National Library of Energy BETA

Sample records for br ush cr

  1. Performance of LiAlloy/Ag(2)CrO(4) Couples in Molten CsBr-LiBr-KBr Eutectic

    SciTech Connect (OSTI)

    GUIDOTTI,RONALD A.; REINHARDT,FREDERICK W.

    1999-10-18

    The performance of Li-alloy/CsBr-LiBr-KBr/Ag{sub 2}CrO{sub 4} systems was studied over a temperature range of 250 C to 300 C, for possible use as a power source for geothermal borehole applications. Single cells were discharged at current densities of 15.8 and 32.6 mA/cm{sup 2} using Li-Si and Li-Al anodes. When tested in 5-cell batteries, the Li-Si/CsBr-LiBr-KBr/Ag{sub 2}CrO{sub 4} system exhibited thermal runaway. Thermal analytical tests showed that the Ag{sub 2}CrO{sub 4} cathode reacted exothermically with the electrolyte on activation. Consequently, this system would not be practical for the envisioned geothermal borehole applications.

  2. br Owner br Facility br Type br Capacity br MW br Commercial...

    Open Energy Info (EERE)

    Owner br Facility br Type br Capacity br MW br Commercial br Online br Date br Geothermal br Area br Geothermal br Region Coordinates Ahuachapan Geothermal Power Plant LaGeo SA de...

  3. High field magnetotransport and point contact Andreev reflection measurements on CuCr{sub 2}Se{sub 4} and CuCr{sub 2}Se{sub 3}BrDegenerate magnetic semiconductor single crystals

    SciTech Connect (OSTI)

    Borisov, K. Coey, J. M. D.; Stamenov, P.; Alaria, J.

    2014-05-07

    Single crystals of the metallically degenerate fully magnetic semiconductors CuCr{sub 2}Se{sub 4} and CuCr{sub 2}Se{sub 3}Br have been prepared by the Chemical Vapour Transport method, using either Se or Br as transport agents. The high-quality, millimetre-sized, octahedrally faceted, needle- and platelet-shaped crystals are characterised by means of high field magnetotransport (?{sub 0}H? 14?T) and Point Contact Andreev Reflection. The relatively high spin polarisation observed |P|>0.56, together with the relatively low minority carrier effective mass of 0.25 m{sub e}, and long scattering time 10{sup ?13}?s, could poise these materials for integration in low- and close-to-room temperature minority injection bipolar heterojunction transistor demonstrations.

  4. Jatropha BR | Open Energy Information

    Open Energy Info (EERE)

    BR Jump to: navigation, search Name: Jatropha BR Place: Brazil Product: Brazilian-based consortium of five leading Brazilian companies engaged in the integrated jatropha curcas...

  5. Photoelectron Emission Studies in CsBr at 257 nm

    SciTech Connect (OSTI)

    Maldonado, Juan R.; Liu, Zhi; Sun, Yun; Pianetta, Piero A.; Pease, Fabian W.; /Stanford U., Elect. Eng. Dept. /SLAC, SSRL

    2006-09-28

    CsBr/Cr photocathodes were found [1,2] to meet the requirements of a multi-electron beam lithography system operating with a light energy of 4.8 eV (257nm). The fact that photoemission was observed with a light energy below the reported 7.3 eV band gap for CsBr was not understood. This paper presents experimental results on the presence of intra-band gap absorption sites (IBAS) in CsBr thin film photo electron emitters, and presents a model based on IBAS to explain the observed photoelectron emission behavior at energies below band gap. A fluorescence band centered at 330 nm with a FWHM of about 0.34 eV was observed in CsBr/Cr samples under 257 nm laser illumination which can be attributed to IBAS and agrees well with previously obtained synchrotron photoelectron spectra[1] from the valence band of CsBr films.

  6. Photoinduced Br Desorption from CsBr Thin Films Grown on Cu(100)

    SciTech Connect (OSTI)

    Halliday, Matthew T.; Joly, Alan G.; Hess, Wayne P.; Shluger, AL

    2015-10-22

    Thin films of CsBr deposited onto metals such as copper are potential photocathode materials for light sources and other applications. We investigate desorption dynamics of Br atoms from CsBr films grown on insulator (KBr, LiF) and metal (Cu) substrates induced by sub-bandgap 6.4 eV laser pulses. The experimental results demonstrate that the peak kinetic energy of Br atoms desorbed from CsBr/Cu films is much lower than that for the hyperthermal desorption from CsBr/LiF films. Kelvin probe measurements indicate negative charge at the surface following Br desorption from CsBr/Cu films. Our ab initio calculations of excitons at CsBr surfaces demonstrate that this behavior can be explained by an exciton model of desorption including electron trapping at the CsBr surface. Trapped negative charges reduce the energy of surface excitons available for Br desorption. We examine the electron-trapping characteristics of low-coordinated sites at the surface, in particular, divacancies and kink sites. We also provide a model of cation desorption caused by Franck-Hertz excitation of F centers at the surface in the course of irradiation of CsBr/Cu films. These results provide new insights into the mechanisms of photoinduced structural evolution of alkali halide films on metal substrates and activation of metal photocathodes coated with CsBr.

  7. Materials Data on CrBrO (SG:59) by Materials Project

    DOE Data Explorer [Office of Scientific and Technical Information (OSTI)]

    Kristin Persson

    2014-11-02

    Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

  8. X-ray absorption studies of mixed salt polymer electrolytes: ZnBr{sub 2}/CaBr{sub 2}-PEO, ZnBr{sub 2}/LiBr-PEO, and ZnBr{sub 2}/RbBr-PEO complexes

    SciTech Connect (OSTI)

    McBreen, J.; Yang, X.Q.; Lee, H.S.; Okamoto, Y.

    1995-02-01

    Polyethylene oxide (PEO)-salt systems are an important new class of electrolytes that are being considered for many uses. X-ray absorption (XAS) studies of ZnBr{sub 2}-PEO complexes, at the Zn K edge, at temperatures between 25 and 120 C, indicate that additions of bromide salts of Li, Rb, or Ca result in the formation of ZnBr{sub 4}{sup {minus} 2} complexes with a Zn-Br bond length of 2.42 {angstrom}. XAS, at the Rb K edge, in mixed RbBr/ZnBr{sub 2}-PEO complexes with an excess of ZnBr{sub 2}, shows that the ZnBr{sub 2} causes the RbBr to dissolve in the polymer. The Rb{sup +} ions are weakly complexed with the PEO with an Rb-O bond distance of 2.93 {angstrom}.

  9. High energy XeBr electric discharge laser

    DOE Patents [OSTI]

    Sze, Robert C.; Scott, Peter B.

    1981-01-01

    A high energy XeBr laser for producing coherent radiation at 282 nm. The XeBr laser utilizes an electric discharge as the excitation source to minimize formation of molecular ions thereby minimizing absorption of laser radiation by the active medium. Additionally, HBr is used as the halogen donor which undergoes harpooning reactions with Xe.sub.M * to form XeBr*.

  10. High energy XeBr electric discharge laser

    DOE Patents [OSTI]

    Sze, R.C.; Scott, P.B.

    A high energy XeBr laser for producing coherent radiation at 282 nm is disclosed. The XeBr laser utilizes an electric discharge as the excitation source to minimize formation of molecular ions thereby minimizing absorption of laser radiation by the active medium. Additionally, HBr, is used as the halogen donor which undergoes harpooning reactions with Xe/sub M/ to form XeBr.

  11. GLADY CASSIT Y VANDALIA MURPHY CR EEK BU CKHN-CENT URY CLAY

    U.S. Energy Information Administration (EIA) Indexed Site

    GLADY CASSIT Y VANDALIA MURPHY CR EEK BU CKHN-CENT URY CLAY GLENVILLE N MINNORA JARVISVILLE FAR MINGTON PH ILIPPI BELIN GT ON WAYN ESBUR G PR UNT Y GLENVILLE S CAVE RUN TAYLOR DRAIN ROSEDALE ST MPT-N RMNT-SHK WESTON-JAN E LEW SWN DL-WID EN VADIS STANL EY DEKALB UNION TALLM AN SVILL E ASPINALL-FIN ST ER ZOLLARSVILLE WILBU R RAMSEY HEATER S BR IDGEPORT-PRUNT YTOWN ALEXAND ER LILLY FORK SH ERMAN HIRAM ST FK-BLST N CK BU RNS CH APEL S BR WN -LUM BER PORT CON INGS PR ATT BOSWELL REVEL ELK C REEK

  12. Improved production of Br atoms near zero speed by photodissociating laser aligned Br{sub 2} molecules

    SciTech Connect (OSTI)

    Deng, L. Z., E-mail: lzdeng@phy.ecnu.edu.cn; Yin, J. P., E-mail: jpyin@phy.ecnu.edu.cn [State Key Laboratory of Precision Spectroscopy, Department of Physics, East China Normal University, Shanghai 200062 (China)

    2014-10-28

    We theoretically investigated the improvement on the production rate of the decelerated bromine (Br) atoms near zero speed by photodissociating laser aligned Br{sub 2} precursors. Adiabatic alignment of Br{sub 2} precursors exposed to long laser pulses with duration on the order of nanoseconds was investigated by solving the time-dependent Schrdinger equation. The dynamical fragmentation of adiabatically aligned Br{sub 2} precursors was simulated and velocity distribution of the Br atoms produced was analyzed. Our study shows that the larger the degree of the precursor alignment, ?cos{sup 2}???, the higher the production rate of the decelerated Br atoms near zero speed. For Br{sub 2} molecules with an initial rotational temperature of ?1 K, a ?cos{sup 2}??? value of ?0.88 can result in an improvement factor of over ?20 on the production rate of the decelerated Br atoms near zero speed, requiring a laser intensity of only ?1 10{sup 12} W/cm{sup 2} for alignment.

  13. Preliminary upper limit on BR(D{sup {+-}}{r_arrow}{pi}{sup {...

    Office of Scientific and Technical Information (OSTI)

    Preliminary upper limit on BR(Dsup +-rarrowpisup +-musup +musup -) Citation Details In-Document Search Title: Preliminary upper limit on BR(Dsup ...

  14. Ca2+-Doped CeBr3 Scintillating Materials

    SciTech Connect (OSTI)

    Guss, Paul; Foster, Michael E.; Wong, Bryan M.; Doty, F. Patrick; Shah, Kanai; Squillante, Michael R.; Shirwadkar, Urmila; Hawrami, Rastgo; Tower, Josh; Yuan, Ding

    2014-01-21

    Despite the outstanding scintillation performance characteristics of cerium tribromide (CeBr3) and cerium-activated lanthanum tribromide, their commercial availability and application are limited due to the difficulties of growing large, crack-free single crystals from these fragile materials. This investigation employed aliovalent doping to increase crystal strength while maintaining the optical properties of the crystal. One divalent dopant (Ca2+) was used as a dopant to strengthen CeBr3 without negatively impacting scintillation performance. Ingots containing nominal concentrations of 1.9% of the Ca2+ dopant were grown. Preliminary scintillation measurements are presented for this aliovalently doped scintillator. Ca2+-doped CeBr3 exhibited little or no change in the peak fluorescence emission for 371 nm optical excitation for CeBr3. The structural, electronic, and optical properties of CeBr3 crystals were studied using the density functional theory within the generalized gradient approximation. The calculated lattice parameters are in good agreement with the experimental data. The energy band structures and density of states were obtained. The optical properties of CeBr3, including the dielectric function, were calculated.

  15. Microsoft Word - CR.doc

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    in XAS studies a. Porewater Na and Nitrate b. Water Extractable and Sorbed Cr c. In-situ Temperature Depth Below Ground Surface (m) Figure 1. Solute concentration profiles in core...

  16. Decommissioning of the BR3 reactor: status and perspectives

    SciTech Connect (OSTI)

    Noynaert, L.; Verstraeten, I.

    2007-07-01

    The BR3 plant at Mol in Belgium built at the end of the fifties was the first PWR plant built outside the USA. The reactor had a small net power output (10 MWe) but comprised all the loops and features of a commercial PWR plant. The BR3 plant was operated with the main objective of testing advanced PWR fuels under irradiation conditions similar to those encountered in large commercial PWR plants. The reactor was started in 1962 and shut down in 1987 after 25 years of continuous operation. Since 1989, SCK.CEN is decommissioning the BR3 PWR research reactor. The dismantling of the metallic components including reactor pressure vessel and internals is completed and extensively reported in the literature. The dismantling of auxiliary components and the decontamination of parts of the infrastructure are now going on. The decommissioning progress is continuously monitored and costs and strategy are regularly reassessed. The first part of the paper describes the main results and lessons learned from the reassessment exercises performed in 1994, 1999, 2004 and 2007. Impacts of changes in legal framework on the decommissioning costs will be addressed. These changes concern e.g. licensing aspects, clearance levels, waste management... The middle part of the paper discusses the management of activated and/or contaminated concrete. The costing exercise performed in 1995 highlighted that the management of activated and contaminated concrete is the second main cost item after the dismantling of the reactor pressure vessel and internals. Different possible solutions were studied. These are evacuation as radioactive waste with or without supercompaction, recycling this 'radioactive' grout or concrete for conditioning of radioactive waste e.g. conditioning of metallic waste. The paper will give the results of the cost-benefit analysis made to select the solution retained. The last part of the paper will discuss the end goal of the decommissioning of the BR3. In the final decommissioning plan approved by ONDRAF/NIRAS, it was mentioned that the final goal of the BR3 decommissioning will be the 'green field' unless opportunities for reuse of the BR3 site will occur during decommissioning. A strategy of partial reuse of the BR3 facility is proposed and being discussed with the main stakeholders. The paper will give the present state of the discussion. (authors)

  17. A preliminary report on the photoionization efficiency spectrum, ionization energy and heat of formation of Br{sub 2}O; and the appearance energy of BrO{sup +} (Br{sub 2}O)

    SciTech Connect (OSTI)

    Thorn, R.P. Jr.; Monks, P.S.; Stief, L.J.; Kuo, S.C.; Zhang, Z.; Klemm, R.B.

    1995-08-01

    We report experimental results for the photoionization efficiency (PIE) spectrum of Br{sub 2}O along with the ionization energy (derived form the ionization threshold) and the appearance energy (AE) of BrO{sup +} (Br{sub 2}O). A value for the heat of formation of Br{sub 2}O is derived form the AE result. Experiments were performed by employing a discharge flow-photoionization mass spectrometer (DF-PIMS) apparatus coupled to beamline U-11 at the National Synchrotron Light Source (NSLS) at Brookhaven National Laboratory.

  18. High gradient rf gun studies of CsBr photocathodes

    SciTech Connect (OSTI)

    Vecchione, Theodore; Maldonado, Juan R.; Gierman, Stephen; Corbett, Jeff; Hartmann, Nick; Pianetta, Piero A.; Hesselink, Lambertus; Schmerge, John F.

    2015-04-03

    CsBr photocathodes have 10 times higher quantum efficiency with only 3 times larger intrinsic transverse emittance than copper. They are robust and can withstand 80 MV/m fields without breaking down or emitting dark current. They can operate in 210?? torr vacuum and survive exposure to air. They are well suited for generating high pulse charge in rf guns without a photocathode transfer system.

  19. High gradient rf gun studies of CsBr photocathodes

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Vecchione, Theodore; Maldonado, Juan R.; Gierman, Stephen; Corbett, Jeff; Hartmann, Nick; Pianetta, Piero A.; Hesselink, Lambertus; Schmerge, John F.

    2015-04-03

    CsBr photocathodes have 10 times higher quantum efficiency with only 3 times larger intrinsic transverse emittance than copper. They are robust and can withstand 80 MV/m fields without breaking down or emitting dark current. They can operate in 2×10⁻⁹ torr vacuum and survive exposure to air. They are well suited for generating high pulse charge in rf guns without a photocathode transfer system.

  20. AmeriFlux BR-Sa3 Santarem-Km83-Logged Forest

    DOE Data Explorer [Office of Scientific and Technical Information (OSTI)]

    Goulden, Mike [University of California - Irvine

    2016-01-01

    This is the AmeriFlux version of the carbon flux data for the site BR-Sa3 Santarem-Km83-Logged Forest. Site Description - Cleared forest. Logged site is near km 83 along BR-183.

  1. Guide to Developing Air-Cooled Lithium Bromide (LiBr) Absorption...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Guide to Developing Air-Cooled Lithium Bromide (LiBr) Absorption for CHP Applications, April 2005 Guide to Developing Air-Cooled Lithium Bromide (LiBr) Absorption for CHP...

  2. Improved Growth Methods for LaBr3 Scintillation Radiation Detectors

    SciTech Connect (OSTI)

    McGregor, Douglas S

    2011-05-01

    The objective is to develop advanced materials for deployment as high-resolution gamma ray detectors. Both LaBr3 and CeBr3 are advanced scintillation materials, and will be studied in this research. Prototype devices, in collaboration Sandia National Laboratories, will be demonstrated along with recommendations for mass production and deployment. It is anticipated that improved methods of crystal growth will yield larger single crystals of LaBr3 for deployable room-temperature operated gamma radiation spectrometers. The growth methods will be characterized. The LaBr3 and CeBr3 scintillation crystals will be characterized for light yield, spectral resolution, and for hardness.

  3. Natural Organobromine in Marine Sediments: New Evidence of Biogeochemical Br Cycling

    SciTech Connect (OSTI)

    A Leri; J Hakala; M Marcus; A Lanzirotti; C Reddy; S Myneni

    2011-12-31

    Organobromine (Br{sub org}) compounds, commonly recognized as persistent, toxic anthropogenic pollutants, are also produced naturally in terrestrial and marine systems. Several enzymatic and abiotic bromination mechanisms have been identified, as well as an array of natural Br{sub org} molecules associated with various marine organisms. The fate of the carbon-bromine functionality in the marine environment, however, remains largely unexplored. Oceanographic studies have noted an association between bromine (Br) and organic carbon (C{sub org}) in marine sediments. Even so, there has been no direct chemical evidence that Br in the sediments exists in a stable form apart from inorganic bromide (Br{sub inorg}), which is widely presumed conservative in marine systems. To investigate the scope of natural Br{sub org} production and its fate in the environment, we probed Br distribution and speciation in estuarine and marine sediments using in situ X-ray spectroscopy and spectromicroscopy. We show that Br{sub org} is ubiquitous throughout diverse sedimentary environments, occurring in correlation with C{sub org} and metals such as Fe, Ca, and Zn. Analysis of sinking particulate carbon from the seawater column links the Br{sub org} observed in sediments to biologically produced Br{sub org} compounds that persist through humification of natural organic matter (NOM). Br speciation varies with sediment depth, revealing biogeochemical cycling of Br between organic and inorganic forms as part of the burial and degradation of NOM. These findings illuminate the chemistry behind the association of Br with Corg in marine sediments and cast doubt on the paradigmatic classification of Br as a conservative element in seawater systems.

  4. Novel visible-light AgBr/Ag?PO? hybrids photocatalysts with surface plasma resonance effects

    SciTech Connect (OSTI)

    Wang, Yunfang Li, Xiuli; Wang, Yawen; Fan, Caimei

    2013-06-01

    Three kinds of AgBr/Ag?PO? hybrids were synthesised via an anion-exchange precipitation method and characterised by XRD, XPS, SEM, EDS, and UVvis. The results showed that AgBr/Ag?PO? hybrids displayed much higher photocatalytic activities than single Ag?PO? or AgBr under visible light (?>420 nm), and OH and h? were the major active species during the degradation process. Considering interstitial ions Ag?? on lattice gap of AgBr are easy to become sliver particle, we deduced the possible photocatalytic mechanism could be ascribed to the synergistic effects of the appropriate valence band position of Ag?PO? and AgBr, surface plasmon resonance effect of Ag?, reactive radical species Br?, and the Ag vacancy on the surface of catalysts. - Graphical abstract: The optical absorption and structural morphology of the as-prepared AgBr@Ag?PO? photocatalyst using an anion-exchange precipitation method are conductive to the photocatalytic degradation of organics in water. Highlights: Novel AgBr/Ag?PO? hybrids are synthesised by a facile method. AgBr/Ag?PO? hybrids show excellent photocatalytic activities under visible light. Interstitial ions are in favour of the formation of Ag particle. Surface plasmon resonance effect plays a key factor for light absorption. The photocatalytic mechanism for AgBr/Ag?PO? hybrids is studied.

  5. Process for depositing Cr-bearing layer

    DOE Patents [OSTI]

    Ellis, Timothy W.; Lograsso, Thomas A.; Eshelman, Mark A.

    1995-05-09

    A method of applying a Cr-bearing layer to a substrate, comprises introducing an organometallic compound, in vapor or solid powder form entrained in a carrier gas to a plasma of an inductively coupled plasma torch or device to thermally decompose the organometallic compound and contacting the plasma and the substrate to be coated so as to deposit the Cr-bearing layer on the substrate. A metallic Cr, Cr alloy or Cr compound such as chromium oxide, nitride and carbide can be provided on the substrate. Typically, the organometallic compound is introduced to an inductively coupled plasma torch that is disposed in ambient air so to thermally decompose the organometallic compound in the plasma. The plasma is directed at the substrate to deposit the Cr-bearing layer or coating on the substrate.

  6. Process for depositing Cr-bearing layer

    DOE Patents [OSTI]

    Ellis, T.W.; Lograsso, T.A.; Eshelman, M.A.

    1995-05-09

    A method of applying a Cr-bearing layer to a substrate, comprises introducing an organometallic compound, in vapor or solid powder form entrained in a carrier gas to a plasma of an inductively coupled plasma torch or device to thermally decompose the organometallic compound and contacting the plasma and the substrate to be coated so as to deposit the Cr-bearing layer on the substrate. A metallic Cr, Cr alloy or Cr compound such as chromium oxide, nitride and carbide can be provided on the substrate. Typically, the organometallic compound is introduced to an inductively coupled plasma torch that is disposed in ambient air so to thermally decompose the organometallic compound in the plasma. The plasma is directed at the substrate to deposit the Cr-bearing layer or coating on the substrate. 7 figs.

  7. Nucleation of Cr precipitates in Fe-Cr alloy under irradiation

    SciTech Connect (OSTI)

    Dai, Y. Y.; Ao, L.; Sun, Qing- Qiang; Yang, L.; Nie, JL; Peng, SM; Long, XG; Zhou, X. S.; Zu, Xiaotao; Liu, L.; Sun, Xin; Terentyev, Dimtry; Gao, Fei

    2015-04-01

    The nucleation of Cr precipitates induced by overlapping of displacement cascades in Fe-Cr alloys has been investigated using the combination of molecular dynamics (MD) and Metropolis Monte Carlo (MMC) simulations. The results reveal that the number of Frenkel pairs increases with the increasing of overlapped cascades. Overlapping cascades could promote the formation of Cr precipitates in Fe-Cr alloys, as analyzed using short range order (SRO) parameters to quantify the degree of ordering and clustering of Cr atoms. In addition, the simulations using MMC approach show that the presence of small Cr clusters and vacancy clusters formed within cascade overlapped region enhance the nucleation of Cr precipitates, leading to the formation of large Cr dilute precipitates.

  8. Apparatus for improving the working time of the XeBr laser

    DOE Patents [OSTI]

    Sander, R.K.; Balog, G.; Seegmiller, E.T.

    1980-03-04

    In XeBr lasers which make use of HBr as the source of bromine, it has been found that the working life of the laser is limited because of dissociation of the HBr in the lasing region to form H/sub 2/ and Br/sub 2/. Accordingly, apparatus is disclosed for substantially improving the working time of the XeBr laser wherein means are provided for recombining H/sub 2/ and Br/sub 2/ into HBr and for continuously circulating the gaseous working medium from the lasing region through the recombination region.

  9. Apparatus for improving the working time of the XeBr laser

    DOE Patents [OSTI]

    Sander, Robert K.; Balog, George; Seegmiller, Emma T.

    1982-01-01

    In XeBr lasers which make use of HBr as the source of bromine, it has been found that the working life of the laser is limited because of dissociation of the HBr in the lasing region to form H.sub.2 and Br.sub.2. Accordingly, apparatus is disclosed for substantially improving the working time of the XeBr laser wherein means are provided for recombining H.sub.2 and Br.sub.2 into HBr and for continuously circulating the gaseous working medium from the lasing region through the recombination region. BACKGROUND OF THE INVENTION

  10. X-ray photoemission analysis of chemically modified TlBr surfaces for improved radiation detectors

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Nelson, A. J.; Voss, L. F.; Beck, P. R.; Graff, R. T.; Conway, A. M.; Nikolic, R. J.; Payne, S. A.; Lee, J. -S.; Kim, H.; Cirignano, L.; et al

    2013-01-12

    We subjected device-grade TlBr to various chemical treatments used in room temperature radiation detector fabrication to determine the resulting surface composition and electronic structure. As-polished TlBr was treated separately with HCl, SOCl2, Br:MeOH and HF solutions. High-resolution photoemission measurements on the valence band electronic structure and Tl 4f, Br 3d, Cl 2p and S 2p core lines were used to evaluate surface chemistry and shallow heterojunction formation. Surface chemistry and valence band electronic structure were correlated with the goal of optimizing the long-term stability and radiation response.

  11. Structural analysis of Cr aggregation in ferromagnetic semiconductor (Zn,Cr)Te

    SciTech Connect (OSTI)

    Kobayashi, H.; Yamawaki, K.; Nishio, Y.; Kanazawa, K.; Kuroda, S.; Mitome, M.; Bando, Y.

    2013-12-04

    The Cr aggregation in a ferromagnetic semiconductor (Zn,Cr)Te was studied by performing precise analyses using TEM and XRD of microscopic structure of the Cr-aggregated regions formed in iodine-doped Zn{sub 1?x}Cr{sub x}Te films with a relatively high Cr composition x ? 0.2. It was found that the Cr-aggregated regions are composed of Cr{sub 1??}Te nanocrystals of the hexagonal structure and these hexagonal precipitates are stacked preferentially on the (111)A plane of the zinc-blende (ZB) structure of the host ZnTe crystal with its c-axis nearly parallel to the (111){sub ZB} plane.

  12. Results for aliovalent doping of CeBr{sub 3} with Ca{sup 2+}

    SciTech Connect (OSTI)

    Guss, Paul; Foster, Michael E.; Wong, Bryan M.; Patrick Doty, F.; Shah, Kanai; Squillante, Michael R.; Shirwadkar, Urmila; Hawrami, Rastgo; Tower, Joshua; Yuan, Ding

    2014-01-21

    Despite the outstanding scintillation performance characteristics of cerium tribromide (CeBr{sub 3}) and cerium-activated lanthanum tribromide, their commercial availability and application are limited due to the difficulties of growing large, crack-free single crystals from these fragile materials. This investigation employed aliovalent doping to increase crystal strength while maintaining the optical properties of the crystal. One divalent dopant (Ca{sup 2+}) was used as a dopant to strengthen CeBr{sub 3} without negatively impacting scintillation performance. Ingots containing nominal concentrations of 1.9% of the Ca{sup 2+} dopant were grown, i.e., 1.9% of the CeBr{sub 3} molecules were replaced by CaBr{sub 2} molecules, to match our target replacement of 1 out of 54 cerium atoms be replaced by a calcium atom. Precisely the mixture was composed of 2.26 g of CaBr{sub 2} added to 222.14 g of CeBr{sub 3}. Preliminary scintillation measurements are presented for this aliovalently doped scintillator. Ca{sup 2+}-doped CeBr{sub 3} exhibited little or no change in the peak fluorescence emission for 371?nm optical excitation for CeBr{sub 3}. The structural, electronic, and optical properties of CeBr{sub 3} crystals were studied using the density functional theory within the generalized gradient approximation. Calculated lattice parameters are in agreement with the experimental data. The energy band structures and density of states were obtained. The optical properties of CeBr{sub 3}, including the dielectric function, were calculated.

  13. Characterization of the LiSi/CsBr-LiBr-KBr/FeS(2) System for Potential Use as a Geothermal Borehole Power Source

    SciTech Connect (OSTI)

    GUIDOTTI, RONALD A.; REINHARDT, FREDERICK W.

    1999-10-18

    We are continuing to study the suitability of modified thermal-battery technology as a potential power source for geothermal borehole applications. Previous work focused on the LiSi/FeS{sub 2} couple over a temperature range of 350 C to 400 C with the LiBr-KBr-LiF eutectic, which melts at 324.5 C. In this work, the discharge processes that take place in LiSi/CsBr-LiBr-KBr eutectic/FeS{sub 2} thermal cells were studied at temperatures between 250 C and 400 C using pelletized cells with immobilized electrolyte. The CsBr-LiBr-KBr eutectic was selected because of its lower melting point (228.5 C). Incorporation of a quasi-reference electrode allowed the determination of the relative contribution of each electrode to the overall cell polarization. The results of single-cell tests and limited battery tests are presented, along with preliminary data for battery stacks tested in a simulated geothermal borehole environment.

  14. Studies on Ca2+-Doped CeBr3 Scintillating Materials

    SciTech Connect (OSTI)

    Guss, P. [NSTec; Foster, M. E. [SNL; Wong, B. M. [SNL; Doty, F. P. [SNL; Shah, K. [RMD; Squillante, M. [RMD; Glodo, J. [RMD; Yuan, D. [NSTec

    2013-07-03

    Despite the outstanding scintillation performance characteristics of cerium tribromide (CeBr3) and cerium-activated lanthanum tribromide (LaBr3:Ce), their commercial availability and application is limited due to the difficulties of growing large, crack-free single crystals from these fragile materials. The objective of this investigation was to employ aliovalent doping to increase crystal strength while maintaining the optical properties of the crystal. One divalent dopant (Ca2+) was investigated as a dopant to strengthen CeBr3 without negatively impacting scintillation performance. Ingots containing nominal concentrations of 1.9% of the Ca2+ dopant were grown. Preliminary scintillation measurements are presented for this aliovalently doped scintillator. Ca2+-doped CeBr3 exhibited little or no change in the peak fluorescence emission for 371 nm optical excitation for CeBr3. The structural, electronic, and optical properties of CeBr3 crystals were investigated using the density functional theory within generalized gradient approximation. The calculated lattice parameters are in good agreement with the experimental data. The energy band structures and density of states were obtained. The optical properties of CeBr3, including the dielectric function, were calculated.

  15. Midea: ENERGY STAR Referral (MWF-08CR)

    Broader source: Energy.gov [DOE]

    DOE referred the matter of Westpointe-brand room air conditioner model MWF-08CR to the EPA for appropriate action after DOE testing showed that the model does not meet the ENERGY STAR specification.

  16. Emerson: ENERGY STAR Referral (CR289E)

    Broader source: Energy.gov [DOE]

    DOE referred the matter of Emerson-brand refrigerator, model CR289E, to the EPA for appropriate action after DOE testing showed that the model does not meet the ENERGY STAR specification.

  17. Structure and properties of electronic and hole centers in CsBr from theoretical calculations

    SciTech Connect (OSTI)

    Halliday, Matthew T.; Hess, Wayne P.; Shluger, Alexander L.

    2015-06-24

    The electronic structure, geometry, diffusion barriers and optical properties of fundamental defects of CsBr are calculated using hybrid functional DFT and TD- DFT methods. The B3LYP functional with a modified exchange contribution has been used in an embedded cluster scheme to model the structure and spectroscopic properties of self-trapped triplet exciton, interstitial Br atoms and ions, self-trapped holes and Br vacancies. The calculated migration barriers and positions of maxima of optical absorption bands are in good agreement with experiment, justifying the obtained defect geometries. The o*-center triplet exciton luminescence energy is also accurately calculated.

  18. Guide to Developing Air-Cooled Lithium Bromide (LiBr) Absorption for CHP

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Applications, April 2005 | Department of Energy Developing Air-Cooled Lithium Bromide (LiBr) Absorption for CHP Applications, April 2005 Guide to Developing Air-Cooled Lithium Bromide (LiBr) Absorption for CHP Applications, April 2005 The objective of this paper is to summarize the development status of air-cooled lithium bromide (LiBr)-water absorption chillers to guide future efforts to develop chillers for combined heat and power (CHP) applications in light-commercial buildings. The key

  19. Measurement of the Ratio of Branching Fractions Br(Bs -> Ds- pi+)/Br(B -> D- pi+) at CDF-II

    SciTech Connect (OSTI)

    Furic, Ivan Kresimir; /MIT

    2004-03-01

    The measurement of B{sub s}{sup 0} mixing is one of the flagship analyses for the Run II B physics program. The sensitivity of the measurement to the frequency of B{sub s}{sup 0} oscillations strongly depends on the number of reconstructed B{sub s}{sup 0} mesons. They present the measurement of the ratio of branching fractions Br(B{sub s}{sup 0} {yields} D{sub s}{sup -}{pi}{sup +})/Br(B{sup 0} {yields} D{sup -}{pi}{sup +}), which directly influences the number of B{sub s}{sup 0} events available for the measurement of B{sub s}{sup 0} mixing at CDF-II. They analyze 115 pb{sup -1} of data collected with the CDF-II detector in p{bar p} collisions at {radical}s = 1.96 TeV using a novel displaced track trigger. They reconstruct 78 {+-} 11 B{sub s}{sup 0} {yields} D{sub s}{sup -}{pi}{sup +} decays at 1153 {+-} 45 B{sup 0} {yields} D{sup -}{pi}{sup +} decays with good signal to background ratio. This is the world's largest sample of fully reconstructed B{sub s}{sup 0} {yields} D{sub s}{sup -}{pi}{sup +} decays. They find the ratio of production fractions multiplied by the ratio of branching fractions to be: f{sub s}/f{sub d} {center_dot} Br(B{sub s}{sup 0} {yields} D{sub s}{sup -}{pi}{sup +})/Br(B{sup 0} {yields} D{sup -}{pi}{sup +}) = 0.325 {+-} 0.046(stat) {+-} 0.034(syst) {+-} 0.084 (BR). Using the world average value of f{sub s}/f{sub d} = 0.26 {+-} 0.03, we infer that the ratio of branching fractions is: Br(B{sub s}{sup 0} {yields} D{sub s}{sup -}{pi}{sup +})/Br(B{sup 0} {yields} D{sup -}{pi}{sup +}) = 1.25 {+-} 0.18(stat) {+-} 0.13(syst) {+-} 0.32(BR) {+-} 0.14(PR) where the last uncertainty is due to the uncertainty on the world average measurement of the ratio of B{sub s}{sup 0} to B{sup 0} production rates, f{sub s}/f{sub d}.

  20. LAKESHORE AVON BR ANT-EDEN ALD EN-LANC ASTER AU BURN W SH ELDON

    U.S. Energy Information Administration (EIA) Indexed Site

    81 81 LAKESHORE AVON BR ANT-EDEN ALD EN-LANC ASTER AU BURN W SH ELDON CALEDONIA HURON C REEK LEIC EST ER COL DEN ASH FORD INDIAN FALLS LAWTONS SAR DINIA RPD-037 -2 ...

  1. Measurement of BR(Bu to phi K)/BR(Bu to J/psi K) at the collider detector at Fermilab

    SciTech Connect (OSTI)

    Napora, Robert A

    2004-10-01

    This thesis presents evidence for the decay mode B{sup {+-}} {yields} {phi}K{sup {+-}} in p{bar p} collisions at {radical}s = 1.96 TeV using (120 {+-} 7)pb{sup -1} of data collected by the Collider Detector at Fermilab (CDF). This signal is then used to measure the branching ratio relative to the decay mode B{sup {+-}} {yields} J/{psi}K{sup {+-}}. The measurement starts from reconstructing the two decay modes: B{sup {+-}} {yields} {phi}K{sup {+-}}, where {phi} {yields} K{sup +}K{sup -} and B{sup {+-}} {yields} J/{psi}K{sup {+-}}, where J/{psi} {yields} {mu}{sup +}{mu}{sup -}. The measurement yielded 23 {+-} 7 B{sup {+-}} {yields} {phi}K{sup {+-}} events, and 406 {+-} 26 B{sup {+-}} {yields} J/{psi}K{sup {+-}} events. The fraction of B{sup {+-}} {yields} J/{psi}K{sup {+-}} events where the J/{psi} subsequently decayed to two muons (as opposed to two electrons) was found to be f{sub {mu}{mu}} = 0.839 {+-} 0.066. The relative branching ratio of the two decays is then calculated based on the equation: BR(B{sup {+-}} {yields} {phi}K{sup {+-}})/BR(B{sup {+-}} {yields} J/{psi}K{sup {+-}}) = N{sub {phi}K}/N{sub {psi}K} {center_dot}f{sub {mu}{mu}} BR(J/{psi} {yields} {mu}{sup +}{mu}{sup -})/BR({phi} {yields} K{sup +}K{sup -}) {epsilon}{sub {mu}{mu}}K/{epsilon}KKK R({epsilon}{sub iso}). The measurement finds BR(B{sup {+-}} {yields} {phi}K{sup {+-}})/BR(B{sup {+-}} {yields} J/{psi}K{sup {+-}}) = 0.0068 {+-} 0.0021(stat.) {+-} 0.0007(syst.). The B{sup {+-}} {yields} {phi}K{sup {+-}} branching ratio is then found to be BR(B{sup {+-}} {yields} {phi}K{sup {+-}}) = [6.9 {+-} 2.1(stat.) {+-} 0.8(syst.)] x 10{sup -6}. This value is consistent with similar measurements reported by the e{sup +}e{sup -} collider experiments BaBar[1], Belle[2], and CLEO[3].

  2. Microstructural and mechanical characteristics of Ni–Cr thin films

    SciTech Connect (OSTI)

    Petley, Vijay; Sathishkumar, S.; Thulasi Raman, K.H.; Rao, G.Mohan; Chandrasekhar, U.

    2015-06-15

    Highlights: • Ni–Cr thin films of varied composition deposited by DC magnetron co-sputtering. • Thin film with Ni–Cr: 80–20 at% composition exhibits most distinct behavior. • The films were tensile tested and exhibited no cracking till the substrate yielding. - Abstract: Ni–Cr alloy thin films have been deposited using magnetron co-sputtering technique at room temperature. Crystal structure was evaluated using GIXRD. Ni–Cr solid solution upto 40 at% of Cr exhibited fcc solid solution of Cr in Ni and beyond that it exhibited bcc solid solution of Ni in Cr. X-ray diffraction analysis shows formation of (1 1 1) fiber texture in fcc and (2 2 0) fiber texture in bcc Ni–Cr thin films. Electron microscopy in both in-plane and transverse direction of the film surface revealed the presence of columnar microstructure for films having Cr upto 40 at%. Mechanical properties of the films are evaluated using nanoindentation. The modulus values increased with increase of Cr at% till the film is fcc. With further increase in Cr at% the modulus values decreased. Ni–Cr film with 20 at% Ni exhibits reduction in modulus and is correlated to the poor crystallization of the film as reflected in XRD analysis. The Ni–Cr thin film with 80 at% Ni and 20 at% Cr exhibited the most distinct columnar structure with highest electrical resistivity, indentation hardness and elastic modulus.

  3. Morphology, deformation, and defect structures of TiCr{sub 2} in Ti-Cr alloys

    SciTech Connect (OSTI)

    Chen, K.C.; Allen, S.M.; Livingston, J.D.

    1992-12-31

    The morphologies and defect structures of TiCr{sub 2} in several Ti-Cr alloys have been examined by optical metallography, x-ray diffraction, and transmission electron microscopy (TEM), in order to explore the room-temperature deformability of the Laves phase TiCr{sub 2}. The morphology of the Laves phase was found to be dependent upon alloy composition and annealing temperature. Samples deformed by compression have also been studied using TEM. Comparisons of microstructures before and after deformation suggest an increase in twin, stacking fault, and dislocation density within the Laves phase, indicating some but not extensive room-temperature deformability.

  4. Kinetics and Mechanism of the Hydrogenation of CpCr(CO)3/[CpCr(CO)3]2 Equilibrium to CpCr(CO)3H

    SciTech Connect (OSTI)

    Norton, Jack R.; Spataru, Tudor; Camaioni, Donald M.; Lee, Suh-Jane; Li, Gang; Choi, Jongwook; Franz, James A.

    2014-05-26

    The kinetics of the hydrogenation of 2 CpCr(CO)3/[CpCr(CO)3]2 to CpCr(CO)3H has been investigated. The reaction is second-order in Cr and first-order in H2, with a rate constant of 45 M 2s 1 at 25 C in benzene. DFT calculations rule out an H2 complex as an intermediate, and suggest (a) end-on approach of H2 to one Cr of [CpCr(CO)3]2 as the Cr-Cr bond undergoes heterolytic cleavage, (b) heterolytic cleavage of the coordinated H2 between O and Cr, and (c) isomerization of the resulting O-protonated CpCr(CO)2(COH) to CpCr(CO)3H. The work at Pacific Northwest National Laboratory (PNNL) was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences; Battelle operates PNNL for DOE.

  5. Hazard Evaluation for 244-CR Vault

    SciTech Connect (OSTI)

    GRAMS, W.H.

    1999-08-19

    This document presents the results of a hazards identification and evaluation performed on the 244-CR Vault to close a USQ (USQ No.TF-98-0785, Potential Inadequacy in Authorization Basis (PIAB): To Evaluate Miscellaneous Facilities Listed In HNF-2503 And Not Addressed In The TWRS Authorization Basis) that was generated as part of an evaluation of inactive TWRS facilities.

  6. Attachment I CHPRC CONDITION REPORT FORM Status: Analysis CR NUMBER: CR-2011I 2037

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    CHPRC CONDITION REPORT FORM Status: Analysis CR NUMBER: CR-2011I 2037 Issue Identification and Processing Initiator: Initiating IDetifed Bannister, Roland J Document: 6/23/2011d Title of Issue: Extent of Condition review for S3000 containers Description of Issue: Extent of Condition Review arose from the Causal Analysis regarding the breached drum found in 2404WB on April 26, 2011. The scope of the review was to assess all other known S3000 (homogenous solids) waste streams to identify

  7. Dual-phase Cr-Ta alloys for structural applications

    DOE Patents [OSTI]

    Liu, Chain T.; Brady, Michael P.; Zhu, Jiahong; Tortorelli, Peter F.

    2001-01-01

    Dual phase alloys of chromium containing 2 to 11 atomic percent tantalum with minor amounts of Mo, Cr, Ti, Y, La, Cr, Si and Ge are disclosed. These alloys contain two phases including Laves phase and Cr-rich solid solution in either eutectic structures or dispersed Laves phase particles in the Cr-rich solid solution matrix. The alloys have superior mechanical properties at high temperature and good oxidation resistance when heated to above 1000.degree. C. in air.

  8. Lattice dynamics in perovskite halides CsSn X 3 with X = I , Br , Cl

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | DOE PAGES Lattice dynamics in perovskite halides CsSn X 3 with X = I , Br , Cl « Prev Next » Title: Lattice dynamics in perovskite halides CsSn X 3 with X = I , Br , Cl Authors: Huang, Ling-yi ; Lambrecht, Walter R. L. Publication Date: 2014-11-05 OSTI Identifier: 1180124 Grant/Contract Number: ER 46874-SC0008933 Type: Publisher's Accepted Manuscript Journal Name: Physical Review B Additional Journal Information: Journal Volume: 90; Journal Issue: 19; Journal ID: ISSN

  9. Very fast doped LaBr.sub.3 scintillators and time-of-flight PET

    DOE Patents [OSTI]

    Shah, Kanai S.

    2006-10-31

    The present invention concerns very fast scintillator materials capable of resolving the position of an annihilation event within a portion of a human body cross-section. In one embodiment, the scintillator material comprises LaBr.sub.3 doped with cerium. Particular attention is drawn to LaBr.sub.3 doped with a quantity of Ce that is chosen for improving the timing properties, in particular the rise time and resultant timing resolution of the scintillator, and locational capabilities of the scintillator.

  10. LAKESHORE AVON BR ANT-EDEN ALD EN-LANC ASTER AU BURN W SH ELDON

    U.S. Energy Information Administration (EIA) Indexed Site

    81 § ¨ ¦ 81 LAKESHORE AVON BR ANT-EDEN ALD EN-LANC ASTER AU BURN W SH ELDON CALEDONIA HURON C REEK LEIC EST ER COL DEN ASH FORD INDIAN FALLS LAWTONS SAR DINIA RPD-037 -2 GLENWOOD PU LASKI PAVILION CON CORD COL LINS N ELM A ORC HARD PARK-H AMBU RG DANLEY CORNERS ST ILLWAT ER CHAFF EE-ARCAD E FAYETT E-WATERLOO LAKEVIEW JAVA SEN EC A W ELLER Y AU RORA E ZOAR BU FFALO TIOGA SILVER LAKE AKR ON ROM E RAT HBON E ALM A BET HANY WYOMING ULYSSES BR ANCH W SAN DY CREEK COL LINS BLOOMFIELD E LEBANON

  11. Oxidation/Reduction Reactions at the Metal Contact-TlBr Interface: An X-ray

    Office of Scientific and Technical Information (OSTI)

    Photoelectron Spectroscopy Study (Conference) | SciTech Connect Conference: Oxidation/Reduction Reactions at the Metal Contact-TlBr Interface: An X-ray Photoelectron Spectroscopy Study Citation Details In-Document Search Title: Oxidation/Reduction Reactions at the Metal Contact-TlBr Interface: An X-ray Photoelectron Spectroscopy Study Authors: Nelson, A J ; Swanberg, E L ; Voss, L F ; Graff, R T ; Conway, A M ; Nikolic, R J ; Payne, S A ; Kim, H ; Cirignano, L ; Shah, K Publication Date:

  12. Cr-doped scandium borate laser

    DOE Patents [OSTI]

    Chai, Bruce H.; Lai, Shui T.; Long, Margaret N.

    1989-01-01

    A broadly wavelength-tunable laser is provided which comprises as the laser medium a single crystal of MBO.sub.3 :Cr.sup.3+, where M is selected from the group of Sc, In and Lu. The laser may be operated over a broad temperature range from cryogenic temperatures to elevated temperatures. Emission is in a spectral range from red to infrared, and the laser is useful in the fields of defense, communications, isotope separation, photochemistry, etc.

  13. CALiPER Application Summary Report 16. LED BR30 and R30 Lamps

    SciTech Connect (OSTI)

    none,

    2012-07-01

    This report analyzes the independently tested performance of 13 LED products labeled as BR30 or R30 lamps. The test results indicate substantial improvement versus earlier CALiPER testing of similar products, and performance comparable to recent data from LED Lighting Facts and ENERGY STAR.

  14. Hydrogen for X-group exchange in CH3X, X = Cl, Br, I, OMe and...

    Office of Scientific and Technical Information (OSTI)

    Hydrogen for X-group exchange in CH3X, X Cl, Br, I, OMe and NMe2 byMonomeric 1,2,4-(Me3C)3C5H22CeH: Experimental and Computational Support for a Carbenoid Mechanism Citation ...

  15. Temporal evolution of ion energy distribution functions and ion charge states of Cr and Cr-Al pulsed arc plasmas

    SciTech Connect (OSTI)

    Tanaka, Koichi; Anders, André

    2015-11-15

    To study the temporal evolution of ion energy distribution functions, charge-state-resolved ion energy distribution functions of pulsed arc plasmas from Cr and Cr-Al cathodes were recorded with high time resolution by using direct data acquisition from a combined energy and mass analyzer. The authors find increases in intensities of singly charged ions, which is evidence that charge exchange reactions took place in both Cr and Cr-Al systems. In Cr-Al plasmas, the distributions of high-charge-state ions exhibit high energy tails 50 μs after discharge ignition, but no such tails were observed at 500 μs. The energy ratios of ions of different charge states at the beginning of the pulse, when less neutral atoms were in the space in front of the cathode, suggest that ions are accelerated by an electric field. The situation is not so clear after 50 μs due to particle collisions. The initial mean ion charge state of Cr was about the same in Cr and in Cr-Al plasmas, but it decreased more rapidly in Cr-Al plasmas compared to the decay in Cr plasma. The faster decay of the mean ion charge state and ion energy caused by the addition of Al into a pure Cr cathode suggests that the mean ion charge state is determined not only by ionization processes at the cathode spot but also by inelastic collision between different elements.

  16. Cr segregation at the FeCr surface and the origin of corrosion resistance in ferritic steels

    SciTech Connect (OSTI)

    De Caro, M S; Morse, B; Egiebor, N; Farmer, J; Caro, A

    2008-11-22

    Structural materials in Gen-IV nuclear reactors will face severe conditions of high operating temperatures, high neutron flux exposure, and corrosive environment. Radiation effects and corrosion and chemical compatibility issues are factors that will limit the materials lifetime. Low-chromium (9-12 Cr wt.%) ferritic martensitic (F/M) steels are being considered as possible candidates because they offer good swelling resistance and good mechanical properties under extreme conditions of radiation dose and irradiation temperature. The surface chemistry of FeCr alloys, responsible for the corrosion properties, is complex. It exists today a controversy between equilibrium thermodynamic calculations, which suggest Cr depletion at the surface driven by the higher surface energy of Cr, and experimental data which suggest the oxidation process occurs in two stages, first forming a Fe-rich oxide, followed by a duplex oxide layer, and ending with a Cr-rich oxide. Moreover, it has been shown experimentally that corrosion resistance of F/M steels depends significantly on Cr content, increasing with increasing Cr content and with a threshold around 10% Cr, below which, the alloy behaves as pure Fe. In an attempt to rationalize these two contradicting observations and to understand the physical mechanism behind corrosion resistance in these materials we perform atomistic simulations using our FeCr empirical potential and analyze Cr equilibrium distributions at different compositions and temperatures in single and polycrystalline samples. We analyze the controversy in terms of thermodynamic and kinetic considerations.

  17. Geothermal br Resource br Area Geothermal br Resource br Area...

    Open Energy Info (EERE)

    Aluto Langano Geothermal Area Aluto Langano Geothermal Area East African Rift System Ethiopian Rift Valley Major Normal Fault Basalt MW K Amatitlan Geothermal Area Amatitlan...

  18. Investigation into Nanostructured Lanthanum Halides and CeBr{sub 3} for Nuclear Radiation Detection

    SciTech Connect (OSTI)

    Guss, P., Guise, R., Mukhopadhyay, S., Yuan, D.

    2011-06-22

    This slide-show presents work on radiation detection with nanostructured lanthanum halides and CeBr{sub 3}. The goal is to extend the gamma energy response on both low and high-energy regimes by demonstrating the ability to detect low-energy x-rays and relatively high-energy activation prompt gamma rays simultaneously using the nano-structured lanthanum bromide, lanthanum fluoride, cerium bromide, or other nanocrystal material. Homogeneous and nano structure cases are compared.

  19. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    labor are authorized as direct charges Control : SF 6432-CR Title: Standard Terms & Conditions for Cost Reimbursement Owner: Procurement Policy Department Release Date: 11...

  20. SF6432-CR (02-01-12) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    as direct charges to this contract Control : SF 6432-CR Title: Standard Terms & Conditions for Cost Reimbursement Owner: Procurement Policy & Quality Dept Release Date:...

  1. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    by Part 931 of the DEAR by a Sandia audit. Control : SF 6432-CR Title: Standard Terms & Conditions for Cost Reimbursement Owner: Procurement Policy Department Release Date: 04...

  2. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    ... prior to any attempts to enter a government site as shown ... premises are subject to search. (e) Contractor shall ... SF 6432-CR Title: Standard Terms & Conditions for Cost ...

  3. SF6432-CR (02-01-12) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    ... prior to any attempts to enter a government site as shown ... premises are subject to search. (e) Contractor will ... SF 6432-CR Title: Standard Terms & Conditions for Cost ...

  4. Development of Surface Complexation Models of Cr(VI) Adsorption...

    Office of Scientific and Technical Information (OSTI)

    Cr(VI) Adsorption on Soils, Sediments and Model Mixtures of Kaolinite, Montmorillonite, ... into aquifers and shallow sediments and soils via many anthropogenic activities. ...

  5. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    a Government site to perform work shall have Control : SF 6432-CR Title: Standard Terms & Conditions for Cost Reimbursement Owner: Procurement Policy & Quality Dept Release...

  6. Microsoft Word - chapter FeCrMo_ver2.doc

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Low-Alloy Ferritic Steels Fe-Cr-Mo Tempered December 8, 2005 ... strength level, material processing, and heat treatment 1. ... yield strength, hydrogen gas pressure, and temperature. ...

  7. Optimization of electrode characteristics for the Br-2/H-2 redox flow cell

    SciTech Connect (OSTI)

    Tucker, MC; Cho, KT; Weber, AZ; Lin, GY; Nguyen, TV

    2014-10-17

    The Br-2/H-2 redox flow cell shows promise as a high-power, low-cost energy storage device. The effect of various aspects of material selection, processing, and assembly of electrodes on the operation, performance, and efficiency of the system is determined. In particular, (+) electrode thickness, cell compression, hydrogen pressure, and (-) electrode architecture are investigated. Increasing hydrogen pressure and depositing the (-) catalyst layer on the membrane instead of on the carbon paper backing layers have a large positive impact on performance, enabling a limiting current density above 2 A cm(-2) and a peak power density of 1.4 W cm(-2). Maximum energy efficiency of 79 % is achieved. In addition, the root cause of limiting-current behavior in this system is elucidated, where it is found that Br- reversibly adsorbs at the Pt (-) electrode for potentials exceeding a critical value, and the extent of Br- coverage is potential-dependent. This phenomenon limits maximum cell current density and must be addressed in system modeling and design. These findings are expected to lower system cost and enable higher efficiency.

  8. Optimization of electrode characteristics for the Br?/H? redox flow cell

    SciTech Connect (OSTI)

    Tucker, Michael C.; Cho, Kyu Taek; Weber, Adam Z.; Lin, Guangyu; Van Nguyen, Trung

    2015-01-01

    The Br?/H? redox flow cell shows promise as a high-power, low-cost energy storage device. The effect of various aspects of material selection, processing, and assembly of electrodes on the operation, performance, and efficiency of the system is determined. In particular, (+) electrode thickness, cell compression, hydrogen pressure, and () electrode architecture are investigated. Increasing hydrogen pressure and depositing the () catalyst layer on the membrane instead of on the carbon-paper backing layers have a large positive impact on performance, enabling a limiting current density above 2 A cm-2 and a peak power density of 1.4 W cm-2. Maximum energy efficiency of 79% is achieved. In addition, the root cause of limiting-current behavior in this system is elucidated, where it is found that Br- reversibly adsorbs at the Pt () electrode for potentials exceeding a critical value, and the extent of Br- coverage is potential-dependent. This phenomenon limits maximum cell current density and must be addressed in system modeling and design. These findings are expected to lower system cost and enable higher efficiency.

  9. A modified Stillinger-Weber potential for TlBr and its polymorphic extension

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Zhou, Xiaowang; Foster, Michael E.; Jones, Reese E.; Doty, F. Patrick; Yang, Pin; Fan, Hongyou

    2015-04-30

    TlBr is promising for g- and x- radiation detection, but suffers from rapid performance degradation under the operating external electric fields. To enable molecular dynamics (MD) studies of this degradation, we have developed a Stillinger-Weber type of TlBr interatomic potential. During this process, we have also addressed two problems of wider interests. First, the conventional Stillinger-Weber potential format is only applicable for tetrahedral structures (e.g., diamond-cubic, zinc-blende, or wurtzite). Here we have modified the analytical functions of the Stillinger-Weber potential so that it can now be used for other crystal structures. Second, past modifications of interatomic potentials cannot always bemore » applied by a broad community because any new analytical functions of the potential would require corresponding changes in the molecular dynamics codes. Here we have developed a polymorphic potential model that simultaneously incorporates Stillinger-Weber, Tersoff, embedded-atom method, and any variations (i.e., modified functions) of these potentials. As a result, we have implemented this polymorphic model in MD code LAMMPS, and demonstrated that our TlBr potential enables stable MD simulations under external electric fields.« less

  10. Spin-driven ordering of Cr in the equiatomic high entropy alloy NiFeCrCo

    SciTech Connect (OSTI)

    Niu, C.; Zaddach, A. J.; Oni, A. A.; Sang, X.; LeBeau, J. M.; Koch, C. C.; Irving, D. L.; Hurt, J. W.

    2015-04-20

    Spin-driven ordering of Cr in an equiatomic fcc NiFeCrCo high entropy alloy (HEA) was predicted by first-principles calculations. Ordering of Cr is driven by the reduction in energy realized by surrounding anti-ferromagnetic Cr with ferromagnetic Ni, Fe, and Co in an alloyed L1{sub 2} structure. The fully Cr-ordered alloyed L1{sub 2} phase was predicted to have a magnetic moment that is 36% of that for the magnetically frustrated random solid solution. Three samples were synthesized by milling or casting/annealing. The cast/annealed sample was found to have a low temperature magnetic moment that is 44% of the moment in the milled sample, which is consistent with theoretical predictions for ordering. Scanning transmission electron microscopy measurements were performed and the presence of ordered nano-domains in cast/annealed samples throughout the equiatomic NiFeCrCo HEA was identified.

  11. Response of LaBr{sub 3}(Ce) scintillators to 2.5 MeV fusion neutrons

    SciTech Connect (OSTI)

    Cazzaniga, C.; Nocente, M.; Gorini, G.; Istituto di Fisica del Plasma, Associazione EURATOM-ENEA-CNR, Via Roberto Cozzi 53, Milano 20125 ; Tardocchi, M.; Croci, G.; Giacomelli, L.; Angelone, M.; Pillon, M.; Villari, S.; Weller, A.; Petrizzi, L.; Collaboration: ASDEX Upgrade Team; JET-EFDA Contributors

    2013-12-15

    Measurements of the response of LaBr{sub 3}(Ce) to 2.5 MeV neutrons have been carried out at the Frascati Neutron Generator and at tokamak facilities with deuterium plasmas. The observed spectrum has been interpreted by means of a Monte Carlo model. It is found that the main contributor to the measured response is neutron inelastic scattering on {sup 79}Br, {sup 81}Br, and {sup 139}La. An extrapolation of the count rate response to 14 MeV neutrons from deuterium-tritium plasmas is also presented. The results are of relevance for the design of ?-ray diagnostics of fusion burning plasmas.

  12. Characterization of low-melting electrolytes for potential geothermal borehole power supplies: The LiBr-KBr-LiF eutectic

    SciTech Connect (OSTI)

    Guidotti, R.A.; Reinhardt, F.W.

    1998-05-01

    The suitability of modified thermal-battery technology for use as a potential power source for geothermal borehole applications is under investigation. As a first step, the discharge processes that take place in LiSi/LiBr-KBr-LiF/FeS{sub 2} thermal cells were studied at temperatures of 350 C and 400 C using pelletized cells with immobilized electrolyte. Incorporation of a reference electrode allowed the relative contribution of each electrode to the overall cell polarization to be determined. The results of single-cell tests are presented, along with preliminary data for cells based on a lower-melting CsBr-LiBr-KBr eutectic salt.

  13. Measurement of ratio R = (BR(D{sup 0}{yields}K{pi}{pi}{pi})/BR(D{sup 0}{yields}K{pi})) in {pi}{sup -}-Nucleus interactions at 500 GeV/c

    SciTech Connect (OSTI)

    Solano Salinas, C. J.; Paucarchuco, C.; Fernandez, A.; Sheaff, M.

    2007-10-26

    We report a very preliminary result on the measurement of the ratio of branching ratios, for two decays D{sup 0} meson, R = (BR(D{sup 0}{yields}K{pi}{pi}{pi})/BR(D{sup 0}{yields}K{pi})), using data from the E791 experiment. We find R = 1.96{+-}0.0286 (stat){+-}0.06 (sys). This is in agreement with and of similar precision to the current PDG average value 1.97{+-}0.09.

  14. Magnetic properties and hyperfine interactions in Cr8, Cr7Cd, and Cr7Ni molecular rings from 19F-NMR

    SciTech Connect (OSTI)

    Bordonali, L; Garlatti, E; Casadei, C M; Furukawa, Y; Lascialfari, A; Carretta, S; Troiani, F; Timco, G; Winpenny, R E; Borsa, F

    2014-04-14

    A detailed experimental investigation of the 19F nuclear magnetic resonance is made on single crystals of the homometallic Cr8 antiferromagnetic molecular ring and heterometallic Cr7Cd and Cr7 Ni rings in the low temperature ground state. Since the F? ion is located midway between neighboring magnetic metal ions in the ring, the 19F-NMR spectra yield information about the local electronic spin density and 19F hyperfine interactions. In Cr8, where the ground state is a singlet with total spin S T = 0, the 19F-NMR spectra at 1.7 K and low external magnetic field display a single narrow line, while when the magnetic field is increased towards the first level crossing field, satellite lines appear in the 19F-NMR spectrum, indicating a progressive increase in the Boltzmann population of the first excited state S T = 1. In the heterometallic rings, Cr7Cd and Cr7 Ni, whose ground state is magnetic with S T = 3/2 and S T = 1/2, respectively, the 19F-NMR spectrum has a complicated structure which depends on the strength and orientation of the magnetic field, due to both isotropic and anisotropic transferred hyperfine interactions and classical dipolar interactions. From the 19F-NMR spectra in single crystals we estimated the transferred hyperfine constants for both the F?-Ni2+ and the F?-Cd2+ bonds. The values of the hyperfine constants compare well to the ones known for F?-Ni2+ in KNiF3 and NiF2 and for F?-Cr3+ in K2NaCrF6. The results are discussed in terms of hybridization of the 2s, 2p orbitals of the F? ion and the d orbitals of the magnetic ion. Finally, we discuss the implications of our results for the electron-spin decoherence.

  15. Characterization of Cr-rich Cr-Sb multilayer films: Syntheses of a new metastable phase using modulated elemental reactants

    SciTech Connect (OSTI)

    Regus, Matthias; Mankovsky, Sergiy; Polesya, Svitlana; Kuhn, Gerhard; Ditto, Jeffrey; Schürmann, Ulrich; Jacquot, Alexandre; Bartholomé, Kilian; Näther, Christian; Winkler, Markus; König, Jan D.; Böttner, Harald; Kienle, Lorenz; Johnson, David C.; Ebert, Hubert; Bensch, Wolfgang

    2015-10-15

    The new metastable compound Cr{sub 1+x}Sb with x up to 0.6 has been prepared via a thin film approach using modulated elemental reactants and investigated by in-situ X-ray reflectivity, X-ray diffraction, differential scanning calorimetry, energy dispersive X-ray analysis as well as transmission electron microscopy and atomic force microscopy. The new Cr-rich antimonide crystallizes in a structure related to the Ni{sub 2}In-type structure, where the crystallographic position (1/3, 2/3, 3/4) is partially occupied by excess Cr. The elemental layers of the pristine material interdiffused significantly before Cr{sub 1+x}Sb crystallized. A change in the activation energy was observed for the diffusion process when crystal growth starts. First-principles electronic structure calculations provide insight into the structural stability, magnetic properties and resistivity of Cr{sub 1+x}Sb. - Graphical abstract: 1 amorphous multilayered film 2 interdiffused amorphous film 3 metastable crystalline phase 4 thermodynamic stable phase (and by-product). - Highlights: • Interdiffusion of amorphous Cr and Sb occurs before crystallization. • Crystallization of a new metastable phase Cr{sub 1.6}Sb in Ni{sub 2}In-type structure. • The new Cr-rich phase shows half-metallic behavior.

  16. Br-rich Tips of Calcified Crab Claws are Less Hard but More Fracture

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Resistant: A Comparison of Mineralized and Heavy-element Biological Materials Br-rich Tips of Calcified Crab Claws are Less Hard but More Fracture Resistant: A Comparison of Mineralized and Heavy-element Biological Materials figure 1 Figure 1. The heavy element biomaterial is the darker material at the tip of the shore crab claws. Figure "b" shows the same claw as "a" but after bead blasting. The claw tips are less eroded by the bead blasting than surrounding calcified

  17. 244-CR Vault Interim Stabilization Project Plan

    SciTech Connect (OSTI)

    PARKMAN, D.B.

    2000-04-25

    The 244-CR Vault is a two-level, multi-cell structure of reinforced concrete constructed below grade. The lower cell contains four individual compartments, each containing a steel process storage tank and equipped with a concrete sump. The upper cell contains the piping and support equipment, and has two compartments for each of the tanks. The ''pump pit'' is accessed by the removal of concrete cover blocks, while the smaller ''riser pit'' is accessed by steel cover plates. The facility most recently was used as a double-contained receiver tank (DCRT). A DCRT is a type of waste transfer tank that together with its related equipment constitutes a short-term storage area for liquid waste and has a pump pit for waste transfer operations. This vault most recently was used for short-term storage and waste routing for saltwell liquid pumped from the 241-C Tank Farm in the 200 East Area. Waste transfer lines are connected inside the pump pit by a jumper installed between connecting nozzles. An active ventilation system is in operation at the 244-CR vault. Ventilation supply air enters the upper vault section through an inlet header with some leakage through the spaces between the cell cover blocks. The upper and lower vaults are connected by exhauster ports, which allow airflow between the two sections. Normal flow moves air from the upper cell to the lower cell where it is removed and routed into a filter plenum; there the air is treated by a bank of four prefilters and two banks of high-efficiency particulate air (HEPA) filters (each containing four HEPAs). The air is exhausted to the atmosphere through the 296-C-05 Stack. The stack is equipped with a record sampler and continuous air monitor. Two fans (each rated at 4,200 cubic feet per minute) installed downstream of the filtration system provide the motive force for exhausting the vaults and the tanks. As an active system, it is operated continuously with only one of the two fans required to operate at a time. A continuous beta-gamma air monitor is interlocked to the operating fan. Loss of power to the fans will activate an alarm at the 244-AR facility.

  18. Interlayer coupling in Fe/Cr/Gd multilayer structures

    SciTech Connect (OSTI)

    Drovosekov, A. B. Kreines, N. M.; Savitsky, A. O.; Kravtsov, E. A.; Blagodatkov, D. V.; Ryabukhina, M. V.; Milyaev, M. A.; Ustinov, V. V.; Pashaev, E. M.; Subbotin, I. A.; Prutskov, G. V.

    2015-06-15

    The effect of the chromium layer thickness on the magnetic state of an [Fe/Cr/Gd/Cr]{sub n} multilayer structure is studied. A series of Fe/Cr/Gd structures with Cr spacer thicknesses of 4–30 Å is studied by SQUID magnetometry and ferromagnetic resonance in the temperature range 4.2–300 K. The obtained experimental results are described in terms of an effective field model, which takes into account a biquadratic contribution to the interlayer coupling energy and a nonuniform magnetization distribution inside the gadolinium layer (which was detected earlier). Depending on the magnetic field and temperature, the following types of magnetic ordering are identified at various chromium layer thicknesses: ferromagnetic, antiferromagnetic, and canted ordering. A comparison of the experimental and calculated curves allowed us to determine the dependence of the bilinear (J{sub 1}) and biquadratic (J{sub 2}) exchange constants on chromium layer thickness t{sub Cr}. Weak oscillations at a period of about 18 Å are detected in the J{sub 1}(t{sub Cr}) dependence in the range 8–30 Å. The interlayer coupling oscillations in the system under study are assumed to be related to the RKKY exchange interaction mechanism via the conduction electrons of Cr.

  19. Effects of Cr and Ni on Interdiffusion and Reaction between U and Fe-Cr-Ni Alloys

    SciTech Connect (OSTI)

    K. Huang; Y. Park; L. Zhou; K.R. Coffey; Y.H. Sohn; B.H. Sencer; J. R. Kennedy

    2014-08-01

    Metallic U-alloy fuel cladded in steel has been examined for high temperature fast reactor technology wherein the fuel cladding chemical interaction is a challenge that requires a fundamental and quantitative understanding. In order to study the fundamental diffusional interactions between U with Fe and the alloying effect of Cr and Ni, solid-to-solid diffusion couples were assembled between pure U and Fe, Fe–15 wt.%Cr or Fe–15 wt.%Cr–15 wt.%Ni alloy, and annealed at high temperature ranging from 580 to 700 °C. The microstructures and concentration profiles that developed from the diffusion anneal were examined by scanning electron microscopy, and X-ray energy dispersive spectroscopy (XEDS), respectively. Thick U6Fe and thin UFe2 phases were observed to develop with solubilities: up to 2.5 at.% Ni in U6(Fe,Ni), up to 20 at.%Cr in U(Fe, Cr)2, and up to 7 at.%Cr and 14 at.% Ni in U(Fe, Cr, Ni)2. The interdiffusion and reactions in the U vs. Fe and U vs. Fe–Cr–Ni exhibited a similar temperature dependence, while the U vs. Fe–Cr diffusion couples, without the presence of Ni, yielded greater activation energy for the growth of intermetallic phases – lower growth rate at lower temperature but higher growth rate at higher temperature.

  20. 9 Cr-- 1 Mo steel material for high temperature application

    DOE Patents [OSTI]

    Jablonski, Paul D; Alman, David; Dogan, Omer; Holcomb, Gordon; Cowen, Christopher

    2012-11-27

    One or more embodiments relates to a high-temperature, titanium alloyed, 9 Cr-1 Mo steel exhibiting improved creep strength and oxidation resistance at service temperatures up to 650.degree. C. The 9 Cr-1 Mo steel has a tempered martensite microstructure and is comprised of both large (0.5-3 .mu.m) primary titanium carbides and small (5-50 nm) secondary titanium carbides in a ratio of. from about 1:1.5 to about 1.5:1. The 9 Cr-1 Mo steel may be fabricated using exemplary austenizing, rapid cooling, and tempering steps without subsequent hot working requirements. The 9 Cr-1 Mo steel exhibits improvements in total mass gain, yield strength, and time-to-rupture over ASTM P91 and ASTM P92 at the temperature and time conditions examined.

  1. TI--CR--AL--O thin film resistors

    DOE Patents [OSTI]

    Jankowski, Alan F.; Schmid, Anthony P.

    2000-01-01

    Thin films of Ti--Cr--Al--O are used as a resistor material. The films are rf sputter deposited from ceramic targets using a reactive working gas mixture of Ar and O.sub.2. Resistivity values from 10.sup.4 to 10.sup.10 Ohm-cm have been measured for Ti--Cr--Al--O film <1 .mu.m thick. The film resistivity can be discretely selected through control of the target composition and the deposition parameters. The application of Ti--Cr--Al--O as a thin film resistor has been found to be thermodynamically stable, unlike other metal-oxide films. The Ti--Cr--Al--O film can be used as a vertical or lateral resistor, for example, as a layer beneath a field emission cathode in a flat panel display; or used to control surface emissivity, for example, as a coating on an insulating material such as vertical wall supports in flat panel displays.

  2. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    CR xx-xxxx) Initial release SANDIA CORPORATION SF 6432-CR (04/2015) SECTION II STANDARD TERMS AND CONDITIONS FOR COST-REIMBURSEMENT CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY IDENTIFIED AS BEING CHANGED, SUPPLEMENTED, OR AMENDED IN WRITING ISSUED BY THE SANDIA CONTRACTING REPRESENTATIVE. (CTRL+CLICK ON A LINK BELOW TO ADVANCE DIRECTLY TO THAT SECTION) ACCEPTANCE OF TERMS AND CONDITIONS (Ts&Cs)

  3. Phase stability and elastic properties of Cr-V alloys

    SciTech Connect (OSTI)

    Gao, M. C.; Suzuki, Y.; Schweiger, H.; Do?an, .N.; Hawk, J.; Widom M.

    2013-02-20

    V is the only element in the periodic table that forms a complete solid solution with Cr and thus is particularly important in alloying strategy to ductilize Cr. This study combines first-principles density functional theory calculations and experiments to investigate the phase stability and elastic properties of CrV binary alloys. The cluster expansion study reveals the formation of various ordered compounds at low temperatures that were not previously known. These compounds become unstable due to the configurational entropy of bcc solid solution as the temperature is increased. The elastic constants of ordered and disordered compounds are calculated at both T = 0 K and finite temperatures. The overall trends in elastic properties are in agreement with measurements using the resonant ultrasound spectroscopy method. The calculations predict that addition of V to Cr decreases both the bulk modulus and the shear modulus, and enhances the Poissons ratio, in agreement with experiments. Decrease in the bulk modulus is correlated to decrease in the valence electron density and increase in the lattice constant. An enhanced Poissons ratio for bcc CrV alloys (compared to pure Cr) is associated with an increased density of states at the Fermi level. Furthermore, the difference charge density in the bonding region in the (110) slip plane is highest for pure Cr and decreases gradually as V is added. The present calculation also predicts a negative Cauchy pressure for pure Cr, and it becomes positive upon alloying with V. The intrinsic ductilizing effect from V may contribute, at least partially, to the experimentally observed ductilizing phenomenon in the literature.

  4. High temperature crystal structures and superionic properties of SrCl{sub 2}, SrBr{sub 2}, BaCl{sub 2} and BaBr{sub 2}

    SciTech Connect (OSTI)

    Hull, Stephen; Norberg, Stefan T.; Ahmed, Istaq; Eriksson, Sten G.; Mohn, Chris E.

    2011-11-15

    The structural properties of the binary alkaline-earth halides SrCl{sub 2}, SrBr{sub 2}, BaCl{sub 2} and BaBr{sub 2} have been investigated from ambient temperature up to close to their melting points, using the neutron powder diffraction technique. Fluorite-structured SrCl{sub 2} undergoes a gradual transition to a superionic phase at 900-1100 K, characterised by an increasing concentration of anion Frenkel defects. At a temperature of 920(3) K, the tetragonal phase of SrBr{sub 2} undergoes a first-order transition to a cubic fluorite phase. This high temperature phase shows the presence of extensive disorder within the anion sublattice, which differs from that found in superionic SrCl{sub 2}. BaCl{sub 2} and BaBr{sub 2} both adopt the cotunnite crystal structure under ambient conditions. BaCl{sub 2} undergoes a first-order structural transition at 917(5) K to a disordered fluorite-structured phase. The relationship between the (disordered) crystal structures and the ionic conductivity behaviour is discussed and the influence of the size of the mobile anion on the superionic behaviour is explored. - Graphical abstract: Anomalous behaviour of the lattice expansion of SrCl{sub 2} at temperatures of {approx}1000 K is associated with the gradual transition to a superionic phase, whilst SrBr{sub 2} undergoes a first-order structural transition ({beta}{yields}{alpha}) to a fluorite-structured superionic phase at 920(3) K. Highlights: > Anomalous behaviour of the lattice expansion of SrCl{sub 2} occurs at temperatures {approx}1000 K. > Crystal structure of {beta}-SrBr{sub 2} is described in detail. > On heating, SrBr{sub 2} and BaCl{sub 2} transform to a fluorite-structured superionic phase. > Temperature dependence of the BaCl{sub 2} and BaBr{sub 2} structures is presented. > Nature of the superionic phases within the alkaline-earth halides is discussed.

  5. Influence of Cr on the nanoclusters formation and superferromagnetic behavior of Fe-Cr-Nb-B glassy alloys

    SciTech Connect (OSTI)

    Chiriac, H.; Whitmore, L.; Grigoras, M.; Ababei, G.; Stoian, G.; Lupu, N.

    2015-05-07

    High resolution imaging and electron diffraction confirm that in the as-quenched state the structure of Fe{sub 79.7−x}Cr{sub x}Nb{sub 0.3}B{sub 20} (x = 11–13 at. %) melt-spun ribbons is completely amorphous, independent of the Cr content. Energy-dispersive X-ray spectroscopy mapping emphasizes clearly the presence of Fe and Cr clusters varying from approximately 1 to 2–3 nm in size with the increase of Cr content from 11 to 13 at. %. The Fe and Cr atoms segregate the atomic scale to form nanometer sized clusters, influencing strongly the macroscopic magnetic behavior. The Curie temperature of the system, T{sub C}{sup system}, confirmed by the magnetic susceptibility versus temperature measurements, gives the strength of the magnetic interactions between clusters. The inter-cluster interactions are much stronger for lower contents of Cr, the microstructure is less uniform, and T{sub C}{sup system} increases from 290 K for 13 at. % Cr to 330 K for 11.5 at. % Cr. The whole system transforms to a ferromagnetic state through interactions between the clusters. Zero-field cooling and field cooling curves confirm the cluster behavior with a blocking temperature, T{sub b}, of about 250 K. Above T{sub b}, the ribbons behave as a superferromagnetic system, whilst below the blocking temperature a classical ferromagnetic behavior is observed.

  6. LiCl Dehumidifier LiBr absorption chiller hybrid air conditioning system with energy recovery

    DOE Patents [OSTI]

    Ko, Suk M.

    1980-01-01

    This invention relates to a hybrid air conditioning system that combines a solar powered LiCl dehumidifier with a LiBr absorption chiller. The desiccant dehumidifier removes the latent load by absorbing moisture from the air, and the sensible load is removed by the absorption chiller. The desiccant dehumidifier is coupled to a regenerator and the desiccant in the regenerator is heated by solar heated hot water to drive the moisture therefrom before being fed back to the dehumidifier. The heat of vaporization expended in the desiccant regenerator is recovered and used to partially preheat the driving fluid of the absorption chiller, thus substantially improving the overall COP of the hybrid system.

  7. X-ray-absorption study of CuBr at high pressure

    SciTech Connect (OSTI)

    Tranquada, J.M.; Ingalls, R.

    1986-09-15

    The x-ray-absorption spectrum of cuprous bromide has been measured as a function of pressure. The x-ray-absorption near-edge structure proved to be an excellent indicator of high-pressure phase transitions in this material. The normalized ''white-line'' peak heights at both the Cu and Br K-italic edges decreased on entering the tetragonal phase and increased in going to the NaCl structure. The zinc-blende to tetragonal phase transition took place over a very narrow pressure range centered at 46 +- 5 kbar. The transformation from the tetragonal to the NaCl structure, on the other hand, showed a broad mixed-phase region, suggesting a nucleation-and-growth mechanism for the transition. The mixed-phase region was centered at 75 +- 6 kbar. No evidence of a phase between the zinc-blende and tetragonal phases was observed, presumably because it does not exist. Analysis of the extended x-ray-absorption fine-structure (EXAFS) clearly showed that there is no change in coordination in going from the zinc-blende to the tetragonal phase although the nearest-neighbor distance increases slightly. A much larger increase in R-italic/sub 1/ occurs at the transition to the NaCl structure, where the coordination increases from 4 to 6. The mean-square deviation in the nearest-neighbor bond length, sigma/sub 1//sup 2/, appears to be a fairly smooth function of nearest-neighbor distance, decreasing (or increasing) as R-italic/sub 1/ decreases (or increases) more or less independent of structure. Evidence from the literature was presented to suggest that the zinc-blende to tetragonal transition in CuBr (and also CuCl) should occur by shear deformation.

  8. Molecular Characterization of Brown Carbon (BrC) Chromophores in Secondary Organic Aerosol Generated From Photo-Oxidation of Toluene

    SciTech Connect (OSTI)

    Lin, Peng; Liu, Jiumeng; Shilling, John E.; Kathmann, Shawn M.; Laskin, Julia; Laskin, Alexander

    2015-09-28

    Atmospheric Brown carbon (BrC) is a significant contributor to light absorption and climate forcing. However, little is known about a fundamental relationship between the chemical composition of BrC and its optical properties. In this work, light-absorbing secondary organic aerosol (SOA) was generated in the PNNL chamber from toluene photo-oxidation in the presence of NOx (Tol-SOA). Molecular structures of BrC components were examined using nanospray desorption electrospray ionization (nano-DESI) and liquid chromatography (LC) combined with UV/Vis spectroscopy and electrospray ionization (ESI) high-resolution mass spectrometry (HRMS). The chemical composition of BrC chromophores and the light absorption properties of toluene SOA (Tol-SOA) depend strongly on the initial NOx concentration. Specifically, Tol-SOA generated under high-NOx conditions (defined here as initial NOx/toluene of 5/1) appears yellow and mass absorption coefficient of the bulk sample (MACbulk@365nm = 0.78 m2 g-1) is nearly 80 fold higher than that measured for the Tol-SOA sample generated under low-NOx conditions (NOx/toluene < 1/300). Fifteen compounds, most of which are nitrophenols, are identified as major BrC chromophores responsible for the enhanced light absorption of Tol-SOA material produced in the presence of NOx. The integrated absorbance of these fifteen chromophores accounts for 40-60% of the total light absorbance by Tol-SOA at wavelengths between 300 nm and 500 nm. The combination of tandem LC-UV/Vis-ESI/HRMS measurements provides an analytical platform for predictive understanding of light absorption properties by BrC and their relationship to the structure of individual chromophores. General trends in the UV/vis absorption by plausible isomers of the BrC chromophores were evaluated using theoretical chemistry calculations. The molecular-level understanding of BrC chemistry is helpful for better understanding the evolution and behavior of light absorbing aerosols in the atmosphere.

  9. Synthesis, crystal structure, spectroscopic and thermal properties of [Et{sub 4}N][Ta{sub 6}Br{sub 12}(H{sub 2}O){sub 6}]Br{sub 4}.4H{sub 2}O (Et=ethyl)-A new compound with the paramagnetic [Ta{sub 6}Br{sub 12}]{sup 3+} cluster core

    SciTech Connect (OSTI)

    Peric, Berislav; Jozic, Drazan; Planinic, Pavica; Brnicevic, Nevenka; Giester, Gerald

    2009-09-15

    A new hexanuclear cluster compound, [Et{sub 4}N][Ta{sub 6}Br{sub 12}(H{sub 2}O){sub 6}]Br{sub 4}.4H{sub 2}O (Et=ethyl) (1), with the paramagnetic [Ta{sub 6}Br{sub 12}]{sup 3+} cluster entity, was synthesized and characterized by elemental and TG/DTA analyses, IR and UV/Vis spectroscopy and by a single-crystal X-ray diffraction study. The presence of the paramagnetic [Ta{sub 6}Br{sub 12}]{sup 3+} unit was confirmed also by the room-temperature magnetic and EPR measurements. The compound crystallizes in the tetragonal I4{sub 1}/a space group, with a=14.299(5), c=21.241(5) A, Z=4, R{sub 1}(F)/wR{sub 2}(F{sup 2})=0.0296/0.0811. The structure contains discrete [Ta{sub 6}Br{sub 12}(H{sub 2}O){sub 6}]{sup 3+} cations with an octahedron of metal atoms edge-bridged by bromine atoms and with water molecules occupying all six terminal positions. The cluster units are positioned in the vertices of the three-dimensional (pseudo)diamond lattice. The structure shows similarities with literature reported structures of cluster compounds crystallizing in the diamond (Fd3-barm) space group. - Graphical abstract: Two interpenetrating (pseudo)diamond nets formed by packing of the paramagnetic [Ta{sub 6}Br{sub 12}(H{sub 2}O)]{sup 3+} (octahedral) and diamagnetic [Et{sub 4}N]{sup +} (spheres) cations.

  10. Surface structure of ?-Cr2O3(0001) after activated oxygen exposure

    SciTech Connect (OSTI)

    Kaspar, Tiffany C.; Chamberlin, Sara E.; Chambers, Scott A.

    2013-09-13

    The surface structure of a-Cr2O3(0001) before and after exposure to activated oxygen from an ECR plasma source was investigated by x-ray photoelectron spectroscopy (XPS) and x-ray photoelectron diffraction (XPD). Epitaxial Cr2O3(0001) thin films were deposited on Al2O3(0001) substrates by oxygen-plasma-assisted molecular beam epitaxy (OPA-MBE). When cooled or annealed in vacuum, strong evidence for a Cr-Cr-O3- termination was obtained by comparing the Cr3+ XPD azimuthal scan to single scattering simulations. However, after plasma exposure, a high binding energy feature was observed in the Cr 2p XPS spectrum that possesses an ordered structure distinct from the underlying Cr3+ of Cr2O3, which remains Cr-Cr-O3-like. Investigation of this new surface structure with simulations of various candidate structures tentatively rules out CrO2-like configurations. The high binding energy feature likely arises from a higher oxidation state of Cr. One possibility is the oxidation of the surface layer of Cr to Cr6- with a double chromyl structure (O=Cr=O).

  11. Chromium Isotope Fractionation During Reduction of Cr(VI) Under Saturated Flow Conditions

    SciTech Connect (OSTI)

    Jamieson-Hanes, Julia H.; Gibson, Blair D.; Lindsay, Matthew B.J.; Kim, Yeongkyoo; Ptacek, Carol J.; Blowes, David W.

    2012-10-25

    Chromium isotopes are potentially useful indicators of Cr(VI) reduction reactions in groundwater flow systems; however, the influence of transport on Cr isotope fractionation has not been fully examined. Laboratory batch and column experiments were conducted to evaluate isotopic fractionation of Cr during Cr(VI) reduction under both static and controlled flow conditions. Organic carbon was used to reduce Cr(VI) in simulated groundwater containing 20 mg L{sup -1} Cr(VI) in both batch and column experiments. Isotope measurements were performed on dissolved Cr on samples from the batch experiments, and on effluent and profile samples from the column experiment. Analysis of the residual solid-phase materials by scanning electron microscopy (SEM) and by X-ray absorption near edge structure (XANES) spectroscopy confirmed association of Cr(III) with organic carbon in the column solids. Decreases in dissolved Cr(VI) concentrations were coupled with increases in {delta}{sup 53}Cr, indicating that Cr isotope enrichment occurred during reduction of Cr(VI). The {delta}{sup 53}Cr data from the column experiment was fit by linear regression yielding a fractionation factor ({alpha}) of 0.9979, whereas the batch experiments exhibited Rayleigh-type isotope fractionation ({alpha} = 0.9965). The linear characteristic of the column {delta}{sup 53}Cr data may reflect the contribution of transport on Cr isotope fractionation.

  12. Gamma-ray decay of levels in /sup 53/Cr

    SciTech Connect (OSTI)

    Dickens, J.K.; Larson, D.C.

    1987-11-01

    Gamma-ray decay of levels in the stable isotope /sup 53/Cr has been studied using /sup 53/Cr(n,n'..gamma..) reactions for incident neutron energies between threshold and 10 MeV. Of the 65 gamma rays or gamma-ray groups observed for neutron interactions with /sup 53/Cr, 50 have been placed or tentatively placed among 34 levels in /sup 53/Cr up to an excitation energy of 4.36 MeV. Deduced branching ratios are in reasonable agreement with previous measurements except for decay of the E/sub x/ = 1537-keV level. For the decay of the E/sub x/ = 1537-keV level we are unable to explain variations in the branching ratios of the transition gamma rays as a function of incident neutron energy within the framework of the presently known level structure of /sup 53/Cr and suggest the possibility of a second energy level at E/sub x/ = 1537 keV. 59 refs., 13 figs., 2 tabs.

  13. Ultrafast dynamics of strong-field dissociative ionization ofCH2Br2 probed by femtosecond soft x-ray transient absorptionspectroscopy

    SciTech Connect (OSTI)

    Loh, Zhi-Heng; Leone, Stephen R.

    2008-01-15

    Femtosecond time-resolved soft x-ray transient absorption spectroscopy based on a high-order harmonic generation source is used to investigate the dissociative ionization of CH{sub 2}Br{sub 2} induced by 800 nm strong-field irradiation. At moderate peak intensities (2.0 x 10{sup 14} W/cm{sup 2}), strong-field ionization is accompanied by ultrafast C-Br bond dissociation, producing both neutral Br ({sup 2}P{sub 3/2}) and Br* ({sup 2}P{sub 1/2}) atoms together with the CH{sub 2}Br{sup +} fragment ion. The measured rise times for Br and Br* are 130 {+-} 22 fs and 74 {+-} 10 fs, respectively. The atomic bromine quantum state distribution shows that the Br/Br* population ratio is 8.1 {+-} 3.8 and that the Br {sup 2}P{sub 3/2} state is not aligned. The observed product distribution and the timescales of the photofragment appearances suggest that multiple field-dressed potential energy surfaces are involved in the dissociative ionization process. In addition, the transient absorption spectrum of CH{sub 2}Br{sub 2}{sup +} suggests that the alignment of the molecule relative to the polarization axis of the strong-field ionizing pulse determines the electronic symmetry of the resulting ion; alignment of the Br-Br, H-H, and C{sub 2} axis of the molecule along the polarization axis results in the production of the ion {tilde X}({sup 2}B{sub 2}), {tilde B}({sup 2}B{sub 1}) and {tilde C}({sup 2}A{sub 1}) states, respectively. At higher peak intensities (6.2 x 10{sup 14} W/cm{sup 2}), CH{sub 2}Br{sub 2}{sup +} undergoes sequential ionization to form the metastable CH{sub 2}Br{sub 2}{sup 2+} dication. These results demonstrate the potential of core-level probing with high-order harmonic transient absorption spectroscopy for studying ultrafast molecular dynamics.

  14. A XANES and EXAFS Study of Hydration and Ion Pairing in Ambient Aqueous MnBr[subscript 2] Solutions

    SciTech Connect (OSTI)

    Chen, Yongsheng; Fulton, John L.; Partenheimer, Walter

    2008-09-25

    Extended X-ray absorption fine structure (EXAFS) and X-ray absorption near edge structure (XANES) spectroscopies were used to probe the first-shell coordination structure of Mn(II) in aqueous MnBr{sub 2} solutions at ambient conditions from very dilute to the near saturation limit. The Mn K-edge EXAFS spectra for 0.05 and 0.2 m solutions showed that there was no Br(-I) in the first shell, and that the Mn(II) was fully hydrated with six water molecules in an octahedral arrangement. In contrast, for 6 m solution, the coordination number of water was reduced to about 5, and an average of about one bromine atom was present in the first shell as a contact ion pair. The 1s {yields} 4p transition at 6545.5 eV confirmed the observation of Mn-Br contact ion pairs at high concentrations and the 1s {yields} 3d transition at 6539.5 eV showed that the first shell coordination symmetry remained octahedral even in the presence of Mn-Br ion pairs.

  15. Electrodeposition of zinc on glassy carbon from ZnCl/sub 2/ and ZnBr/sub 2/ electrolytes

    SciTech Connect (OSTI)

    McBreen, J.; Gannon, E.

    1983-08-01

    The initial stages of the electrocrystallization of zinc from 3M ZnCl/sub 2/ and 3M ZnBr/sub 2/ on glassy carbon has been investigated using cyclic voltametry, the potential step method, and scanning electron microscopy. Particular care was taken to ensure electrolyte purity and to eliminate resistance effects in the measurements. The nucleation overvoltage in 3M ZnCl/sub 2/ was about 17 and about 12 mV in 3M ZnBr/sub 2/. In 3M ZnCl/sub 2/, the current transients from the potential step measurements could be fitted to a simple model that assumes instantaneous nucleation followed by growth of three dimensional centers under kinetic control. A similar mechanism is operative for 3M ZnBr/sub 2/ at low overvoltages. At higher overvoltages, the current transient is governed by mixed kinetic and diffusion control and cannot be fitted to a simple model. The lower nucleation overvoltage and the faster kinetics in 3M ZnBr/sub 2/ is correlated with the lower stability constants for the zinc bromide complexes. Erroneous results are obtained when resistance effects are not accounted for.

  16. Room-temperature ferromagnetism in Cr-doped Si achieved by controlling atomic structure, Cr concentration, and carrier densities: A first-principles study

    SciTech Connect (OSTI)

    Wei, Xin-Yuan; Yang, Zhong-Qin; Zhu, Yan; Li, Yun

    2015-04-28

    By using first-principles calculations, we investigated how to achieve a strong ferromagnetism in Cr-doped Si by controlling the atomic structure and Cr concentration as well as carrier densities. We found that the configuration in which the Cr atom occupies the tetrahedral interstitial site can exist stably and the Cr atom has a large magnetic moment. Using this doping configuration, room-temperature ferromagnetism can be achieved in both n-type and p-type Si by tuning Cr concentration and carrier densities. The results indicate that the carrier density plays a crucial role in realizing strong ferromagnetism in diluted magnetic semiconductors.

  17. Grain boundary depletion and migration during selective oxidation of Cr in a Ni-5Cr binary alloy exposed to high-temperature hydrogenated water

    SciTech Connect (OSTI)

    Schreiber, Daniel K.; Olszta, Matthew J.; Bruemmer, Stephen M.

    2014-10-01

    High-resolution microscopy of a high-purity Ni-5Cr alloy exposed to 360C hydrogenated water reveals intergranular selective oxidation of Cr accompanied by local Cr depletion and diffusion-induced grain boundary migration (DIGM). The corrosion-product oxide consists of a porous, interconnected network of Cr2O3 platelets with no further O ingress into the metal ahead. Extensive grain boundary depletion of Cr (to <0.05at.%) is observed typically 20100 nm wide as a result of DIGM and reaching depths of many micrometers beyond the oxidation front.

  18. Importance of Doping and Frustration in Itinerant Fe-doped Cr2Al

    SciTech Connect (OSTI)

    Susner, Michael A; Parker, David S; Safa-Sefat, Athena

    2015-01-01

    We have performed an experimental and theoretical study comparing the effects of Fe-doping of Cr2Al, an antiferromagnet with a N el temperature of 670 K, with known results on Fe-doping of antiferromagnetic bcc Cr. (Cr1-xFex)2Al materials are found to exhibit a rapid suppression of antiferromagnetic order with the presence of Fe, decreasing TN to 170 K for x=0.10. Antiferromagnetic behavior disappears entirely at x 0.125 after which point increasing paramagnetic behavior is exhibited. This is unlike the effects of Fe doping of bcc antiferromagnetic Cr, in which TN gradually decreases followed by the appearance of a ferromagnetic state. Theoretical calculations explain that the Cr2Al-Fe suppression of magnetic order originates from two effects: the first is band narrowing caused by doping of additional electrons from Fe substitution that weakens itinerant magnetism; the second is magnetic frustration of the Cr itinerant moments in Fe-substituted Cr2Al. In pure-phase Cr2Al, the Cr moments have an antiparallel alignment; however, these are destroyed through Fe substitution and the preference of Fe for parallel alignment with Cr. This is unlike bulk Fe-doped Cr alloys in which the Fe anti-aligns with the Cr atoms, and speaks to the importance of the Al atoms in the magnetic structure of Cr2Al and Fe-doped Cr2Al.

  19. Importance of Doping and Frustration in Itinerant Fe-doped Cr2Al

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Susner, Michael A; Parker, David S; Safa-Sefat, Athena

    2015-01-01

    We have performed an experimental and theoretical study comparing the effects of Fe-doping of Cr2Al, an antiferromagnet with a N el temperature of 670 K, with known results on Fe-doping of antiferromagnetic bcc Cr. (Cr1-xFex)2Al materials are found to exhibit a rapid suppression of antiferromagnetic order with the presence of Fe, decreasing TN to 170 K for x=0.10. Antiferromagnetic behavior disappears entirely at x 0.125 after which point increasing paramagnetic behavior is exhibited. This is unlike the effects of Fe doping of bcc antiferromagnetic Cr, in which TN gradually decreases followed by the appearance of a ferromagnetic state. Theoretical calculationsmore » explain that the Cr2Al-Fe suppression of magnetic order originates from two effects: the first is band narrowing caused by doping of additional electrons from Fe substitution that weakens itinerant magnetism; the second is magnetic frustration of the Cr itinerant moments in Fe-substituted Cr2Al. In pure-phase Cr2Al, the Cr moments have an antiparallel alignment; however, these are destroyed through Fe substitution and the preference of Fe for parallel alignment with Cr. This is unlike bulk Fe-doped Cr alloys in which the Fe anti-aligns with the Cr atoms, and speaks to the importance of the Al atoms in the magnetic structure of Cr2Al and Fe-doped Cr2Al.« less

  20. Metastable bcc phase formation in the Nb-Cr system

    SciTech Connect (OSTI)

    Thoma, D.J.; Schwarz, R.B.; Perepezko, J.H.; Plantz, D.H.

    1993-08-01

    Extended metastable bcc solid solutions of Nb-Xat.%Cr (X = 35, 50, 57, 77, 82, and 94) were synthesized by two-anvil splat-quenching. In addition, bcc (Nb-67at.%Cr) was prepared by mechanically alloying mixtures of niobium and chromium powders. The lattice parameters were measured by X-ray diffraction and the Young`s moduli were measured by low-load microindentation. The composition dependence of the lattice parameters and elastic moduli show a positive deviation with respect to a rule of mixtures. During continuous heating at 15C/min., the metastable precursor bcc phases decomposed at temperatures above 750C to uniformly refined microstructures.

  1. Ag/AgBr/g-C{sub 3}N{sub 4}: A highly efficient and stable composite photocatalyst for degradation of organic contaminants under visible light

    SciTech Connect (OSTI)

    Cao, Jing; Zhao, Yijie; Lin, Haili; Xu, Benyan; Chen, Shifu

    2013-10-15

    Graphical abstract: Ag/AgBr/g-C{sub 3}N{sub 4} composite photocatalysts displayed excellent photocatalytic activities on the degradation of methyl orange (MO) under visible light. The improved photocatalytic performance and stability of Ag/AgBr/g-C{sub 3}N{sub 4} originated from the synergetic effects of AgBr/g-C{sub 3}N{sub 4} interface and metallic Ag nanoparticles. O{sub 2}?, one of the reactive species, was responsible for the photodegradation of MO compared to H+ and OH. - Highlights: Novel Ag/AgBr/g-C{sub 3}N{sub 4} composite photocatalyst was reported. Ag/AgBr/g-C{sub 3}N{sub 4} had novel energy band combination between AgBr and g-C{sub 3}N{sub 4}. Synergetic effects of AgBr/g-C{sub 3}N{sub 4} interface and metallic Ag nanoparticles. Electron trapping role of metallic Ag dominated the stability of Ag/AgBr/g-C{sub 3}N{sub 4}. - Abstract: Novel Ag/AgBr/g-C{sub 3}N{sub 4} composite photocatalysts were constructed via depositionprecipitation method and extensively characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM), high-resolution transmission electron microscopy (HRTEM) and UVvis diffuse reflectance spectroscopy (DRS). Under visible light (? > 420 nm), Ag/AgBr/g-C{sub 3}N{sub 4} composite photocatalysts displayed much higher photocatalytic activities than those of Ag/AgBr and g-C{sub 3}N{sub 4} for degradation of methyl orange (MO). 50% Ag/AgBr/g-C{sub 3}N{sub 4} presented the best photocatalytic performance, which was mainly attributed to the synergistic effects of AgBr/g-C{sub 3}N{sub 4} interface and the in situ metallic Ag nanoparticles for efficiently separating electronhole pairs. Furthermore, Ag/AgBr/g-C{sub 3}N{sub 4} remained good photocatalytic activity through 5 times of cycle experiments. Additionally, the radical scavengers experiment indicated that O{sub 2}{sup ?} was the main reactive species for the MO degradation under visible light.

  2. Direct molecular diffusion and micro-mixing for rapid dewatering of LiBr solution

    SciTech Connect (OSTI)

    Bigham, S; Isfahani, RN; Moghaddam, S

    2014-03-01

    A slow molecular diffusion rate often limits the desorption process of an absorbate molecule from a liquid absorbent. To enhance the desorption rate, the absorbent is often boiled to increase the liquid vapor interfacial area. However, the growth of bubbles generated during the nucleate boiling process still remains mass-diffusion limited. Here, it is shown that a desorption rate higher than that of boiling can be achieved, if the vapor absorbent interface is continuously replenished with the absorbate-rich solution to limit the concentration boundary layer growth. The study is conducted in a LiBr-water-solution, in which the water molecules' diffusion rate is quite slow. The manipulation of the vapor solution interface concentration distribution is enabled by the mechanical confinement of the solution flow within microchannels, using a hydrophobic vapor-venting membrane and the implementation of microstructures on the flow channel's bottom wall. The microstructures stretch and fold the laminar streamlines within the solution film and produce vortices. The vortices continuously replace the concentrated solution at the vapor solution interface with the water-rich solution brought from the bottom and middle of the flow channel. The physics of the process is described using a combination of experimental and numerical studies. Published by Elsevier Ltd.

  3. The corrosion phenomena in the coin cell BR2325 of the ``superstoichiometric fluorocarbon-lithium'' system

    SciTech Connect (OSTI)

    Mitkin, V.N.; Galkin, P.S.; Denisova, T.N.

    1998-07-01

    It was noted at the earlier study and at the longer observations of the novel various types of superstoichiometric fluorocarbon materials CF{sub 1+x}, where x = 0.1--0.33 (FCM) and their behavior, that despite of their known hygroscopity during a storage of samples in laboratory and technological utensils nevertheless occurs an appreciable sorption of atmospheric moisture. The color of samples does not change but sometimes there appears a smell of hydrogen fluoride and even corrosion of glasswares at a long storage. On the basis of these facts was assumed that at a long storage the slow reactions of HF producing with a sorption moisture can proceed. This phenomena is necessary to take into account for successful manufacturing of long life lithium cells based on superstoichiometric fluorocarbon composite cathodes (FCC). The chemistry of such slow hydrolytic process and especially of processes which can proceed at manufacturing of FCC earlier was not investigated also of any data in the literature in this occasion is not present. Just for this reason the authors undertook a study of the corrosion phenomena which can proceed in industrial sources of a current at a long storage under influence of slow hydrolysis of C-F bonds by moisture. The goal of the study was to search long term damages in the slightly wet FCM and based on these materials cathodic composites for fluorocarbon-lithium cells. As a model for corrosion process investigation they have chosen a standard coin lithium battery of a type BR2325.

  4. Photoluminescence characteristics of polariton condensation in a CuBr microcavity

    SciTech Connect (OSTI)

    Nakayama, Masaaki Murakami, Katsuya; Furukawa, Yoshiaki; Kim, DaeGwi

    2014-07-14

    We have investigated the photoluminescence (PL) properties of a CuBr microcavity at 10?K, including the temporal profiles, from the viewpoint of cavity-polariton condensation. The excitation energy density dependence of the PL intensity (band width) of the lower polariton branch at an in-plane wave vector of k{sub //}?=?0 exhibits a threshold-like increase (decrease). A large blueshift in the PL energy of ?10?meV caused by the cavity-polariton renormalization is correlated with the excitation energy density dependence of the PL intensity. The estimated density of photogenerated electron-hole pairs at the threshold is two orders lower than the Mott transition density. These results consistently demonstrate the occurrence of cavity-polariton condensation. In addition, we found that the PL rise and decay times are shortened dramatically by the cavity-polariton condensation, which reflects the bosonic final state stimulation in the relaxation process and the intrinsic cavity-polariton lifetime in the decay process.

  5. Synthesis and photocatalytic performance of an efficient Ag@AgBr/K{sub 2}Ti{sub 4}O{sub 9} composite photocatalyst under visible light

    SciTech Connect (OSTI)

    Liang, Yinghua; Lin, Shuanglong; Liu, Li; Hu, Jinshan; Cui, Wenquan

    2014-08-15

    Highlights: The plasmatic Ag@AgBr sensitized K{sub 2}Ti{sub 4}O{sub 9} composite photocatalysts. Ag@AgBr greatly increased visible light absorption for K{sub 2}Ti{sub 4}O{sub 9}. The plamonic photocatalysts exhibited enhanced activity for the degradation of RhB. - Abstract: Ag@AgBr nanoparticle-sensitized K{sub 2}Ti{sub 4}O{sub 9} composite photocatalysts (Ag@AgBr/K{sub 2}Ti{sub 4}O{sub 9}) were prepared by a facile precipitationphotoreduction method. The photocatalytic activities of the Ag@AgBr/K{sub 2}Ti{sub 4}O{sub 9} nanocomposites were evaluated for photocatalytic degradation of (RhB) under visible light irradiation. The composites exhibited excellent visible light absorption, which was attributable to the surface plasmon effect of Ag nanoparticles. The Ag@AgBr was uniformly scattered on the surface of K{sub 2}Ti{sub 4}O{sub 9} and possessed sizes in the range of 2050 nm. The loading amount of Ag@AgBr was also studied, and was found to influence the absorption spectra of the resulting composites. Approximately 95.9% of RhB was degraded by Ag@AgBr (20 wt.%)/K{sub 2}Ti{sub 4}O{sub 9} after irradiation for 1 h. The stability of the material was also investigated by performing consecutive runs. Additionally, studies performed using radical scavengers indicated that O{sub 2}{sup ?} and Br{sup 0} acted as the main reactive species. Based on the experimental results, a photocatalytic mechanism for organics degradation over Ag@AgBr/K{sub 2}Ti{sub 4}O{sub 9} photocatalysts was proposed.

  6. Viscosity and density of aqueous solutions of LiBr, LiCl, ZnBr[sub 2], CaCl[sub 2], and LiNO[sub 3]; 1: Single salt solutions

    SciTech Connect (OSTI)

    Wimby, J.M.; Berntsson, T.S. . Dept. of Heat and Power Technology)

    1994-01-01

    New experimental data for the viscosity and density of the binary systems lithium chloride + water, lithium bromide + water, calcium chloride + water, lithium nitrate + water, and zinc bromide + water are presented. Densities are presented in tabular form and as 10-parameter correlations, while kinematic and dynamic viscosities are presented in tabular form. Data are presented in the concentration range from intermediate dilution to close to room temperature crystallization concentration. The temperature ranges are 20--70 C for density and 25--90 C for viscosity. When available, literature data are compared with the new data, and some disagreement is found. New thermogravimetric curves are presented for the dehydration of CaCl[sub 2], ZnBr[sub 2], and LiBr in order to enable evaluation of drying as a composition determination technique.

  7. Shell model description of band structure in 48Cr

    SciTech Connect (OSTI)

    Vargas, Carlos E.; Velazquez, Victor M.

    2007-02-12

    The band structure for normal and abnormal parity bands in 48Cr are described using the m-scheme shell model. In addition to full fp-shell, two particles in the 1d3/2 orbital are allowed in order to describe intruder states. The interaction includes fp-, sd- and mixed matrix elements.

  8. Magnetization reversal in TmCrO{sub 3}

    SciTech Connect (OSTI)

    Yoshii, Kenji

    2012-11-15

    Highlights: ► We observed two magnetization reversals in TmCrO{sub 3}. ► The reversal at 28 K is attributed to antiparallel coupling between Cr{sup 3+} and Tm{sup 3+}. ► The other reversal originates from spin reorientation. ► Magnetocaloric effect is observed at the spin reorientation temperature. ► Characteristic magnetization switching is demonstrated. -- Abstract: The perovskite chromite TmCrO{sub 3} shows magnetization reversal at two temperatures. The reversal at ∼28 K is attributed to the antiparallel coupling between Tm{sup 3+} and Cr{sup 3+} moments, while that at the lower temperature (∼6–7 K) is rooted in a rotation of the magnetic moments. Magnetocaloric measurements offer a relatively large entropy change (∼4–5 J kg{sup −1} K{sup −1}) at the lower temperature. The reversal at ∼28 K is accompanied by a sign change of an exchange-bias-like field. The absence of the training effect suggests that this behavior is rooted in unidirectional magnetic anisotropy. The existence of the two magnetization reversals offers the characteristic switching of magnetization. For example, the magnetization is flipped without changing the direction of the applied magnetic field.

  9. Audit Report: CR-FS-99-01

    Energy Savers [EERE]

    MANAGEMENT REPORT AUDIT OF THE DEPARTMENT OF ENERGY'S CONSOLIDATED FINANCIAL STATEMENTS FOR FISCAL YEAR 1998 Report Number: CR-FS-99-01 Capital Regional Audit Office Date of Issue: June 15, 1999 Germantown, MD 20874 MANAGEMENT REPORT AUDIT OF THE DEPARTMENT OF ENERGY'S CONSOLIDATED FINANCIAL STATEMENTS FOR FISCAL YEAR 1998 TABLE OF CONTENTS Page SUMMARY.................................................................................. 1 PART I - APPROACH AND

  10. CR-39 track etching and blow-up method

    DOE Patents [OSTI]

    Hankins, Dale E. (Livermore, CA)

    1987-01-01

    This invention is a method of etching tracks in CR-39 foil to obtain uniformly sized tracks. The invention comprises a step of electrochemically etching the foil at a low frequency and a "blow-up" step of electrochemically etching the foil at a high frequency.

  11. Audit Report: CR-B-01-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Audit Report: CR-B-01-01 May 9, 2001 Issues Regarding Fee Structure for Three Environmental Management Contracts PDF icon Audit Report: CR-B-01-01 More Documents & Publications ...

  12. Audit Report: CR-B-96-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Audit Report: CR-B-96-01 May 24, 1996 The Federal Energy Regulatory Commission Leased Warehouse Space PDF icon Audit Report: CR-B-96-01 More Documents & Publications Semiannual ...

  13. Audit Report: CR-B-97-02 | Department of Energy

    Office of Environmental Management (EM)

    2 Audit Report: CR-B-97-02 April 4, 1997 Audit of Department of Energy's Contractor Salary Increase Funds Audit Report: CR-B-97-02 More Documents & Publications Inspection Report:...

  14. Audit Report: CR-FS-97-02 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    FS-97-02 Audit Report: CR-FS-97-02 May 1, 1997 Audit of the Department of Energy's Consolidated Financial Statements for Fiscal Year 1996 Audit Report: CR-FS-97-02 More Documents &...

  15. Audit Report: CR-B-95-03 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Audit Report: CR-B-95-03 February 6, 1995 Audit of the Department of Energy's Security Police Officer Training PDF icon Audit Report: CR-B-95-03 More Documents & Publications Type...

  16. Pressure dependence of the magnetic order in CrAs: A neutron...

    Office of Scientific and Technical Information (OSTI)

    Pressure dependence of the magnetic order in CrAs: A neutron diffraction investigation Citation Details In-Document Search Title: Pressure dependence of the magnetic order in CrAs:...

  17. Solid-solution CrCoCuFeNi high-entropy alloy thin films synthesized...

    Office of Scientific and Technical Information (OSTI)

    Solid-solution CrCoCuFeNi high-entropy alloy thin films synthesized by sputter deposition Title: Solid-solution CrCoCuFeNi high-entropy alloy thin films synthesized by sputter ...

  18. The Preparation of an Ultrastable Mesoporous Cr(III)-MOF via...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    labilization of the Fe(III)-O coordination bond in a mesoporous metal-organic framework, PCN-333-Fe(III), is realized by the reduction of Fe(III) by Cr(II). The Fe(II)-Cr(II)...

  19. Technology Implimentation Plan - ATF FeCrAl Cladding for LWR Application

    SciTech Connect (OSTI)

    Snead, Mary A.; Snead, Lance; Terrani, Kurt A.; Field, Kevin G.; Worrall, Andrew; Robb, Kevin R.; Yamamoto, Yukinori; Powers, Jeffrey J.; Dryepondt, Sebastien N.; Pint, Bruce A.; Hu, Xunxiang

    2015-06-01

    Technology implimentation plan for FeCrAl development under the FCRD Advanced Fuel program. The document describes the activities required to get FeCrAl clad ready for LTR testing

  20. The crystal and magnetic structure of Ti-substituted LaCrO{sub...

    Office of Scientific and Technical Information (OSTI)

    On account of a miscibility gap, a higher degree of Ti-substitution at the Cr site cannot be achieved; as a consequence the solid state solubility of Ti in LaCrOsub 3 at 1573 K ...

  1. Hydrogen for X-group exchange in CH3X, X = Cl, Br, I, OMe and NMe2

    Office of Scientific and Technical Information (OSTI)

    byMonomeric [1,2,4-(Me3C)3C5H2]2CeH: Experimental and Computational Support for a Carbenoid Mechanism (Journal Article) | SciTech Connect Hydrogen for X-group exchange in CH3X, X = Cl, Br, I, OMe and NMe2 byMonomeric [1,2,4-(Me3C)3C5H2]2CeH: Experimental and Computational Support for a Carbenoid Mechanism Citation Details In-Document Search Title: Hydrogen for X-group exchange in CH3X, X = Cl, Br, I, OMe and NMe2 byMonomeric [1,2,4-(Me3C)3C5H2]2CeH: Experimental and Computational Support for

  2. Steady-State Thermal-Hydraulics Analyses for the Conversion of the BR2 Reactor to LEU

    SciTech Connect (OSTI)

    Licht, J. R.; Bergeron, A.; Dionne, B.; Van den Branden, G.; Kalcheva, S.; Sikik, E.; Koonen, E.

    2015-12-01

    BR2 is a research reactor used for radioisotope production and materials testing. It’s a tank-in-pool type reactor cooled by light water and moderated by beryllium and light water (Figure 1). The reactor core consists of a beryllium moderator forming a matrix of 79 hexagonal prisms in a hyperboloid configuration; each having a central bore that can contain a variety of different components such as a fuel assembly, a control or regulating rod, an experimental device, or a beryllium or aluminum plug. Based on a series of tests, the BR2 operation is currently limited to a maximum allowable heat flux of 470 W/cm2 to ensure fuel plate integrity during steady-state operation and after a loss-of-flow/loss-of-pressure accident.

  3. Comparison of CsBr and KBr coated Cu photocathodes: Effects of laser irradiation and work function changes

    SciTech Connect (OSTI)

    He, Weidong; VilayurGanapathy, Subramanian; Joly, Alan G.; Droubay, Timothy C.; Chambers, Scott A.; Maldonado, Juan R.; Hess, Wayne P.

    2013-02-20

    Thin films (7 nm layers) of CsBr and KBr were deposited on Cu(100) to investigate photoemission properties of these potential photocathode materials. After thin film deposition and prolonged laser ultraviolet (UV) irradiation (266 nm picosecond laser) photoemission quantum efficiency increases by factors of 26 and 77 for KBr/Cu(100) and CsBr/Cu(100) photocathodes, respectively. Immediately following thin film deposition, a decrease in work function is observed, compared to bare Cu, in both cases. Quantum efficiency enhancements are attributed to the decrease in photocathode work function, due to the deposition of alkali halide thin films, and photo-induced processes, that introduce defect states into the alkali halide bandgap, induced by UV laser irradiation. It is possible that alkali metal formation occurs during UV irradiation and that this further contributes to photoemission enhancement. Our results suggest that KBr, a relatively stable alkali-halide, has potential for photocathode applications.

  4. Periodicity, Electronic Structures, and Bonding of Gold Tetrahalides [AuX4](-) (X = F, CI, Br, I, At, Uus)

    SciTech Connect (OSTI)

    Li, Wan-Lu; Li, Yong; Xu, Congqiao; Wang, Xue B.; Vorpagel, Erich R.; Li, Jun

    2015-12-07

    Systematic theoretical and experimental investigations have been performed to understand the periodicity and electronic structures of trivalent-gold halides using gold tetrahalides [AuX4]⁻ anions (X = F, Cl, Br, I, At, Uus). The [AuX4]⁻ (X = Cl, Br, I) anions were produced in gas phase and their negative-ion photoelectron spectra were obtained, which exhibited rich and well-resolved spectral peaks. We calculated the adiabatic as well as vertical electron detachment energies using density functional methods with scalar and spin-orbit coupling relativistic effects. The simulated photoelectron spectra based on these calculations are in good agreement with the experimental spectra. Our results show that the trivalent Au(III) oxidation state becomes progressively less stable while Au(I) is preferred when the halides become heavier along the Period Table. This trend reveals that the oxidation state of metals in complexes can be manipulated through ligand design

  5. Radiation effects on interface reactions of U/Fe, U/(Fe+Cr), and U/(Fe+Cr+Ni)

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Shao, Lin; Chen, Di; Wei, Chaochen; Martin, Michael S.; Wang, Xuemei; Park, Youngjoo; Dein, Ed; Coffey, Kevin R.; Sohn, Yongho; Sencer, Bulent H.; et al

    2014-10-01

    We study the effects of radiation damage on interdiffusion and intermetallic phase formation at the interfaces of U/Fe, U/(Fe + Cr), and U/(Fe + Cr + Ni) diffusion couples. Magnetron sputtering is used to deposit thin films of Fe, Fe + Cr, or Fe + Cr + Ni on U substrates to form the diffusion couples. One set of samples are thermally annealed under high vacuum at 450 C or 550 C for one hour. A second set of samples are annealed identically but with concurrent 3.5 MeV Fe++ ion irradiation. The Fe++ ion penetration depth is sufficient to reachmore »the original interfaces. Rutherford backscattering spectrometry analysis with high fidelity spectral simulations is used to obtain interdiffusion profiles, which are used to examine differences in U diffusion and intermetallic phase formation at the buried interfaces. For all three diffusion systems, Fe++ ion irradiations enhance U diffusion. Furthermore, the irradiations accelerate the formation of intermetallic phases. In U/Fe couples, for example, the unirradiated samples show typical interdiffusion governed by Fick’s laws, while the irradiated ones show step-like profiles influenced by Gibbs phase rules.« less

  6. Radiation effects on interface reactions of U/Fe, U/(Fe+Cr), and U/(Fe+Cr+Ni)

    SciTech Connect (OSTI)

    Shao, Lin; Chen, Di; Wei, Chaochen; Martin, Michael S.; Wang, Xuemei; Park, Youngjoo; Dein, Ed; Coffey, Kevin R.; Sohn, Yongho; Sencer, Bulent H.; Rory Kennedy, J.

    2014-10-01

    We study the effects of radiation damage on interdiffusion and intermetallic phase formation at the interfaces of U/Fe, U/(Fe + Cr), and U/(Fe + Cr + Ni) diffusion couples. Magnetron sputtering is used to deposit thin films of Fe, Fe + Cr, or Fe + Cr + Ni on U substrates to form the diffusion couples. One set of samples are thermally annealed under high vacuum at 450 C or 550 C for one hour. A second set of samples are annealed identically but with concurrent 3.5 MeV Fe++ ion irradiation. The Fe++ ion penetration depth is sufficient to reach the original interfaces. Rutherford backscattering spectrometry analysis with high fidelity spectral simulations is used to obtain interdiffusion profiles, which are used to examine differences in U diffusion and intermetallic phase formation at the buried interfaces. For all three diffusion systems, Fe++ ion irradiations enhance U diffusion. Furthermore, the irradiations accelerate the formation of intermetallic phases. In U/Fe couples, for example, the unirradiated samples show typical interdiffusion governed by Fick’s laws, while the irradiated ones show step-like profiles influenced by Gibbs phase rules.

  7. Radiation effects on interface reactions of U/Fe, U/(Fe+Cr), and U/(Fe+Cr+Ni)

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Shao, Lin; Chen, Di; Wei, Chaochen; Martin, Michael S.; Wang, Xuemei; Park, Youngjoo; Dein, Ed; Coffey, Kevin R.; Sohn, Yongho; Sencer, Bulent H.; et al

    2014-10-01

    We study the effects of radiation damage on interdiffusion and intermetallic phase formation at the interfaces of U/Fe, U/(Fe + Cr), and U/(Fe + Cr + Ni) diffusion couples. Magnetron sputtering is used to deposit thin films of Fe, Fe + Cr, or Fe + Cr + Ni on U substrates to form the diffusion couples. One set of samples are thermally annealed under high vacuum at 450 C or 550 C for one hour. A second set of samples are annealed identically but with concurrent 3.5 MeV Fe++ ion irradiation. The Fe++ ion penetration depth is sufficient to reachmore » the original interfaces. Rutherford backscattering spectrometry analysis with high fidelity spectral simulations is used to obtain interdiffusion profiles, which are used to examine differences in U diffusion and intermetallic phase formation at the buried interfaces. For all three diffusion systems, Fe++ ion irradiations enhance U diffusion. Furthermore, the irradiations accelerate the formation of intermetallic phases. In U/Fe couples, for example, the unirradiated samples show typical interdiffusion governed by Fick’s laws, while the irradiated ones show step-like profiles influenced by Gibbs phase rules.« less

  8. Non-classical nuclei and growth kinetics of Cr precipitates in FeCr alloys during ageing

    SciTech Connect (OSTI)

    Li, Yulan; Hu, Shenyang Y.; Zhang, Lei; Sun, Xin

    2014-01-10

    In this manuscript, we quantitatively calculated the thermodynamic properties of critical nuclei of Cr precipitates in FeCr alloys. The concentration profiles of the critical nuclei and nucleation energy barriers were predicted by the constrained shrinking dimer dynamics (CSDD) method. It is found that Cr concentration distribution in the critical nuclei strongly depend on the overall Cr concentration as well as temperature. The critical nuclei are non-classical because the concentration in the nuclei is smaller than the thermodynamic equilibrium value. These results are in agreement with atomic probe observation. The growth kinetics of both classical and non-classical nuclei was investigated by the phase field approach. The simulations of critical nucleus evolution showed a number of interesting phenomena: 1) a critical classical nucleus first shrinks toward its non-classical nucleus and then grows; 2) a non-classical nucleus has much slower growth kinetics at its earlier growth stage compared to the diffusion-controlled growth kinetics. 3) a critical classical nucleus grows faster at the earlier growth stage than the non-classical nucleus. All of these results demonstrate that it is critical to introduce the correct critical nuclei in order to correctly capture the kinetics of precipitation.

  9. Cs{sub 3}Zr{sub 6}Br{sub 15}Z (Z = C, B): A stuffed rhombohedral perovskite structure of linked clusters

    SciTech Connect (OSTI)

    Qi, Ru-Yi; Corbett, J.D.

    1995-03-29

    The isostructural title compounds are synthesized in good yields form reactions of Zr, ZrBr{sub 4}, CsBr, and Z in sealed Ta tubing for {approximately}3 weeks at 850 {degrees}C. Their single-crystal data refinements established the products as Cs{sub 3.02(7)-}Zr{sub 6}Br{sub 14}C and Cs{sub 3.39(5)}Zr{sub 6}br{sub 15}B (R3c, Z = 6, a = 13.1031 (6), 13.116(1) {angstrom}, c = 35.800(3), 35.980(6) {angstrom}, R(F)/R{sub w} = 5.4/5.9, 5.4/4.4%, respectively). The structure is derived form a three-dimensional [Zr{sub 6}(Z)Br{sub 12}]Br{sub 6/2} network of four-rings (as in ReO{sub 6/2}) twisted into a rhombohedral perovskite analogous to VF{sub 3}. The three necessary Cs{sup +} cations are fractionally distributed over five sites that are far from optimal or common, with either eight asymmetric or only three close bromide neighbors. Refinement of a third Cs{sub 3.18(5)}Zr{sub 6}Br{sub 15}C structure at {minus}50 {degrees}C gave the same result with somewhat smaller positional distributions of the atoms.

  10. Palladium-catalyzed Br/D exchange of arenes: Selective deuterium incorporation with versatile functional group tolerance and high efficiency

    SciTech Connect (OSTI)

    Zhang, Honghai -Hai; Bonnesen, Peter V.; Hong, Kunlun

    2015-07-13

    There is a facile method for introducing one or more deuterium atoms onto an aromatic nucleus via Br/D exchange with high functional group tolerance and high incorporation efficiency is disclosed. Deuterium-labeled aryl chlorides and aryl borates which could be used as substrates in cross-coupling reactions to construct more complicated deuterium-labeled compounds can also be synthesized by this method.

  11. Palladium-catalyzed Br/D exchange of arenes: Selective deuterium incorporation with versatile functional group tolerance and high efficiency

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Zhang, Honghai -Hai; Bonnesen, Peter V.; Hong, Kunlun

    2015-01-01

    There is a facile method for introducing one or more deuterium atoms onto an aromatic nucleus via Br/D exchange with high functional group tolerance and high incorporation efficiency is disclosed. Deuterium-labeled aryl chlorides and aryl borates which could be used as substrates in cross-coupling reactions to construct more complicated deuterium-labeled compounds can also be synthesized by this method.

  12. Magnetic excitations in the spin-1/2 triangular-lattice antiferromagnet Cs2CuBr4

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Zvyagin, S. A.; Ozerov, M.; Kamenskyi, D.; Wosnitza, J.; Krzystek, J.; Yoshizawa, D.; Hagiwara, M.; Hu, Rongwei; Ryu, Hyejin; Petrovic, C.; et al

    2015-11-27

    We present on high- field electron spin resonance (ESR) studies of magnetic excitations in the spin- 1/2 triangular-lattice antiferromagnet Cs2CuBr4. Frequency- field diagrams of ESR excitations are measured for different orientations of magnetic fields up to 25 T. We show that the substantial zero- field energy gap, Δ ≈ 9.5 K, observed in the low-temperature excitation spectrum of Cs2CuBr4 [Zvyagin et al:, Phys. Rev. Lett. 112, 077206 (2014)], is present well above TN. Noticeably, the transition into the long-range magnetically ordered phase does not significantly affect the size of the gap, suggesting that even below TN the high-energy spin dynamicsmore » in Cs2CuBr4 is determined by short-range-order spin correlations. The experimental data are compared with results of model spin-wave-theory calculations for spin-1/2 triangle-lattice antiferromagnet.« less

  13. Surface half-metallicity of CrS thin films and perfect spin filtering and spin diode effects of CrS/ZnSe heterostructure

    SciTech Connect (OSTI)

    Gao, G. Y. Yao, K. L.

    2014-11-03

    Recently, ferromagnetic zinc-blende Mn{sub 1−x}Cr{sub x}S thin films (above x = 0.5) were fabricated experimentally on ZnSe substrate, which confirmed the previous theoretical prediction of half-metallic ferromagnetism in zinc-blende CrS. Here, we theoretically reveal that both Cr- and S-terminated (001) surfaces of the CrS thin films retain the half-metallicity. The CrS/ZnSe(001) heterogeneous junction exhibits excellent spin filtering and spin diode effects, which are explained by the calculated band structure and transmission spectra. The perfect spin transport properties indicate the potential applications of half-metallic CrS in spintronic devices. All computational results are obtained by using the density functional theory combined with nonequilibrium Green's function.

  14. Cr.sup.3+ -doped colquiriite solid state laser material

    DOE Patents [OSTI]

    Payne, Stephen A.; Chase, Lloyd L.; Newkirk, Herbert W.; Krupke, William F.

    1989-01-01

    Chromium doped colquiriite, LiCaAlF.sub.6 :Cr.sup.3+, is useful as a tunable laser crystal that has a high intrinsic slope efficiency, comparable to or exceeding that of alexandrite, the current leading performer of vibronic sideband Cr.sup.3+ lasers. The laser output is tunable from at least 720 nm to 840 nm with a measured slop efficiency of about 60% in a Kr laser pumped laser configuration. The intrinsic slope efficiency (in the limit of large output coupling) may approach the quantum defect limited value of 83%. The high slope efficiency implies that excited state absorption (ESA) is negligible. The potential for efficiency and the tuning range of this material satisfy the requirements for a pump laser for a high density storage medium incorporating Nd.sup.3+ or Tm.sup.3+ for use in a multimegajoule single shot fusion research facility.

  15. Cr/sup 3 +/-doped colquiriite solid state laser material

    DOE Patents [OSTI]

    Payne, S.A.; Chase, L.L.; Newkirk, H.W.; Krupke, W.F.

    1988-03-31

    Chromium doped colquiriite, LiCaAlF/sub 6/:Cr/sup 3 +/, is useful as a tunable laser crystal that has a high intrinsic slope efficiency, comparable to or exceeding that of alexandrite, the current leading performer of vibronic sideband Cr/sup 3 +/ lasers. The laser output is tunable from at least 720 nm to 840 nm with a measured slope efficiency of about 60% in a Kr laser pumped laser configuration. The intrinsic slope efficiency (in the limit of large output coupling) may approach the quantum defect limited value of 83%. The high slope efficiency implies that excited state absorption (ESA) is negligible. The potential for efficiency and the tuning range of this material satisfy the requirements for a pump laser for a high density storage medium incorporating Nd/sup 3 +/ or Tm/sup 3 +/ for use in a multimegajoule single shot fusion research facility. 4 figs.

  16. Cr{sub 2}Nb-based alloy development

    SciTech Connect (OSTI)

    Liu, C.T.; Horton, J.A.; Carmichael, C.A.

    1996-05-01

    This paper summarizes recent progress in developing Cr{sub 2}Nb/Cr(Nb) alloys for structural use in advanced fossil energy conversion systems. Alloy additions were added to control the microstructure and mechanical properties. Two beneficial elements have been identified among all alloying additions added to the alloys. One element is effective in refining the coarse eutectic structure and thus substantially improves the compressive strength and ductility of the alloys. The other element enhances oxidation resistance without sacrificing the ductility. The tensile properties are sensitive to cast defects, which can not be effectively reduced by HIPping at 1450-1580{degrees}C and/or directionally solidifying via a floating zone remelting method.

  17. Transport signatures of quantum critically in Cr at high pressure.

    SciTech Connect (OSTI)

    Jaramillo, R.; Feng, Y.; Wang, J.; Rosenbaum, T. F.

    2010-08-03

    The elemental antiferromagnet Cr at high pressure presents a new type of naked quantum critical point that is free of disorder and symmetry-breaking fields. Here we measure magnetotransport in fine detail around the critical pressure, P{sub c} {approx} 10 GPa, in a diamond anvil cell and reveal the role of quantum critical fluctuations at the phase transition. As the magnetism disappears and T {yields} 0, the magntotransport scaling converges to a non-mean-field form that illustrates the reconstruction of the magnetic Fermi surface, and is distinct from the critical scaling measured in chemically disordered Cr:V under pressure. The breakdown of itinerant antiferromagnetism only comes clearly into view in the clean limit, establishing disorder as a relevant variable at a quantum phase transition.

  18. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Department Release Date: 11/17/15 Page 1 of 25 Printed copies of this document are uncontrolled. Retrieve latest version electronically. SANDIA CORPORATION SF 6432-CR (11/2015) SECTION II STANDARD TERMS AND CONDITIONS FOR COST-REIMBURSEMENT CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY IDENTIFIED AS BEING CHANGED, SUPPLEMENTED, OR AMENDED IN WRITING ISSUED BY THE SANDIA CONTRACTING REPRESENTATIVE.

  19. SF6432-CR (02-01-13) Cost Reimbursement

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    7/31/13 Page 1 of 24 Printed copies of this document are uncontrolled. Retrieve latest version electronically. SANDIA CORPORATION SF 6432-CR (07/2013) SECTION II STANDARD TERMS AND CONDITIONS FOR COST-REIMBURSEMENT CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY IDENTIFIED AS BEING CHANGED, SUPPLEMENTED, OR AMENDED IN WRITING ISSUED BY THE SANDIA CONTRACTING REPRESENTATIVE. (CTRL+CLICK ON A LINK BELOW

  20. AmeriFlux CR-Lse La Selva

    SciTech Connect (OSTI)

    Loescher, Hank

    2016-01-01

    This is the AmeriFlux version of the carbon flux data for the site CR-Lse La Selva. Site Description - Site was occupied by Native Americans since 3000 B.P. practicing shifting cultivation. Some selective cutting along rivers (heart of palm). Charcoal dating indicate fires 2400 B.P. and 1100 B.P. Some clearing for pasture/cocoa production, second growth, humid tropical rain forest. Site resides on land presently owned by the Organization for Tropical Studies.

  1. Watermelon-like iron nanoparticles: Cr doping effect on magnetism and magnetization interaction reversal

    SciTech Connect (OSTI)

    Kaur, Maninder; Dai, Qilin; Bowden, Mark E.; Engelhard, Mark H.; Wu, Yaqiao; Tang, Jinke; Qiang, You

    2013-06-26

    Chromium (Cr) forms a solid solution with iron (Fe) lattice when doped in core-shell iron -iron oxide nanocluster (NC) and shows a mixed phase of sigma (?) FeCr and bcc Fe. The Cr dopant affects heavily the magnetization and magnetic reversal process, and causes the hysteresis loop to shrink near the zero field axis. Dramatic transformation happens from dipolar interaction (0 at. % Cr) to strong exchange interaction (8 at. % of Cr) is confirmed from the Henkel plot and delta M plot, and is explained by a water-melon model of core-shell NC system.

  2. Low temperature spin dynamics in Cr{sub 7}Ni-Cu-Cr{sub 7}Ni coupled molecular rings

    SciTech Connect (OSTI)

    Bordonali, L.; Furukawa, Y.; Mariani, M.; Sabareesh, K. P. V.; Garlatti, E.; Borsa, F.

    2014-05-07

    Proton Nuclear Magnetic Resonance (NMR) relaxation measurements have been performed down to very low temperature (50 mK) to determine the effect of coupling two Cr{sub 7}Ni molecular rings via a Cu{sup 2+} ion. No difference in the spin dynamics was found from nuclear spin lattice relaxation down to 1.5 K. At lower temperature, the {sup 1}H-NMR line broadens dramatically indicating spin freezing. From the plot of the line width vs. magnetization, it is found that the freezing temperature is higher (260 mK) in the coupled ring with respect to the single Cr{sub 7}Ni ring (140 mK)

  3. Preparation, characterization and photocatalytic activity of visible-light-driven plasmonic Ag/AgBr/ZnFe{sub 2}O{sub 4} nanocomposites

    SciTech Connect (OSTI)

    Li, Xiaojuan Tang, Duanlian; Tang, Fan; Zhu, Yunyan; He, Changfa; Liu, Minghua Lin, Chunxiang; Liu, Yifan

    2014-08-15

    Highlights: A plasmonic Ag/AgBr/ZnFe{sub 2}O{sub 4} photocatalyst has been successfully synthesized. Ag/AgBr/ZnFe{sub 2}O{sub 4} nanocomposites exhibit high visible light photocatalytic activity. Ag/AgBr/ZnFe{sub 2}O{sub 4} photocatalyst is stable and magnetically separable. - Abstract: A visible-light-driven plasmonic Ag/AgBr/ZnFe{sub 2}O{sub 4} nanocomposite has been successfully synthesized via a depositionprecipitation and photoreduction through a novel one-pot process. X-ray diffraction spectroscopy, X-ray photoelectron spectroscopy, scanning electron microscopy, transmission electron microscopy and UVvis diffuse reflectance spectroscopy were employed to investigate the crystal structure, chemical composition, morphology, and optical properties of the as-prepared nanocomposites. The photocatalytic activities of the nanocomposites were evaluated by photodegradation of Rhodamine B (RhB) and phenol under visible light. The results demonstrated that the obtained Ag/AgBr/ZnFe{sub 2}O{sub 4} nanocomposites exhibited higher photocatalytic activity as compared to pure ZnFe{sub 2}O{sub 4}. In addition, the sample photoreduced for 20 min and calcined at 500 C achieved the highest photocatalytic activity. Furthermore, the Ag/AgBr/ZnFe{sub 2}O{sub 4} nanocomposite has high stability under visible light irradiation and could be conveniently separated by using an external magnetic field.

  4. Nanostructured Lanthanum Halides and CeBr3 for Nuclear Radiation and Detection

    SciTech Connect (OSTI)

    Paul Guss, Sanjoy Mukhopadhyay, Ron Guise, Ding Yuan

    2010-06-09

    Scintillator materials are used to detect, and in some cases identify, gamma rays. Higher performance scintillators are expensive, hard to manufacture, fragile, and sometimes require liquid nitrogen or cooling engines. But whereas lower-quality scintillators are cheap, easy to manufacture, and more rugged, their performance is lower. At issue: can the desirable qualities of high-and low-performance scintillators be combined to achieve better performance at lower cost? Preliminary experiments show that a LaF{sub 3}:Ce oleic acid-based nanocomposite exhibits a photopeak when exposed to {sup 137}Cs source gamma-radiation. The chemical synthesis of the cerium-doped lanthanum halide nanoparticles are scalable and large quantities of material can be produced at a time, unlike typical crystal growth processes such as the Bridgeman process. Using a polymer composite (Figure 1), produced by LANL, initial measurements of the unloaded and 8% LaF{sub 3}:Ce-loaded sample have been made using {sup 137}Cs sources. Figure 2 shows an energy spectrum acquired for CeF{sub 3}. The lighter plot is the measured polymer-only spectrum and the black plot is the spectrum from the nanocomposite scintillator. As the development of this material continues, the energy resolution is expected to improve and the photopeak-to-Compton ratio will become greater at higher loadings. These measurements show the expected Compton edge in the polymer-only sample, and the Compton edge and photo-peak expected in the nanophosphor composites that LANL has produced. Using a porous VYCORR with CdSe/ZnS core shell quantum dots, Letant has demonstrated that he has obtained signatures of the 241Am photopeak with energy resolution as good at NaI (Figure 3). We begin with the fact that CeBr{sub 3} crystals do not have a self-activity component as strong as the lanthanum halides. The radioactive 0.090% {sup 138}La component of lanthanum leads to significant self-activity, which will be a problem for very large detector volumes. Yet a significant strength of the nanostructure detector concept is the ability to create extremely large detector volumes by mixing nanoparticles into a transparent matrix. This would argue for use of nanoparticles other than lanthanum halides. Nanocomposites are easy to prepare; it is much less costly to use nanocomposites than to grow large whole crystals of these materials. The material can be fabricated at an industrial scale, further reducing cost. This material potentially offers the performance of $300/cc material (e.g., lanthanum bromide) at a cost of $1/cc. Because the material acts as a plastic, it is rugged and flexible, and can be made in large sheets, increasing the sensitivity of a detector using it. It would operate at ambient temperatures. Very large volumes of detector may be produced at greatly reduced cost, enhancing the non-proliferation posture of the nation for the same dollar value.

  5. Cr(OH)₃(s) Oxidation Induced by Surface Catalyzed Mn(II) Oxidation

    SciTech Connect (OSTI)

    Namgung, Seonyi; Kwon, M.; Qafoku, Nikolla; Lee, Gie Hyeon

    2014-09-16

    This study examined the feasibility of Cr(OH)₃(s) oxidation mediated by surface catalyzed Mn(II) oxidation under common groundwater pH conditions as a potential pathway of natural Cr(VI) contaminations. Dissolved Mn(II) (50 μM) was reacted with or without synthesized Cr(OH)₃(s) (1.0 g/L) at pH 7 – 9 under oxic or anoxic conditions. In the absence of Cr(OH)₃(s), homogeneous Mn(II) oxidation by dissolved O₂ was not observed at pH ≤ 8.0 for 50 d. At pH 9.0, by contrast, dissolved Mn(II) was completely removed within 8 d and precipitated as hausmannite. When Cr(OH)₃(s) was present, this solid was oxidized and released substantial amounts of Cr(VI) as dissolved Mn(II) was added into the suspension at pH ≥ 8.0 under oxic conditions. Our results suggest that Cr(OH)₃(s) was readily oxidized by a newly formed Mn oxide as a result of Mn(II) oxidation catalyzed on Cr(OH)₃(s) surface. XANES analysis of the residual solids after the reaction between 1.0 g/L Cr(OH)₃(s) and 204 μM Mn(II) at pH 9.0 for 22 d revealed that the product of surface catalyzed Mn(II) oxidation resembled birnessite. The rate and extent of Cr(OH)₃(s) oxidation was likely controlled by those of surface catalyzed Mn(II) oxidation as the production of Cr(VI) increased with increasing pH and initial Mn(II) concentrations. This study evokes the potential environmental hazard of sparingly soluble Cr(OH)₃(s) that can be a source of Cr(VI) in the presence of dissolved Mn(II).

  6. Oxidation sulfidation resistance of Fe-Cr-Ni alloys

    DOE Patents [OSTI]

    Natesan, Ken (Naperville, IL); Baxter, David J. (Woodridge, IL)

    1984-01-01

    High temperature resistance of Fe-Cr-Ni alloy compositions to oxidative and/or sulfidative conditions is provided by the incorporation of about 1-8 wt. % of Zr or Nb and results in a two-phase composition having an alloy matrix as the first phase and a fine grained intermetallic composition as the second phase. The presence and location of the intermetallic composition between grains of the matrix provides mechanical strength, enhanced surface scale adhesion, and resistance to corrosive attack between grains of the alloy matrix at temperatures of 500.degree.-1000.degree. C.

  7. Improved oxidation sulfidation resistance of Fe-Cr-Ni alloys

    DOE Patents [OSTI]

    Natesan, K.; Baxter, D.J.

    1983-07-26

    High temperature resistance of Fe-Cr-Ni alloy compositions to oxidative and/or sulfidative conditions is provided by the incorporation of about 1 to 8 wt % of Zr or Nb and results in a two-phase composition having an alloy matrix as the first phase and a fine grained intermetallic composition as the second phase. The presence and location of the intermetallic composition between grains of the matrix provides mechanical strength, enhanced surface scale adhesion, and resistance to corrosive attack between grains of the alloy matrix at temperatures of 500 to 1000/sup 0/C.

  8. Characterization of modified 9 Cr-1 Mo steel extruded pipe

    SciTech Connect (OSTI)

    Sikka, V.K.; Hart, M.D.

    1985-04-01

    The fabrication of hot-extruded pipe of modified 9 Cr-1 Mo steel at Cameron Iron Works is described. The report also deals with the tempering response; tensile, Charpy impact, and creep properties; and microstructure of the hot-extruded pipe. The tensile properties of the pipe are compared with the average and average -1.65 standard error of estimate curves for various product forms of several commercial heats of this alloy. The creep-rupture properties are compared with the average curve for various product forms of the commercial heats.

  9. Preliminary design report: Babcock and Wilcox BR-100 100-ton rail/barge spent fuel shipping cask

    SciTech Connect (OSTI)

    None

    1990-02-01

    The purpose of this document is to provide information on burnup credit as applied to the preliminary design of the BR-100 shipping cask. There is a brief description of the preliminary basket design and the features used to maintain a critically safe system. Following the basket description is a discussion of various criticality analyses used to evaluate burnup credit. The results from these analyses are then reviewed in the perspective of fuel burnups expected to be shipped to either the final repository or a Monitored Retrievable Storage (MRS) facility. The hurdles to employing burnup credit in the certification of any cask are then outlines and reviewed. the last section gives conclusions reached as to burnup credit for the BR-100 cask, based on our analyses and experience. All information in this study refers to the cask configured to transport PWR fuel. Boiling Water Reactor (BWR) fuel satisfies the criticality requirements so that burnup credit is not needed. All calculations generated in the preparation of this report were based upon the preliminary design which will be optimized during the final design. 8 refs., 19 figs., 16 tabs.

  10. Impact of membrane characteristics on the performance and cycling of the Br-2-H-2 redox flow cell

    SciTech Connect (OSTI)

    Tucker, MC; Cho, KT; Spingler, FB; Weber, AZ; Lin, GY

    2015-06-15

    The Br-2/H-2 redox flow cell shows promise as a high-power, low-cost energy storage device. In this paper, the effect of various aspects of material selection and processing of proton exchange membranes on the operation of the Br-2/H-2 redox flow cell is determined. Membrane properties have a significant impact on the performance and efficiency of the system. In particular, there is a tradeoff between conductivity and crossover, where conductivity limits system efficiency at high current density and crossover limits efficiency at low current density. The impact of thickness, pretreatment procedure, swelling state during cell assembly, equivalent weight, membrane reinforcement, and addition of a microporous separator layer on this tradeoff is assessed. NR212 (50 mu m) pretreated by soaking in 70 degrees C water is found to be optimal for the studied operating conditions. For this case, an energy efficiency of greater than 75% is achieved for current density up to 400 mA cm(-2), with a maximum obtainable energy efficiency of 88%. A cell with this membrane was cycled continuously for 3164 h. Membrane transport properties, including conductivity and bromine and water crossover, were found to decrease moderately upon cycling but remained higher than those for the as-received membrane. (C) 2015 Elsevier B.V. All rights reserved.

  11. The response of CR-39 nuclear track detector to 1-9 MeV protons

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Sinenian, N.; Rosenberg, M. J.; Manuel, M.; McDuffee, S. C.; Casey, D. T.; Zylstra, A. B.; Rinderknecht, H. G.; Johnson, M. Gatu; Seguin, F. H.; Frenje, J. A.; et al

    2011-10-28

    The response of CR-39 nuclear track detector (TasTrak®) to protons in the energy range of 0.92-9.28 MeV has been studied. Previous studies of the CR-39 response to protons have been extended by examining the piece-to-piece variability in addition to the effects of etch time and etchant temperature; it is shown that the shape of the CR-39 response curve to protons can vary from piece-to-piece. The effects due to the age of CR-39 have also been studied using 5.5 MeV alpha particles over a 5-year period. Track diameters were found to degrade with the age of the CR-39 itself rather thanmore » the age of the tracks, consistent with previous studies utilizing different CR-39 over shorter time periods.« less

  12. Irradiation-enhanced α' precipitation in model FeCrAl alloys

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Edmondson, Philip D.; Briggs, Samuel A.; Yamamoto, Yukinori; Howard, Richard H.; Sridharan, Kumar; Terrani, Kurt A.; Field, Kevin G.

    2016-02-17

    Model FeCrAl alloys with varying compositions (Fe(10–18)Cr(10–6)Al at.%) have been neutron irradiated at ~ 320 to damage levels of ~ 7 displacements per atom (dpa) to investigate the compositional influence on the formation of irradiation-induced Cr-rich α' precipitates using atom probe tomography. In all alloys, significant number densities of these precipitates were observed. Cluster compositions were investigated and it was found that the average cluster Cr content ranged between 51.1 and 62.5 at.% dependent on initial compositions. This is significantly lower than the Cr-content of α' in binary FeCr alloys. As a result, significant partitioning of the Al from themore » α' precipitates was also observed.« less

  13. Ferromagnetism at room temperature in Cr-doped anodic titanium dioxide nanotubes

    SciTech Connect (OSTI)

    Liao, Yulong E-mail: hwzhang@uestc.edu.cn; Zhang, Huaiwu E-mail: hwzhang@uestc.edu.cn; Li, Jie; Yu, Guoliang; Zhong, Zhiyong; Bai, Feiming; Jia, Lijun; Zhang, Shihong; Zhong, Peng

    2014-05-07

    This study reports the room-temperature ferromagnetism in Cr-doped TiO{sub 2} nanotubes (NTs) synthesized via the electrochemical method followed by a novel Cr-doping process. Scanning electron microscopy and transmission electron microscopy showed that the TiO{sub 2} NTs were highly ordered with length up to 26 ?m, outer diameter about 110 nm, and inner diameter about 100 nm. X-ray diffraction results indicated there were no magnetic contaminations of metallic Cr clusters or any other phases except anatase TiO{sub 2}. The Cr-doped TiO{sub 2} NTs were further annealed in oxygen, air and argon, and room-temperature ferromagnetism was observed in all Cr-doped samples. Moreover, saturation magnetizations and coercivities of the Cr-doped under various annealing atmosphere were further analyzed, and results indicate that oxygen content played a critical role in the room-temperature ferromagnetism.

  14. Effects of Cr doping on the magnetic properties of multiferroic YMnO{sub 3}

    SciTech Connect (OSTI)

    Han, Tai-Chun Wu, I-Chu; Hsu, Hsin-Kai

    2014-05-07

    We have synthesized a series of YMn{sub 1?x}Cr{sub x}O{sub 3} (0???x???0.1) samples and study the effect of Cr-doping on their magnetic properties. The magnetic characterization indicates that with increasing Cr-content up to 0.1, the antiferromagnetic (AFM) transition temperature increases from 73 to 89?K. Our experiment results also indicate that the Cr-doped samples exhibit the characteristics of spin-glass state at low temperature. Moreover, the magnetic hysteresis curves of the doped samples show a weak ferromagnetic (FM) behavior. It is found that the spin-glass state of the Cr-doped samples is due to the competition between AFM superexchange and FM double-exchange interaction, induced by the Cr doping.

  15. Highly tunable magnetism in silicene doped with Cr and Fe atoms under

    Office of Scientific and Technical Information (OSTI)

    isotropic and uniaxial tensile strain (Journal Article) | SciTech Connect SciTech Connect Search Results Journal Article: Highly tunable magnetism in silicene doped with Cr and Fe atoms under isotropic and uniaxial tensile strain Citation Details In-Document Search Title: Highly tunable magnetism in silicene doped with Cr and Fe atoms under isotropic and uniaxial tensile strain We have investigated the magnetic properties of silicene doped with Cr and Fe atoms under isotropic and uniaxial

  16. EXTENDED ANALYSIS OF THE SPECTRUM OF SINGLY IONIZED CHROMIUM (Cr II)

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect EXTENDED ANALYSIS OF THE SPECTRUM OF SINGLY IONIZED CHROMIUM (Cr II) Citation Details In-Document Search Title: EXTENDED ANALYSIS OF THE SPECTRUM OF SINGLY IONIZED CHROMIUM (Cr II) We have made new observations of the spectrum of singly ionized chromium (Cr II) in the region 2850-37900 Å with the National Institute of Standards and Technology 2 m Fourier transform spectrometer. These data extend our previously reported observations in the

  17. Dissociative adsorption of CH{sub 3}X (X = Br and Cl) on a silicon(100) surface revisited by density functional theory

    SciTech Connect (OSTI)

    Wang, Chen-Guang; Huang, Kai E-mail: wji@ruc.edu.cn; Ji, Wei E-mail: wji@ruc.edu.cn

    2014-11-07

    During the dissociative adsorption on a solid surface, the substrate usually participates in a passive manner to accommodate fragments produced upon the cleavage of the internal bond(s) of a (transient) molecular adsorbate. This simple picture, however, neglects the flexibility of surface atoms. Here, we report a Density Functional Theory study to revisit our early studies of the dissociative adsorption of CH{sub 3}X (X = Br and Cl) on Si(100). We have identified a new reaction pathway, which involves a flip of a silicon dimer; this new pathway agrees better with experiments. For our main exemplar of CH{sub 3}Br, insights have been gained using a simple model that involves a three-atom reactive center, Br-C-Si. When the silicon dimer flips, the interaction between C and Si in the Br-C-Si center is enhanced, evident in the increased energy-split of the frontier orbitals. We also examine how the dissociation dynamics of CH{sub 3}Br is altered on a heterodimer (Si-Al, Si-P, and Si-Ge) in a Si(100) surface. In each case, we conclude, on the basis of computed reaction pathways, that no heterodimer flipping is involved before the system transverses the transition state to dissociative adsorption.

  18. Origin of spin gapless semiconductor behavior in CoFeCrGa: Theory...

    Office of Scientific and Technical Information (OSTI)

    behavior in CoFeCrGa: Theory and Experiment This content will become publicly available on July 8, 2016 Title: Origin of spin gapless semiconductor behavior in ...

  19. Structural studies and band gap tuning of Cr doped ZnO nanoparticles

    SciTech Connect (OSTI)

    Srinet, Gunjan Kumar, Ravindra Sajal, Vivek

    2014-04-24

    Structural and optical properties of Cr doped ZnO nanoparticles prepared by the thermal decomposition method are presented. X-ray diffraction studies confirmed the substitution of Cr on Zn sites without changing the wurtzite structure of ZnO. Modified form of W-H equations was used to calculate various physical parameters and their variation with Cr doping is discussed. Significant red shift was observed in band gap, i.e., a band gap tuning is achieved by Cr doping which could eventually be useful for optoelectronic applications.

  20. Microsoft Word - chapter FeNiCrMo_ver4.doc

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Low-Alloy Ferritic Steels Fe-Ni-Cr-Mo Tempered December 8, ... strength level, material processing, and heat treatment 1. ... steel composition, hydrogen gas pressure, and temperature. ...

  1. Magnetic Interaction Reversal In Watermelon Nanostructured Cr-doped Fe Nanoclusters

    SciTech Connect (OSTI)

    Kaur, Maninder; Dai, Qilin; Bowden, Mark E.; Engelhard, Mark H.; Wu, Yaqiao; Tang, Jinke; Qiang, You

    2013-11-11

    Cr-doped core-shell Fe/Fe-oxide nanoclusters (NCs) were synthesized at varied atomic percentages of Cr from 0 at. % to 8 at. %. The low concentrations of Cr (<10 at. %) were selected in order to inhibit the complete conversion of the Fe-oxide shell to Cr2O3 and the Fe core to FeCr alloy. The magnetic interaction in Fe/Fe-oxide NCs (rv25 nm) can be controlled by antiferromagnetic Cr-dopant. We report the origin of r-FeCr phase at very low Cr concentration (2 at. %) unlike in previous studies, and the interaction reversal from dipolar to exchange interaction in watermelon-like Cr-doped core-shell NCs. The giant magnetoresistance (GMR) effect,1,2 where an antiferromagnetic (AFM) exchange coupling exists between two ferromagnetic (FM) layers separated by a certain type of magnetic or non-magnetic spacer,3 has significant potential for application in the magnetic recording industry. Soon after the discovery of the GMR, the magnetic properties of multilayer systems (FeCr) became a subject of intensive study. The application of bulk iron-chromium (Fe-Cr) alloys has been of great interest, as these alloys exhibit favorable prop- erties including corrosion resistance, high strength, hardness, low oxidation rate, and strength retention at elevated temper- ature. However, the structural and magnetic properties of Cr-doped Fe nanoclusters (NCs) have not been investigated in-depth. Of all NCs, Fe-based clusters have unique magnetic properties as well as favorable catalytic characteristics in reactivity, selectivity, and durability.4 The incorporation of dopant of varied type and concentration in Fe can modify its chemical ordering, thereby optimizing its electrical, optical, and magnetic properties and opening up many new applications. The substitution of an Fe atom (1.24 A˚ ) by a Cr atom (1.25 A˚ ) can easily modify the magnetic properties, since (i) the curie temperature (Tc ) of Fe is 1043 K, while Cr is an itinerant AFM with a bulk Neel temperature TN =311 K, and (ii) Fe and Cr share the same crystal structure (bcc) with only 0.5% difference between their lattice constants.

  2. Improving thermostability of CrO{sub 2} thin films by doping with Sn

    SciTech Connect (OSTI)

    Ding, Yi; Wang, Ziyu; Liu, Shuo; Shi, Jing; Yin, Di; Yuan, Cheng; Lu, Zhihong; Xiong, Rui

    2014-09-01

    Chromium dioxide (CrO{sub 2}) is an ideal material for spin electronic devices since it has almost 100% spin polarization near Fermi level. However, it is thermally unstable and easily decomposes to Cr{sub 2}O{sub 3} even at room temperature. In this study, we try to improve the thermal stability of CrO{sub 2} thin films by doping with Sn whose oxide has the same structure as CrO{sub 2}. High quality epitaxial CrO{sub 2} and Sn-doped CrO{sub 2} films were grown on single crystalline TiO{sub 2} (100) substrates by chemical vapor deposition. Sn{sup 4+} ions were believed to be doped into CrO{sub 2} lattice and take the lattice positions of Cr{sup 4+}. The magnetic measurements show that Sn-doping leads to a decrease of magnetocrystalline anisotropy. The thermal stabilities of the films were evaluated by annealing the films at different temperatures. Sn-doped films can withstand a temperature up to 510 °C, significantly higher than what undoped films can do (lower than 435 °C), which suggests that Sn-doping indeed enhances the thermal stability of CrO{sub 2} films. Our study also indicates that Sn-doping may not change the essential half metallic properties of CrO{sub 2}. Therefore, Sn-doped CrO{sub 2} is expected to be very promising for applications in spintronic devices.

  3. Environmental effects on noble-gas hydrides: HXeBr, HXeCCH, and HXeH in noble-gas and molecular matrices

    SciTech Connect (OSTI)

    Tsuge, Masashi E-mail: leonid.khriachtchev@helsinki.fi; Lignell, Antti; Rsnen, Markku; Khriachtchev, Leonid E-mail: leonid.khriachtchev@helsinki.fi

    2013-11-28

    Noble-gas hydrides HNgY (Ng is a noble-gas atom and Y is an electronegative group) are sensitive probes of local environment due to their relatively weak bonding and large dipole moments. We experimentally studied HXeBr in Ar, Kr, and N{sub 2} matrices, HXeCCH in Ne and N{sub 2} matrices, and HXeH in an N{sub 2} matrix. These are the first observations of noble-gas hydrides in an N{sub 2} matrix. An N{sub 2} matrix strongly increases the HXe stretching frequency of HXeBr and HXeCCH with respect to a Ne matrix, which is presumably due to a strong interaction between the HNgY dipole moment and quadrupole moments of the surrounding lattice N{sub 2} molecules. The spectral shift of HXeBr in an N{sub 2} matrix is similar to that in a CO{sub 2} matrix, which is a rather unexpected result because the quadrupole moment of CO{sub 2} is about three times as large as that of N{sub 2}. The HXe stretching frequencies of HXeBr and HXeCCH in noble-gas matrices show a trend of ?(Ne) < ?(Xe) < ?(Kr) < ?(Ar), which is a non-monotonous function of the dielectric constants of the noble-gas solids. The MP2(full) calculations of HXeBr and HXeCCH with the polarizable continuum model as well as the CCSD(T) calculations of the HXeBrNg and HXeCCHNg (Ng = Ne, Ar, Kr, and Xe) complexes cannot fully explain the experimental observations. It is concluded that more sophisticated computational models should be used to describe these experimental findings.

  4. Stabilized wide bandgap MAPbBrxI3-x perovskite by enhanced grain size and improved crystallinity

    SciTech Connect (OSTI)

    Hu, Miao; Bi, Cheng; Yuan, Yongbo; Bai, Yang; Huang, Jinsong

    2015-12-07

    In this study, the light instability of CH3NH3PbIxBr3x has been raised one of the biggest challenges for its application in tandem solar cells. Here we show that an improved crystallinity and grain size of CH3NH3PbIxBr3x films could stabilize these materials under one sun illumination, improving both the efficiency and stability of the wide-bandgap perovskite solar cells.

  5. Metastable bcc phase formation in the Nb-Cr-Ti system

    SciTech Connect (OSTI)

    Thoma, D.J.; Perepezko, J.H.

    1994-08-01

    Metastable disordered bcc phases have been formed from the melt in the Nb-Cr-Ti system where primary Laves phases would develop under equilibrium solidification conditions. Three vertical temperature-composition sections in the ternary system incorporating NbCr, were evaluated: the Nb-Cr binary, the TiCr{sub 2}-NbCr{sub 2} isoplethal section, and the NbCr{sub 2}-Ti plethal section. In the rapid solidification of NbCr{sub 2}, metastable bcc phase formation was not observed, but deviations from NbCr{sub 2} stoichiometry or alloying with Ti was found to promote bcc phase formation by decreasing the required liquid undercooling to reach the metastable bcc liquidus and solidus. The metastable phases were characterized through x-ray diffraction (XRD), and systematic deviations from Vegard`s Rule have been defined in the three plethal sections. The metastable bcc phases decompose at temperatures >800{degrees}C to uniformly refined microstructures. As a result, novel microstructural tailoring schemes are possible through the metastable precursor microstructures.

  6. Audit Report: CR-B-95-06 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    5-06 Audit Report: CR-B-95-06 June 30, 1995 Audit of Department of Energy Support Service Contracting PDF icon Audit Report: CR-B-95-06 More Documents & Publications Audit Report: IG-0427 Inspection Report: IG-0377 Chapter 16 - Types of Contracts

  7. Audit Report: CR-FS-96-03 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    6-03 Audit Report: CR-FS-96-03 April 15, 1996 Report on Matters Identified at Strategic Petroleum Reserve During Audit of Statement of Financial Position PDF icon Audit Report: CR-FS-96-03 More Documents & Publications Audit Report: IG-0370 Inspection Report: INS-9502 Audit Report: ER-FS-99-04

  8. Audit Report: CR-B-95-02 | Department of Energy

    Energy Savers [EERE]

    5-02 Audit Report: CR-B-95-02 November 10, 1994 Audit of Management Controls Over Selected Energy Research Major System Acquisitions PDF icon Audit Report: CR-B-95-02 More Documents & Publications Audit Report: ER-B-95-04 Audit Report: IG-0389 Audit Report: IG-0543

  9. Computational prediction and characterization of single-layer CrS{sub 2}

    SciTech Connect (OSTI)

    Zhuang, Houlong L.; Blonsky, Michael N.; Hennig, Richard G.; Johannes, Michelle D.

    2014-01-13

    Using first-principles calculations, we predict a previously unreported bulk CrS{sub 2} phase that is stable against competing phases and a low energy dynamically stable single-layer CrS{sub 2} phase. We characterize the electronic, optical, and piezoelectric properties of this single-layer material. Like single-layer MoS{sub 2}, CrS{sub 2} has a direct bandgap and valley polarization. The optical bandgap of CrS{sub 2} is 1.3?eV, close to the ideal bandgap of 1.4?eV for photovoltaic applications. Applying compressive strain increases the bandgap and optical absorbance, transforming it into a promising photocatalyst for solar water splitting. Finally, we show that single-layer CrS{sub 2} possesses superior piezoelectric properties to single-layer MoS{sub 2}.

  10. NEUTRON-INDUCED SWELLING OF Fe-Cr BINARY ALLOYS IN FFTF AT ~400 DEGREES C

    SciTech Connect (OSTI)

    Garner, Francis A.; Greenwood, Lawrence R.; Okita, Taira; Sekimura, Naoto; Wolfer, W. G.

    2002-12-31

    The purpose of this effort is to determine the influence of dpa rate, He/dpa ratio and composition on the void swelling of simple binary Fe-Cr alloys. Contrary to the behavior of swelling of model fcc Fe-Cr-Ni alloys irradiated in the same FFTF-MOTA experiment, model bcc Fe-Cr alloys do not exhibit a dependence of swelling on dpa rate at approximately 400 degrees C. This is surprising in that an apparent flux-sensitivity was observed in an earlier comparative irradiation of Fe-Cr binaries conducted in EBR-II and FFTF. The difference in behavior is ascribed to the higher helium generation rates of Fe-Cr alloys in EBR-II compared to that of FFTF, and also the fact that lower dpa rates in FFTF are accompanied by progressively lower helium generation rates.

  11. CROSSED MOLECULAR BEAM STUDIES OF CHEMILUMINESCENT REACTIONS: F{sub 2} + I{sub 2}, Br{sub 2} and ICl

    SciTech Connect (OSTI)

    Kahler, C.C.; Lee, Y.T.

    1980-05-01

    The chemiluminescent bimolecular halogen-halogen reactions, F{sub 2} + I{sub 2}, Br{sub 2} and ICl, have been studied by the crossed molecular beam technique. Undispersed chemiluminescence was measured as a function of collision energy and, for I{sub 2} + F{sub 2}, as a function of the two beam pressures. Although no spectra were obtained to positively identify the emitters as IF*, ClF* and BrF*, arguments are given to support this identification. The observed reaction thresholds of 4.2 and 5.9 kcal/mole for I{sub 2} + F{sub 2} and ICl + F{sub 2} , respectively, are the same as the threshold energies for production of the stable trihalogens I{sub 2}F and ClF. This coincidence of threshold energies, as well as similar high collision energy behavior, implies that the chemiluminescent reaction proceeds via a stable trihalogen intermediate. This mechanism can explain our results and the results of other workers without resorting to a symmetry forbidden four center reaction mechanism. A threshold of 11.3 kcal/mole was found for Br{sub 2} + F{sub 2} , no threshold for Br{sub 2}F has been previously reported. Laser enhancement of the I{sub 2} + F{sub 2} reaction was attempted, but no enhancement was seen.

  12. Development of ODS FeCrAl alloys for accident-tolerant fuel cladding

    SciTech Connect (OSTI)

    Dryepondt, Sebastien N.; Hoelzer, David T.; Pint, Bruce A.; Unocic, Kinga A.

    2015-09-18

    FeCrAl alloys are prime candidates for accident-tolerant fuel cladding due to their excellent oxidation resistance up to 1400 C and good mechanical properties at intermediate temperature. Former commercial oxide dispersion strengthened (ODS) FeCrAl alloys such as PM2000 exhibit significantly better tensile strength than wrought FeCrAl alloys, which would alloy for the fabrication of a very thin (~250 m) ODS FeCrAl cladding and limit the neutronic penalty from the replacement of Zr-based alloys by Fe-based alloys. Several Fe-12-Cr-5Al ODS alloys where therefore fabricated by ball milling FeCrAl powders with Y2O3 and additional oxides such as TiO2 or ZrO2. The new Fe-12Cr-5Al ODS alloys showed excellent tensile strength up to 800 C but limited ductility. Good oxidation resistance in steam at 1200 and 1400 C was observed except for one ODS FeCrAl alloy containing Ti. Rolling trials were conducted at 300, 600 C and 800 C to simulate the fabrication of thin tube cladding and a plate thickness of ~0.6mm was reached before the formation of multiple edge cracks. Hardness measurements at different stages of the rolling process, before and after annealing for 1h at 1000 C, showed that a thinner plate thickness could likely be achieved by using a multi-step approach combining warm rolling and high temperature annealing. Finally, new Fe-10-12Cr-5.5-6Al-Z gas atomized powders have been purchased to fabricate the second generation of low-Cr ODS FeCrAl alloys. The main goals are to assess the effect of O, C, N and Zr contents on the ODS FeCrAl microstructure and mechanical properties, and to optimize the fabrication process to improve the ductility of the 2nd gen ODS FeCrAl while maintaining good mechanical strength and oxidation resistance.

  13. Progress in the material development of LiCaAlF sub 6 :Cr sup 3+ laser crystals

    SciTech Connect (OSTI)

    Michelle D. Shinn.; Chase, L.L.; Caird, J.A.; Payne, S.A.; Atherton, L.J.; Kway, W.L.

    1990-03-01

    High Cr{sup 3+} doping levels, up to 8 mole percent, and low losses have been obtained with the tunable solid-state laser material LiCaAlF{sub 6}:Cr{sup 3+} (Cr:LiCAF). Measurements and calculations show that high pumping and extraction efficiencies are possible with the improved material. 13 refs., 4 figs., 1 tab.

  14. Magnetic properties and hyperfine interactions in Cr{sub 8}, Cr{sub 7}Cd, and Cr{sub 7}Ni molecular rings from {sup 19}F-NMR

    SciTech Connect (OSTI)

    Bordonali, L.; Borsa, F.; Consorzio INSTM, Via Giusti 9, I-50121 Firenze; Department of Physics and Astronomy, Ames Laboratory, Iowa State University, Ames, Iowa 50011 ; Garlatti, E.; Dipartimento di Fisica e Scienze della Terra, Università di Parma, Viale G. P. Usberti 7 Casadei, C. M.; Department of Physics and Astronomy, Ames Laboratory, Iowa State University, Ames, Iowa 50011 ; Furukawa, Y.; Lascialfari, A.; Consorzio INSTM, Via Giusti 9, I-50121 Firenze; Department of Physics, Università degli Studi di Milano, Via Celoria 16, 20133 Milano ; Carretta, S.; Timco, G.; Winpenny, R. E. P.

    2014-04-14

    A detailed experimental investigation of the {sup 19}F nuclear magnetic resonance is made on single crystals of the homometallic Cr{sub 8} antiferromagnetic molecular ring and heterometallic Cr{sub 7}Cd and Cr{sub 7}Ni rings in the low temperature ground state. Since the F{sup −} ion is located midway between neighboring magnetic metal ions in the ring, the {sup 19}F-NMR spectra yield information about the local electronic spin density and {sup 19}F hyperfine interactions. In Cr{sub 8}, where the ground state is a singlet with total spin S{sub T} = 0, the {sup 19}F-NMR spectra at 1.7 K and low external magnetic field display a single narrow line, while when the magnetic field is increased towards the first level crossing field, satellite lines appear in the {sup 19}F-NMR spectrum, indicating a progressive increase in the Boltzmann population of the first excited state S{sub T} = 1. In the heterometallic rings, Cr{sub 7}Cd and Cr{sub 7}Ni, whose ground state is magnetic with S{sub T} = 3/2 and S{sub T} = 1/2, respectively, the {sup 19}F-NMR spectrum has a complicated structure which depends on the strength and orientation of the magnetic field, due to both isotropic and anisotropic transferred hyperfine interactions and classical dipolar interactions. From the {sup 19}F-NMR spectra in single crystals we estimated the transferred hyperfine constants for both the F{sup −}-Ni{sup 2+} and the F{sup −}-Cd{sup 2+} bonds. The values of the hyperfine constants compare well to the ones known for F{sup −}-Ni{sup 2+} in KNiF{sub 3} and NiF{sub 2} and for F{sup −}-Cr{sup 3+} in K{sub 2}NaCrF{sub 6}. The results are discussed in terms of hybridization of the 2s, 2p orbitals of the F{sup −} ion and the d orbitals of the magnetic ion. Finally, we discuss the implications of our results for the electron-spin decoherence.

  15. Ferromagnetic superexchange in insulating Cr2MoO6 by controlling orbital hybridization

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Zhu, M.; Do, D.; Dela Cruz, Clarina R.; Dun, Zhiling; Cheng, J. -G.; Goto, H.; Uwatoko, Yoshiya; Zou, T.; Zhou, Haidon D.; Mahanti, Subhendra D.; et al

    2015-09-11

    We report the magnetic and electronic structures of the newly synthesized inverse-trirutile compound Cr2MoO6. Despite the same crystal symmetry and similar bond-lengths and bond-angles to Cr2TeO6, Cr2MoO6 possesses a magnetic structure of the Cr2MoO6 type, different from that seen in Cr2TeO6. Ab-initio electronic structure calculations show that the sign and strength of the Cr-O-Cr exchange coupling is strongly influenced by the hybridization between Mo 4d and O 2p orbitals. This result further substantiates our recently proposed mechanism for tuning the exchange interaction between two magnetic atoms by modifying the electronic states of the non-magnetic atoms in the exchange path throughmore » orbital hybridization. This approach is fundamentally different from the conventional methods of controlling the exchange interaction by either carrier injection or through structural distortions.« less

  16. Probe Mssbauer spectroscopy of mechanical alloying in binary Cr?{sup 57}Fe(1 at%) system

    SciTech Connect (OSTI)

    Elsukov, Evgeny P. Kolodkin, Denis A. Ul'yanov, Alexander L. Porsev, Vitaly E.

    2014-10-27

    Solid state reactions during mechanical alloying (MA) in a binary mixture of powdered Cr and {sup 57}Fe in atomic ratio of 99:1 have been studied using {sup 57}Fe Mssbauer spectroscopy, X-ray diffraction and Auger spectrometry. The proposed model of MA includes formation of Cr(Fe){sub x}O{sub y} oxides at the contact places of Cr and Fe particles, formation of nanostructure with simultaneous dissolution of the oxides, penetration of Fe atoms along grain boundaries in close-to-boundary distorted zones of interfaces in a substitutional position, formation of the substitutional solid solution of Fe in Cr in the body of grains. It was shown that the increase in the BCC lattice parameter on increasing the milling time is due to the dissolution of oxides and formation of interstitial solid solution of O in Cr. There were established substantial differences in consumption of BCC Fe in a Mg ? Al ? Si ? Cr sequence due to the major role of chemical interaction of Mg(Al,Si,Cr) with Fe.

  17. Effects of competing magnetic interactions on the electronic transport properties of CuCrSe{sub 2}

    SciTech Connect (OSTI)

    Tewari, Girish C.; Jawaharlal Nehru University, New Delhi 110067 ; Karppinen, Maarit; Rastogi, Ashok K.

    2013-02-15

    We have synthesized single-phase samples of the CuCrSe{sub 2} phase that exhibits hexagonal-rhombohedral layered crystal structure with space group R3m. Here we present a detailed study of electronic transport and magnetic properties of CuCrSe{sub 2}. We moreover investigate the heat capacity of CuCrSe{sub 2} in comparison to that of CuCrS{sub 2}. The electrical resistivity of CuCrSe{sub 2} shows metallic-like behavior down to 2 K, while the thermoelectric power is large around 100 {mu}V K{sup -1} at 300 K. A weak anomaly in resistivity and a rounded maximum in magnetic susceptibility are observed around 55 K. No sharp transition at 55 K is observed in the heat capacity of CuCrSe{sub 2}, rather a visible maximum is seen. At low temperatures from 2 to 14 K, the magnetic heat capacity follows T{sup 2}-dependence. We tentatively believe this behavior of CuCrSe{sub 2} to be due to competing magnetic interactions between intralayer Cr atoms. The ferromagnetic Cr-Se-Cr indirect exchange among intralayer Cr atoms is enhanced in the selenide compound (that is more metallic than the sulfide compound), and competes with the antiferromagnetic Cr-Cr direct interactions. The interlayer antiferromagnetic exchange through Cu atoms leads to magnetic ordering at low temperature at T{sub N}=55 K. - Graphical abstract: Comparison of magnetic properties of CuCrSe{sub 2} and CuCrS{sub 2} indicates a sharp cusp-like anomaly in magnetic susceptibility at the antiferromagnetic transition of CuCrS{sub 2} while the maximum of CuCrSe{sub 2} is well rounded. Magnetization is reversible after field-cooling (FC) and zero-field-cooling (ZFC) for both compounds. Highlights: Black-Right-Pointing-Pointer Layered CuCrSe{sub 2} can be synthesized in both fully and partially cation-ordered forms. Black-Right-Pointing-Pointer Contrary to previously believed insulating nature the cation-ordered phase is metallic. Black-Right-Pointing-Pointer Magnetic property of CuCrSe{sub 2} is somewhat different from that of CuCrS{sub 2}. Black-Right-Pointing-Pointer Magnetization and heat capacity data suggest complex short-range ordering for CuCrSe{sub 2}.

  18. Nanoscale Phase Separation In Epitaxial Cr-Mo and Cr-V Alloy Thin Films Studied Using Atom Probe Tomography: Comparison Of Experiments And Simulation

    SciTech Connect (OSTI)

    Devaraj, Arun; Kaspar, Tiffany C.; Ramanan, Sathvik; Walvekar, Sarita K.; Bowden, Mark E.; Shutthanandan, V.; Kurtz, Richard J.

    2014-11-21

    Tailored metal alloy thin film-oxide interfaces generated using molecular beam epitaxial (MBE) deposition of alloy thin films on a single crystalline oxide substrate can be used for detailed studies of irradiation damage response on the interface structure. However presence of nanoscale phase separation in the MBE grown alloy thin films can impact the metal-oxide interface structure. Due to nanoscale domain size of such phase separation it is very challenging to characterize by conventional techniques. Therefor laser assisted atom probe tomography (APT) was utilized to study the phase separation in epitaxial Cr0.61Mo0.39, Cr0.77Mo0.23, and Cr0.32V0.68 alloy thin films grown by MBE on MgO(001) single crystal substrates. Statistical analysis, namely frequency distribution analysis and Pearson coefficient analysis of experimental data was compared with similar analyses conducted on simulated APT datasets with known extent of phase separation. Thus the presence of phase separation in Cr-Mo films, even when phase separation was not clearly observed by x-ray diffraction, and the absence of phase separation in the Cr-V film were thus confirmed.

  19. Nanoscale phase separation in epitaxial Cr-Mo and Cr-V alloy thin films studied using atom probe tomography: Comparison of experiments and simulation

    SciTech Connect (OSTI)

    Devaraj, A.; Ramanan, S.; Walvekar, S.; Bowden, M. E.; Shutthanandan, V.; Kaspar, T. C.; Kurtz, R. J.

    2014-11-21

    Tailored metal alloy thin film-oxide interfaces generated using molecular beam epitaxy (MBE) deposition of alloy thin films on a single crystalline oxide substrate can be used for detailed studies of irradiation damage response on the interface structure. However, the presence of nanoscale phase separation in the MBE grown alloy thin films can impact the metal-oxide interface structure. Due to nanoscale domain size of such phase separation, it is very challenging to characterize by conventional techniques. Therefore, laser assisted atom probe tomography (APT) was utilized to study the phase separation in epitaxial Cr{sub 0.61}Mo{sub 0.39}, Cr{sub 0.77}Mo{sub 0.23}, and Cr{sub 0.32}V{sub 0.68} alloy thin films grown by MBE on MgO(001) single crystal substrates. Statistical analysis, namely frequency distribution analysis and Pearson coefficient analysis of experimental data was compared with similar analyses conducted on simulated APT datasets with known extent of phase separation. Thus, the presence of phase separation in Cr-Mo films, even when phase separation was not clearly observed by x-ray diffraction, and the absence of phase separation in the Cr-V film were confirmed.

  20. Thermodynamic Modeling and Experimental Study of the Fe-Cr-Zr System

    SciTech Connect (OSTI)

    Yang, Ying; Tan, Lizhen; Bei, Hongbin; Busby, Jeremy T

    2013-01-01

    Wide applications of zircaloys, stainless steels and their interactions in nuclear reactors require the knowledge on phase stability and thermodynamic property of the Fe-Cr-Zr system. This knowledge is also important to develop new Zr-contained Fe-Cr ferritic steels. This work aims at developing thermodynamic models for describing phase stability and thermodynamic property of the Fe-Cr-Zr system using the Calphad approach coupled with experimental study. Thermodynamic descriptions of the Fe-Cr and Cr-Zr systems were either directly adopted or slightly modified from literature. The Fe-Zr system has been remodeled to accommodate recent ab-initio calculation of formation enthalpies of various Fe-Zr compounds. Reliable ternary experimental data and thermodynamic models were mainly available in the Zr-rich region. Therefore, selected ternary alloys located in the vicinity of the eutectic valley of (Fe,Cr,Zr) and (Fe,Cr)2Zr laves phase in the Fe-rich region have been experimentally investigated in this study. Microstructure has been examined by using scanning electron microscope, energy-dispersive Xray spectroscopy and X-ray diffraction. These experimental results, along with the literature data were then used to develop thermodynamic models for phases in the Fe-Cr-Zr system. Calculated phase equilibria and thermodynamic properties of the ternary system yield satisfactory agreements with available experimental data, which gives the confidence to use these models as building blocks for developing a Zr, Fe and Cr contained multicomponent thermodynamic database for broader applications in nuclear reactors.

  1. Electrochemical Testing of Ni-Cr-Mo-Gd Alloys

    SciTech Connect (OSTI)

    T. E. Lister; R. E. Mizia; H. Tian

    2005-10-01

    The waste package site recommendation design specified a boron-containing stainless steel, Neutronit 976/978, for fabrication of the internal baskets that will be used as a corrosion-resistant neutron-absorbing material. Recent corrosion test results gave higher-than-expected corrosion rates for this material. The material callout for these components has been changed to a Ni-Cr-Mo-Gd alloy (ASTM-B 932-04, UNS N06464) that is being developed at the Idaho National Laboratory. This report discusses the results of initial corrosion testing of this material in simulated in-package environments that could contact the fuel baskets after breach of the waste package outer barrier. The corrosion test matrix was executed using the potentiodynamic and potentiostatic electrochemical test techniques. The alloy performance shows low rates of general corrosion after initial removal of a gadolinium-rich second phase that intersects the surface. The high halide-containing test solutions exhibited greater tendencies toward initiation of crevice corrosion.

  2. Steamside Oxidation Behavior of Experimental 9%Cr Steels

    SciTech Connect (OSTI)

    Dogan, O.N.; Holcomb, G.R.; Alman, D.E.; Jablonski, P.D.

    2007-10-01

    Reducing emissions and increasing economic competitiveness require more efficient steam power plants that utilize fossil fuels. One of the major challenges in designing these plants is the availability of materials that can stand the supercritical and ultra-supercritical steam conditions at a competitive cost. There are several programs around the world developing new ferritic and austenitic steels for superheater and reheater tubes exposed to the advanced steam conditions. The new steels must possess properties better than current steels in terms of creep strength, steamside oxidation resistance, fireside corrosion resistance, and thermal fatigue resistance. This paper introduces a series of experimental 9%Cr steels containing Cu, Co, and Ti. Stability of the phases in the new steels is discussed and compared to the phases in the commercially available materials. The steels were tested under both the dry and moist conditions at 650C for their cyclical oxidation resistance. Results of oxidation tests are presented. Under the moist conditions, the experimental steels exhibited significantly less mass gain compared to the commercial P91 steel. Microstructural characterization of the scale revealed different oxide compositions.

  3. Magnetic properties of granular CoCrPt:SiO{sub 2} films as tailored by

    Office of Scientific and Technical Information (OSTI)

    Co{sup +} irradiation (Journal Article) | SciTech Connect Magnetic properties of granular CoCrPt:SiO{sub 2} films as tailored by Co{sup +} irradiation Citation Details In-Document Search Title: Magnetic properties of granular CoCrPt:SiO{sub 2} films as tailored by Co{sup +} irradiation We report on an approach to tailor the magnetic exchange in a conventional granular CoCrPt:SiO{sub 2} recording medium by irradiation with Co{sup +} ions. Irradiation at low fluences enhances the intergranular

  4. Sign reversal of transformation entropy change in Co{sub 2}Cr(Ga,Si) shape

    Office of Scientific and Technical Information (OSTI)

    memory alloys (Journal Article) | SciTech Connect Sign reversal of transformation entropy change in Co{sub 2}Cr(Ga,Si) shape memory alloys Citation Details In-Document Search Title: Sign reversal of transformation entropy change in Co{sub 2}Cr(Ga,Si) shape memory alloys In situ X-ray diffraction (XRD) measurements and compression tests were performed on Co{sub 2}Cr(Ga,Si) shape memory alloys. The reentrant martensitic transformation behavior was directly observed during the in situ XRD

  5. Epitaxial Cr on n-SrTiO3(001)An ideal Ohmic contact

    SciTech Connect (OSTI)

    Capan, Cigdem; Sun, Guangyuan; Bowden, Mark E.; Chambers, Scott A.

    2012-01-30

    Epitaxial Cr metallizations grown on n-SrTiO3(001) by molecular beam epitaxy are shown to result in an ordered interface with Cr bound to O in the terminal TiO2 layer, no reduction of the SrTiO3, and a near-perfect Ohmic contact. Cr/n-SrTiO3(001) thus constitutes an ideal interface between a pure metal and wide gap oxide in which interface redox chemistry does not occur, and the Fermi level remains unpinned.

  6. Epitaxial Cr on n-SrTiO{sub 3}(001) - An ideal Ohmic contact

    SciTech Connect (OSTI)

    Capan, C.; Sun, G. Y.; Bowden, M. E.; Chambers, S. A.

    2012-01-30

    Epitaxial Cr metallizations grown on n-SrTiO{sub 3}(001) by molecular beam epitaxy are shown to result in an ordered interface with Cr bound to O in the terminal TiO{sub 2} layer, no reduction of the SrTiO{sub 3}, and a near-perfect Ohmic contact. Cr/n-SrTiO{sub 3}(001) thus constitutes an ideal interface between a pure metal and wide gap oxide in which interface redox chemistry does not occur, and the Fermi level remains unpinned.

  7. Hydrothermal synthesis and magnetic properties of ErCrO{sub 4} nanoparticles

    SciTech Connect (OSTI)

    Sundarayya, Y. Kumar, K. Ashwini Sondge, Rajesh Srinath, S. Kaul, S. N.

    2014-04-24

    Homogeneous single phase ErCrO{sub 4} nanoparticles have been synthesized by a modified sol-gel followed by hydrothermal method. X-ray diffraction reveals that the compound crystallizes into tetragonal structure with space group I41/amd. The average crystallite size was estimated to be 21(1) nm. Morphological analysis of the sample confirms uniform particles of size 20 nm. DC magnetic measurements show that ErCrO{sub 4} undergoes a paramagnetic-antiferromagnetic transition at 16 K, due to the superexchange Er-O-Cr-O-Er antiferromagnetic interactions.

  8. CASL - Mixing and non-stoichiometry in Fe-Ni-Cr-Zn-O spinel compounds:

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Density functional theory calculations Mixing and non-stoichiometry in Fe-Ni-Cr-Zn-O spinel compounds: Density functional theory calculations Mixing and non-stoichiometry in Fe-Ni-Cr-Zn-O spinel compounds: Density functional theory calculations D.A. Andersson and C.R. Stanek Materials Science and Technology Division Los Alamos National Laboratory Density functional theory (DFT) calculations have been employed to better understand the thermodynamic properties of AB2O4 (where A=Fe2+, Ni2+ or

  9. The effect of f[subscript O2] on the partitioning and valence of V and Cr

    Office of Scientific and Technical Information (OSTI)

    in garnet/melt pairs and the relation to terrestrial mantle V and Cr content (Journal Article) | SciTech Connect Journal Article: The effect of f[subscript O2] on the partitioning and valence of V and Cr in garnet/melt pairs and the relation to terrestrial mantle V and Cr content Citation Details In-Document Search Title: The effect of f[subscript O2] on the partitioning and valence of V and Cr in garnet/melt pairs and the relation to terrestrial mantle V and Cr content Chromium and vanadium

  10. Audit Report: CR-B-97-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    1 Audit Report: CR-B-97-01 October 22, 1996 Audit of Department of Energy's Warehouse Space The downsizing of Department of Energy (Department) facilities as a result of the end of ...

  11. Audit Report: CR-B-95-05 | Department of Energy

    Broader source: Energy.gov (indexed) [DOE]

    of the Federal Enegy Regulatory Commission's Office of Chief Accountant Audit Report: CR-B-95-05 More Documents & Publications Audit Report: IG-0811 Audit Manual Audit Report:...

  12. Ultrathin nanosheets of CrSiTe3. A semiconducting two-dimensional...

    Office of Scientific and Technical Information (OSTI)

    In this work we for the first time exfoliate the CrSiTe3, a bulk ferromagnetic semiconductor, to mono- and few-layer 2D crystals onto a SiSiO2 substrate. The Raman spectra show ...

  13. Microstructural Stability of 9-12 Cr Steels at Elevated Temperatures

    SciTech Connect (OSTI)

    Dogan, Omer N.; Hawk, Jeffrey A.

    2005-09-01

    The objective of this report is to explore new substitutional solute solution (Cu, Co) and precipitate (TiC) hardening mechanisms for improved strength of 9-12 Cr martensitic steels.

  14. Audit Report: CR-B-97-04 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Audit Report: CR-B-97-04 More Documents & Publications Audit of Selected Hazardous Waste Remedial Actions Program Costs, ER-B-97-04 Audit Report: IG-0443 Inspection Report: IG-0369

  15. Effects of Cr/Zn Substitutions on Dielectric Properties of CaCu{sub

    Office of Scientific and Technical Information (OSTI)

    3}Ti{sub 4}O{sub 12}(CCTO) Ceramics (Journal Article) | SciTech Connect Effects of Cr/Zn Substitutions on Dielectric Properties of CaCu{sub 3}Ti{sub 4}O{sub 12}(CCTO) Ceramics Citation Details In-Document Search Title: Effects of Cr/Zn Substitutions on Dielectric Properties of CaCu{sub 3}Ti{sub 4}O{sub 12}(CCTO) Ceramics Effects of Zn and Cr substitutions on dielectric properties of CaCu{sub 3-x}Zn{sub x}Ti{sub 4-y}Cr{sub y}O{sub 12} ceramics are reported. Dielectric measurements at room

  16. In Situ Long-Term Reductive Bioimmobilization of Cr(VI) in Groundwater...

    Office of Scientific and Technical Information (OSTI)

    injection into Cr(VI)-contaminated groundwater stimulates an average increase in biomass by up to 50 times, from-5105 to 2.5107 cellsmL. The results also show a...

  17. Half-metallic ferromagnetism in Cr-doped semiconducting Ge-chalcogenide: Density functional approach

    SciTech Connect (OSTI)

    Saini, Hardev S.; Singh, Mukhtiyar; Thakur, Jyoti; Kashyap, Manish K.

    2014-04-24

    A supercell approach has been used to calculate the electronic and magnetic properties of Cr-doped Ge chalcogenide, Ge{sub 1−x}Cr{sub x}Te (x = 0.25 and 0.125). The calculations have been performed using full potential Linear Augmented Plane Wave (FPLAPW) method within generalized gradient approximation (GGA) as exchange-correlation (XC) potential. The calculated results show that the doping of Cr induces the 100% spin polarization at Fermi level (EF) and showed the robust half metallic ferromagnetism in this compound. Thus, the compound at both dopant concentrations behave as dilute magnetic semiconductor (DMS) showing metallic property in majority and semiconducting for minority spin channels which is best suited for spintronic applications. The total magnetic moments of this compound are mainly due to Cr-d states present at E{sup F} with negligible contribution from electronic states of other atoms.

  18. Demonstration of a Full-core Reactivity Equivalence for FeCrAl...

    Office of Scientific and Technical Information (OSTI)

    Demonstration of a Full-core Reactivity Equivalence for FeCrAl Enhanced Accident Tolerant Fuel in BWRs Citation Details In-Document Search Title: Demonstration of a Full-core ...

  19. Flat panel display using Ti-Cr-Al-O thin film

    DOE Patents [OSTI]

    Jankowski, Alan F.; Schmid, Anthony P.

    2002-01-01

    Thin films of Ti--Cr--Al--O are used as a resistor material. The films are rf sputter deposited from ceramic targets using a reactive working gas mixture of Ar and O.sub.2. Resistivity values from 10.sup.4 to 10.sup.10 Ohm-cm have been measured for Ti--Cr--Al--O film <1 .mu.m thick. The film resistivity can be discretely selected through control of the target composition and the deposition parameters. The application of Ti--Cr--Al--O as a thin film resistor has been found to be thermodynamically stable, unlike other metal-oxide films. The Ti--Cr--Al--O film can be used as a vertical or lateral resistor, for example, as a layer beneath a field emission cathode in a flat panel display; or used to control surface emissivity, for example, as a coating on an insulating material such as vertical wall supports in flat panel displays.

  20. Process for producing Ti-Cr-Al-O thin film resistors

    DOE Patents [OSTI]

    Jankowski, Alan F.; Schmid, Anthony P.

    2001-01-01

    Thin films of Ti-Cr-Al-O are used as a resistor material. The films are rf sputter deposited from ceramic targets using a reactive working gas mixture of Ar and O.sub.2. Resistivity values from 10.sup.4 to 10.sup.10 Ohm-cm have been measured for Ti-Cr-Al-O film <1 .mu.m thick. The film resistivity can be discretely selected through control of the target composition and the deposition parameters. The application of Ti-Cr-Al-O as a thin film resistor has been found to be thermodynamically stable, unlike other metal-oxide films. The Ti-Cr-Al-O film can be used as a vertical or lateral resistor, for example, as a layer beneath a field emission cathode in a flat panel display; or used to control surface emissivity, for example, as a coating on an insulating material such as vertical wall supports in flat panel displays.

  1. A pseudo binary y-Gd solidification diagram for Ni-Cr-Mo-Gd alloys...

    Office of Scientific and Technical Information (OSTI)

    Title: A pseudo binary y-Gd solidification diagram for Ni-Cr-Mo-Gd alloys. No abstract prepared. Authors: Dupont, John Neuman 1 ; Minicozzi, Michael J. 1 ; Robino, Charles ...

  2. Optimizing Cr(VI) and Tc(VII) remediation through nano-scale biomineral engineering

    SciTech Connect (OSTI)

    Cutting, R. S.; Coker, V. S.; Telling, N. D.; Kimber, R. L.; Pearce, C. I.; Ellis, B.; Lawson, R; van der Laan, G.; Pattrick, R.A.D.; Vaughan, D.J.; Arenholz, E.; Lloyd, J. R.

    2009-09-09

    To optimize the production of biomagnetite for the bioremediation of metal oxyanion contaminated waters, the reduction of aqueous Cr(VI) to Cr(III) by two biogenic magnetites and a synthetic magnetite was evaluated under batch and continuous flow conditions. Results indicate that nano-scale biogenic magnetite produced by incubating synthetic schwertmannite powder in cell suspensions of Geobacter sulfurreducens is more efficient at reducing Cr(VI) than either biogenic nano-magnetite produced from a suspension of ferrihydrite 'gel' or synthetic nano-scale Fe{sub 3}O{sub 4} powder. Although X-ray Photoelectron Spectroscopy (XPS) measurements obtained from post-exposure magnetite samples reveal that both Cr(III) and Cr(VI) are associated with nanoparticle surfaces, X-ray Magnetic Circular Dichroism (XMCD) studies indicate that some Cr(III) has replaced octahedrally coordinated Fe in the lattice of the magnetite. Inductively Coupled Plasma-Atomic Emission Spectrometry (ICP-AES) measurements of total aqueous Cr in the associated solution phase indicated that, although the majority of Cr(III) was incorporated within or adsorbed to the magnetite samples, a proportion ({approx}10-15 %) was released back into solution. Studies of Tc(VII) uptake by magnetites produced via the different synthesis routes also revealed significant differences between them as regards effectiveness for remediation. In addition, column studies using a {gamma}-camera to obtain real time images of a {sup 99m}Tc(VII) radiotracer were performed to visualize directly the relative performances of the magnetite sorbents against ultra-trace concentrations of metal oxyanion contaminants. Again, the magnetite produced from schwertmannite proved capable of retaining more ({approx}20%) {sup 99m}Tc(VII) than the magnetite produced from ferrihydrite, confirming that biomagnetite production for efficient environmental remediation can be fine-tuned through careful selection of the initial Fe(III) mineral substrate supplied to Fe(III)-reducing bacteria.

  3. Heat treatment of NiCrFe alloy to optimize resistance to intergrannular stress corrosion

    DOE Patents [OSTI]

    Steeves, Arthur F.; Bibb, Albert E.

    1984-01-01

    A process of producing a NiCrFe alloy having a high resistance to stress corrosion cracking comprising heating a NiCrFe alloy to a temperature sufficient to enable the carbon present in the alloy body in the form of carbide deposits to enter into solution, rapidly cool the alloy body, and heat the cooled body to a temperature between 1100.degree. to 1500.degree. F. for about 1 to 30 hours.

  4. Audit Report: CR-B-97-03 | Department of Energy

    Energy Savers [EERE]

    3 Audit Report: CR-B-97-03 May 6, 1997 Followup Audit on the Procurement of Support Services for the Energy Information Administration PDF icon Audit Report: CR-B-97-03 More Documents & Publications Aligning Contract Incentives & Contract Mgt Trends - David Leotta, Director, Office of Contract Management, OAPM Update on Procurement Opportunities and Acquisition Process OPAM Policy Acquisition Guides

  5. Surface modification to improve fireside corrosion resistance of Fe-Cr ferritic steels

    DOE Patents [OSTI]

    Park, Jong-Hee (Clarendon Hills, IL); Natesan, Krishnamurti (Naperville, IL); Rink, David L. (Mokena, IL)

    2010-03-16

    An article of manufacture and a method for providing an Fe--Cr ferritic steel article of manufacture having a surface layer modification for corrosion resistance. Fe--Cr ferritic steels can be modified to enhance their corrosion resistance to liquid coal ash and other chemical environments, which have chlorides or sulfates containing active species. The steel is modified to form an aluminide/silicide passivating layer to reduce such corrosion.

  6. Ultrathin nanosheets of CrSiTe3. A semiconducting two-dimensional

    Office of Scientific and Technical Information (OSTI)

    ferromagnetic material (Journal Article) | SciTech Connect Ultrathin nanosheets of CrSiTe3. A semiconducting two-dimensional ferromagnetic material Citation Details In-Document Search This content will become publicly available on November 27, 2016 Title: Ultrathin nanosheets of CrSiTe3. A semiconducting two-dimensional ferromagnetic material Finite range ferromagnetism and antiferromagnetism in two-dimensional (2D) systems within an isotropic Heisenberg model at non-zero temperature were

  7. Heat treatment of NiCrFe alloy 600 to optimize resistance to intergranular stress corrosion

    DOE Patents [OSTI]

    Steeves, A.F.; Bibb, A.E.

    A process of producing a NiCrFe alloy having a high resistance to stress corrosion cracking comprises heating a NiCrFe alloy to a temperature sufficient to enable the carbon present in the alloy body in the form of carbide deposits to enter into solution, rapidly cooling the alloy body, and heating the cooled body to a temperature between 1100 to 1500/sup 0/F for about 1 to 30 hours.

  8. Ultrathin nanosheets of CrSiTe3. A semiconducting two-dimensional ferromagnetic material

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Lin, Ming -Wei; Zhung, Houlong L.; Yan, Jiaqiang; Ward, Thomas Zac; Puretzky, Alexander A.; Rouleau, Christopher M.; Gai, Zheng; Liang, Liangbo; Meunier, Vincent; Ganesh, Panchapakesan; et al

    2015-11-27

    Finite range ferromagnetism and antiferromagnetism in two-dimensional (2D) systems within an isotropic Heisenberg model at non-zero temperature were originally proposed to be impossible. However, recent theoretical studies using an Ising model have recently shown that 2D magnetic crystals can exhibit magnetism. Experimental verification of existing 2D magnetic crystals in this system has remained elusive. In this work we for the first time exfoliate the CrSiTe3, a bulk ferromagnetic semiconductor, to mono- and few-layer 2D crystals onto a Si/SiO2 substrate. The Raman spectra show the good stability and high quality of the exfoliated flakes, consistent with the computed phonon spectra ofmore » 2D CrSiTe3, giving a strong evidence for the existence of 2D CrSiTe3 crystals. When the thickness of the CrSiTe3 crystals is reduced to few-layers, we observed a clear change in resistivity at 80~120 K, consistent with the theoretical calculations on the Curie temperature (Tc) of ~80 K for the magnetic ordering of 2D CrSiTe3 crystals. As a result, the ferromagnetic mono- and few-layer 2D CrSiTe3 indicated here should enable numerous applications in nano-spintronics.« less

  9. Radiation tolerance of neutron-irradiated model Fe-Cr-Al alloys

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Field, Kevin G.; Hu, Xunxiang; Littrell, Kenneth C.; Yamamoto, Yukinori; Snead, Lance Lewis

    2015-07-14

    The Fe Cr Al alloy system has the potential to form an important class of enhanced accident-tolerant cladding materials in the nuclear power industry owing to the alloy system's higher oxidation resistance in high-temperature steam environments compared with traditional zirconium-based alloys. However, radiation tolerance of Fe Cr Al alloys has not been fully established. In this study, a series of Fe Cr Al alloys with 10 18 wt % Cr and 2.9 4.9 wt % Al were neutron irradiated at 382 C to 1.8 dpa to investigate the irradiation-induced microstructural and mechanical property evolution as a function of alloy composition.more » Dislocation loops with Burgers vector of a/2 111 and a 100 were detected and quantified. Results indicate precipitation of Cr-rich is primarily dependent on the bulk chromium composition. Mechanical testing of sub-size-irradiated tensile specimens indicates the hardening response seen after irradiation is dependent on the bulk chromium composition. Furthermore, a structure property relationship was developed; it indicated that the change in yield strength after irradiation is caused by the formation of these radiation-induced defects and is dominated by the large number density of Cr-rich α' precipitates at sufficiently high chromium contents after irradiation.« less

  10. Networks of ultrasmall Pd/Cr bilayer nanowires as high performance hydrogen sensors.

    SciTech Connect (OSTI)

    Zeng, X.-Q.; Wang, Y.-L.; Deng, H.; Latimer, M. L.; Xiao, Z.-L.; Pearson, J.; Xu, T.; Wang, H.-H.; Welp, U.; Crabtree, G. W.; Kwok, W.-K.

    2011-01-01

    The newly developed hydrogen sensor, based on a network of ultrasmall pure palladium nanowires sputter-deposited on a filtration membrane, takes advantage of single palladium nanowires' characteristics of high speed and sensitivity while eliminating their nanofabrication obstacles. However, this new type of sensor, like the single palladium nanowires, cannot distinguish hydrogen concentrations above 3%, thus limiting the potential applications of the sensor. This study reports hydrogen sensors based on a network of ultrasmall Cr-buffered Pd (Pd/Cr) nanowires on a filtration membrane. These sensors not only are able to outperform their pure Pd counterparts in speed and durability but also allow hydrogen detection at concentrations up to 100%. The new networks consist of a thin layer of palladium deposited on top of a Cr adhesion layer 1-3 nm thick. Although the Cr layer is insensitive to hydrogen, it enables the formation of a network of continuous Pd/Cr nanowires with thicknesses of the Pd layer as thin as 2 nm. The improved performance of the Pd/Cr sensors can be attributed to the increased surface area to volume ratio and to the confinement-induced suppression of the phase transition from Pd/H solid solution ({alpha}-phase) to Pd hydride ({beta}-phase).

  11. Radiation tolerance of neutron-irradiated model Fe-Cr-Al alloys

    SciTech Connect (OSTI)

    Field, Kevin G.; Hu, Xunxiang; Littrell, Kenneth C.; Yamamoto, Yukinori; Snead, Lance Lewis

    2015-07-14

    The Fe Cr Al alloy system has the potential to form an important class of enhanced accident-tolerant cladding materials in the nuclear power industry owing to the alloy system's higher oxidation resistance in high-temperature steam environments compared with traditional zirconium-based alloys. However, radiation tolerance of Fe Cr Al alloys has not been fully established. In this study, a series of Fe Cr Al alloys with 10 18 wt % Cr and 2.9 4.9 wt % Al were neutron irradiated at 382 C to 1.8 dpa to investigate the irradiation-induced microstructural and mechanical property evolution as a function of alloy composition. Dislocation loops with Burgers vector of a/2 111 and a 100 were detected and quantified. Results indicate precipitation of Cr-rich is primarily dependent on the bulk chromium composition. Mechanical testing of sub-size-irradiated tensile specimens indicates the hardening response seen after irradiation is dependent on the bulk chromium composition. Furthermore, a structure property relationship was developed; it indicated that the change in yield strength after irradiation is caused by the formation of these radiation-induced defects and is dominated by the large number density of Cr-rich α' precipitates at sufficiently high chromium contents after irradiation.

  12. Microstructure and Mechanical Properties of n-irradiated Fe-Cr Model Alloys

    SciTech Connect (OSTI)

    Matijasevic, Milena; Al Mazouzi, Abderrahim

    2008-07-01

    High chromium ( 9-12 wt %) ferritic/martensitic steels are candidate structural materials for future fusion reactors and other advanced systems such as accelerator driven systems (ADS). Their use for these applications requires a careful assessment of their mechanical stability under high energy neutron irradiation and in aggressive environments. In particular, the Cr concentration has been shown to be a key parameter to be optimized in order to guarantee the best corrosion and swelling resistance, together with the least embrittlement. In this work, the characterization of the neutron irradiated Fe-Cr model alloys with different Cr % with respect to microstructure and mechanical tests will be presented. The behavior of Fe-Cr alloys have been studied using tensile tests at different temperature range ( from -160 deg. C to 300 deg. C). Irradiation-induced microstructure changes have been studied by TEM for two different irradiation doses at 300 deg. C. The density and the size distribution of the defects induced have been determined. The tensile test results indicate that Cr content affects the hardening behavior of Fe-Cr binary alloys. Hardening mechanisms are discussed in terms of Orowan type of approach by correlating TEM data to the measured irradiation hardening. (authors)

  13. Electronic structure, magnetism, and antisite disorder in CoFeCrGe and CoMnCrAl quaternary Heusler alloys

    SciTech Connect (OSTI)

    Enamullah, .; Venkateswara, Y.; Gupta, Sachin; Varma, Manoj Raama; Singh, Prashant; Suresh, K. G.; Alam, Aftab

    2015-12-10

    In this study, we present a combined theoretical and experimental study of two quaternary Heusler alloys CoFeCrGe (CFCG) and CoMnCrAl (CMCA), promising candidates for spintronics applications. Magnetization measurement shows the saturation magnetization and transition temperature to be 3 μB, 866 K and 0.9 μB, 358 K for CFCG and CMCA respectively. The magnetization values agree fairly well with our theoretical results and also obey the Slater-Pauling rule, a prerequisite for half metallicity. A striking difference between the two systems is their structure; CFCG crystallizes in fully ordered Y-type structure while CMCA has L21 disordered structure. The antisite disorder adds a somewhat unique property to the second compound, which arises due to the probabilistic mutual exchange of Al positions with Cr/Mn and such an effect is possibly expected due to comparable electronegativities of Al and Cr/Mn. Ab initio simulation predicted a unique transition from half metallic ferromagnet to metallic antiferromagnet beyond a critical excess concentration of Al in the alloy.

  14. Electronic structure, magnetism, and antisite disorder in CoFeCrGe and CoMnCrAl quaternary Heusler alloys

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Enamullah, .; Venkateswara, Y.; Gupta, Sachin; Varma, Manoj Raama; Singh, Prashant; Suresh, K. G.; Alam, Aftab

    2015-12-10

    In this study, we present a combined theoretical and experimental study of two quaternary Heusler alloys CoFeCrGe (CFCG) and CoMnCrAl (CMCA), promising candidates for spintronics applications. Magnetization measurement shows the saturation magnetization and transition temperature to be 3 μB, 866 K and 0.9 μB, 358 K for CFCG and CMCA respectively. The magnetization values agree fairly well with our theoretical results and also obey the Slater-Pauling rule, a prerequisite for half metallicity. A striking difference between the two systems is their structure; CFCG crystallizes in fully ordered Y-type structure while CMCA has L21 disordered structure. The antisite disorder adds amore » somewhat unique property to the second compound, which arises due to the probabilistic mutual exchange of Al positions with Cr/Mn and such an effect is possibly expected due to comparable electronegativities of Al and Cr/Mn. Ab initio simulation predicted a unique transition from half metallic ferromagnet to metallic antiferromagnet beyond a critical excess concentration of Al in the alloy.« less

  15. Magnetic excitations in the spin-1/2 triangular-lattice antiferromagnet Cs2CuBr4

    SciTech Connect (OSTI)

    Zvyagin, S. A.; Ozerov, M.; Kamenskyi, D.; Wosnitza, J.; Krzystek, J.; Yoshizawa, D.; Hagiwara, M.; Hu, Rongwei; Ryu, Hyejin; Petrovic, C.; Zhitomirsky, M. E.

    2015-11-27

    We present on high- field electron spin resonance (ESR) studies of magnetic excitations in the spin- 1/2 triangular-lattice antiferromagnet Cs2CuBr4. Frequency- field diagrams of ESR excitations are measured for different orientations of magnetic fields up to 25 T. We show that the substantial zero- field energy gap, Δ ≈ 9.5 K, observed in the low-temperature excitation spectrum of Cs2CuBr4 [Zvyagin et al:, Phys. Rev. Lett. 112, 077206 (2014)], is present well above TN. Noticeably, the transition into the long-range magnetically ordered phase does not significantly affect the size of the gap, suggesting that even below TN the high-energy spin dynamics in Cs2CuBr4 is determined by short-range-order spin correlations. The experimental data are compared with results of model spin-wave-theory calculations for spin-1/2 triangle-lattice antiferromagnet.

  16. Communication: Transfer ionization in a thermal reaction of a cation and anion: Ar{sup +} with Br{sup −} and I{sup −}

    SciTech Connect (OSTI)

    Shuman, Nicholas S.; Miller, Thomas M.; Viggiano, Albert A.; Johnsen, Rainer

    2013-11-07

    We present experimental evidence that reactions of argon cations Ar{sup +} with the halogen anions Br{sup −} and I{sup −} do not occur exclusively by mutual neutralization, but also produce the cations Br{sup +} or I{sup +} ions by transfer ionization (TI). The experiments were carried out in flowing-afterglow plasmas at gas temperatures between and 300 and 500 K, and employed a variant of the Variable Electron and Neutral Density Attachment Mass Spectrometry method. The measured TI rate coefficients are 1.9 ± 0.6 × 10{sup −9} cm{sup 3} s{sup −1} and 1.1 ± {sub 0.3}{sup 0.8}× 10{sup −9} cm{sup 3} s{sup −1} for the Br{sup −} and I{sup −} reactions, respectively. We find that the TI rate coefficients decline with temperature as T{sup −0.5} to T{sup −1}. No indication of TI was found in the reaction with Cl{sup −}, where it is endoergic.

  17. Thermal conductivity of nitride films of Ti, Cr, and W deposited by reactive magnetron sputtering

    SciTech Connect (OSTI)

    Jagannadham, Kasichainula

    2015-05-15

    Nitride films of Ti, Cr, and W were deposited using reactive magnetron sputtering from metal targets in argon and nitrogen plasma. TiN films with (200) orientation were achieved on silicon (100) at the substrate temperature of 500 and 600?C. The films were polycrystalline at lower temperature. An amorphous interface layer was observed between the TiN film and Si wafer deposited at 600?C. TiN film deposited at 600?C showed the nitrogen to Ti ratio to be near unity, but films deposited at lower temperature were nitrogen deficient. CrN film with (200) orientation and good stoichiometry was achieved at 600?C on Si(111) wafer but the film deposited at 500?C showed cubic CrN and hexagonal Cr{sub 2}N phases with smaller grain size and amorphous back ground in the x-ray diffraction pattern. An amorphous interface layer was not observed in the cubic CrN film on Si(111) deposited at 600?C. Nitride film of tungsten deposited at 600?C on Si(100) wafer was nitrogen deficient, contained both cubic W{sub 2}N and hexagonal WN phases with smaller grain size. Nitride films of tungsten deposited at 500?C were nonstoichiometric and contained cubic W{sub 2}N and unreacted W phases. There was no amorphous phase formed along the interface for the tungsten nitride film deposited at 600?C on the Si wafer. Thermal conductivity and interface thermal conductance of all the nitride films of Ti, Cr, and W were determined by transient thermoreflectance technique. The thermal conductivity of the films as function of deposition temperature, microstructure, nitrogen stoichiometry and amorphous interaction layer at the interface was determined. Tungsten nitride film containing both cubic and hexagonal phases was found to exhibit much higher thermal conductivity and interface thermal conductance. The amorphous interface layer was found to reduce effective thermal conductivity of TiN and CrN films.

  18. Influence of the hydration by the environmental humidity on the metallic speciation and the photocatalytic activity of Cr/MCM-41

    SciTech Connect (OSTI)

    Elías, Verónica R.; Sabre, Ema V.; Winkler, Elin L.; Andrini, Leandro; Requejo, Félix G.; Casuscelli, Sandra G.; Eimer, Griselda A.

    2014-05-01

    The influence of the environmental humidity on the Cr species deposited on inorganic supports like MCM-41 silicates was analyzed by UV–vis Diffuse Reflectance (UV–vis RD), Electronic Spin Resonance (ESR) and X-ray near-edge (XANES) spectroscopy. Metal speciation could be inferred, finding that prolonged exposure periods under environmental humidity provoked the reduction of the active Cr{sup 6+} species and thus, the decrease of the Cr/MCM-41 photoactivity. After the Ti loading over the Cr modified samples, Cr species and the photoactivity were not notably influenced by the humidity exposure. Thus, it could be concluded that the presence of Ti is important because the TiO{sub 2} cover protects the oxidized Cr species, stabilizing them. - Graphical abstract: The load of Ti on the Cr modified MCM-41 produces a TiO{sub 2} cover that protects the active Cr species from their reduction by the environmental humidity. - Highlights: • Spectroscopic analysis shows presence of Cr{sup 6+}/Cr{sup 5+} in calcined/re-calcined samples. • Cr{sup 3+} species increase for hydrated samples causing their photoactivity decrease. • Samples with high Cr loadings are more sensitive to environmental humidity presence. • TiO{sub 2} cover protects oxidized Cr species from their reduction by the water. • Ti is important to allow a synergistic effect and to stabilize active Cr{sup 6+}/Cr{sup 5+}.

  19. Irradiation-induced formation of a spinel phase at the FeCr/MgO interface

    SciTech Connect (OSTI)

    Xu, Yun; Yadav, Satyesh Kumar; Aguiar, Jeffery A.; Anderoglu, Osman; Baldwin, Jon Kevin; Wang, Yongqiang; Misra, Amit; Luo, Hongmei; Uberuaga, Blas P.; Li, Nan

    2015-04-27

    Oxide dispersion strengthened ferritic/martensitic alloys have attracted significant attention for their potential uses in future nuclear reactors and storage vessels, as the metal/oxide interfaces act as stable high-strength sinks for point defects while also dispersing helium. Here, in order to unravel the evolution and interplay of interface structure and chemistry upon irradiation in these types of materials, an atomically sharp FeCr/MgO interface was synthesized at 500 °C and separately annealed and irradiated with Ni3+ ions at 500 °C. After annealing, a slight enrichment of Cr atoms was observed at the interface, but no other structural changes were found. However, under irradiation, sufficient Cr diffuses across the interface into the MgO to form a Cr-enriched transition layer that contains spinel precipitates. First-principles calculations indicate that it is energetically favorable to incorporate Cr, but not Fe, substitutionally into MgO. Furthermore, our results indicate that irradiation can be used to form new phases and complexions at interfaces, which may have different radiation tolerance than the pristine structures.

  20. Production of Ni-Cr-Ti-natural fibres composite and investigation of mechanical properties

    SciTech Connect (OSTI)

    Pesmen, G.; Erol, A.

    2015-03-30

    Intermetallic materials such as Ni{sub 2}Ti, Cr{sub 2}Ti are among advanced technology materials that have outstanding mechanical and physical properties for high temperature applications. Especially creep resistance, low density and high hardness properties stand out in such intermetallics. The microstructure, mechanical properties of (%50Ni-%48Cr-%2Ti)-%10Naturel Fibres and (%64Ni-%32Cr-%4Ti)-%10Naturel Fibres powders were investigated using specimens produced by tube furnace sintering at 1000-1200-1400C temperature. A composite consisting of ternary additions, a metallic phase, Ti,Cr and Ni have been prepared under Ar shroud and then tube furnace sintered. XRD, SEM (Scanning Electron Microscope), were investigated to characterize the properties of the specimens. Experimental results carried out for composition (%64Ni-%32Cr-%4Ti)-%10Naturel at 1400C suggest that the best properties as 112.09HV and 5,422g/cm{sup 3} density were obtained at 1400C.

  1. Enhanced piezoelectric output voltage and Ohmic behavior in Cr-doped ZnO nanorods

    SciTech Connect (OSTI)

    Sinha, Nidhi; Ray, Geeta; Godara, Sanjay; Gupta, Manoj K.; Kumar, Binay

    2014-11-15

    Highlights: • Low cost highly crystalline Cr-doped ZnO nanorods were synthesized. • Enhancement in dielectric, piezoelectric and ferroelectric properties were observed. • A high output voltage was obtained in AFM. • Cr-doping resulted in enhanced conductivity and better Ohmic behavior in ZnO/Ag contact. - Abstract: Highly crystalline Cr-doped ZnO nanorods (NRs) were synthesized by solution technique. The size distribution was analyzed by high resolution tunneling electron microscope (HRTEM) and particle size analyzer. In atomic force microscope (AFM) studies, peak to peak 8 mV output voltage was obtained on the application of constant normal force of 25 nN. It showed high dielectric constant (980) with phase transition at 69 °C. Polarization vs. electric field (P–E) loops with remnant polarization (6.18 μC/cm{sup 2}) and coercive field (0.96 kV/cm) were obtained. In I–V studies, Cr-doping was found to reduce the rectifying behavior in the Ag/ZnO Schottky contact which is useful for field effect transistor (FET) and solar cell applications. With these excellent properties, Cr-doped ZnO NRs can be used in nanopiezoelectronics, charge storage and ferroelectric applications.

  2. Ablation and cone formation mechanism on CR-39 by ArF laser irradiation

    SciTech Connect (OSTI)

    Shakeri Jooybari, B. E-mail: hafarideh@aut.ac.ir; Afarideh, H. E-mail: hafarideh@aut.ac.ir; Lamehi-Rachti, M.; Ghergherehchi, M.

    2015-03-07

    In this work, chemical properties, surface modification, and micro structures formation on ablated polyallyl di-glycol carbonate (CR-39) polymer by ArF laser irradiation (λ = 193 nm) at various fluences and pulse number were investigated. CR-39 samples have been irradiated with an ArF laser (193 nm) at a repetition rate of 1 Hz. Threshold fluence of ablation and effective absorption coefficient of CR-39 were determined. Conical microstructures (Taylor cone) formed on laser-ablated CR-39 exhibit: smooth, Taylor cone shape walls and sharp tips together with interference and well defined fringe-structure with a period of 230 nm, around cone base. Mechanism of cone formation and cone evolution of CR-39 ablated surface were investigated by change of fluences (at a given pulse number) and pulse number (at a given fluence). Cone height, cone base, and region of interface were increased in micrometer steps by increasing the total fluence. Depression on the base of the cone and the circular fringe were simulated. FTIR spectra were measured and energy dispersive x-ray analysis of irradiated and un-irradiated samples was performed.

  3. Irradiation-induced formation of a spinel phase at the FeCr/MgO interface

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Xu, Yun; Yadav, Satyesh Kumar; Aguiar, Jeffery A.; Anderoglu, Osman; Baldwin, Jon Kevin; Wang, Yongqiang; Misra, Amit; Luo, Hongmei; Uberuaga, Blas P.; Li, Nan

    2015-04-27

    Oxide dispersion strengthened ferritic/martensitic alloys have attracted significant attention for their potential uses in future nuclear reactors and storage vessels, as the metal/oxide interfaces act as stable high-strength sinks for point defects while also dispersing helium. Here, in order to unravel the evolution and interplay of interface structure and chemistry upon irradiation in these types of materials, an atomically sharp FeCr/MgO interface was synthesized at 500 °C and separately annealed and irradiated with Ni3+ ions at 500 °C. After annealing, a slight enrichment of Cr atoms was observed at the interface, but no other structural changes were found. However, undermore » irradiation, sufficient Cr diffuses across the interface into the MgO to form a Cr-enriched transition layer that contains spinel precipitates. First-principles calculations indicate that it is energetically favorable to incorporate Cr, but not Fe, substitutionally into MgO. Furthermore, our results indicate that irradiation can be used to form new phases and complexions at interfaces, which may have different radiation tolerance than the pristine structures.« less

  4. Neutron inelastic scattering investigation of the magnetic excitations in Cu{sub 2}Te{sub 2}O{sub 5}X{sub 2} (X=Br,Cl)

    SciTech Connect (OSTI)

    Crowe, S.J.; Majumdar, S.; Lees, M.R.; Paul, D. McK.; Bewley, R.I.; Levett, S.J.; Ritter, C.

    2005-06-01

    Neutron inelastic scattering investigations have been performed on the spin tetrahedral system Cu{sub 2}Te{sub 2}O{sub 5}X{sub 2} (X=Cl,Br). We report the observation of magnetic excitations with a dispersive component in both compounds, associated with the three-dimensional incommensurate magnetic order that develops below T{sub N}{sup Cl}=18.2 K and T{sub N}{sup Br}=11.4 K. The excitation in Cu{sub 2}Te{sub 2}O{sub 5}Cl{sub 2} softens as the temperature approaches T{sub N}{sup Cl}, leaving diffuse quasi-elastic scattering above the transition temperature. In the bromide, the excitations are present well above T{sub N}{sup Br}, which might be attributed to the presence of a degree of low dimensional correlations above T{sub N}{sup Br} in this compound.

  5. Atom probe study of irradiation-enhanced α' precipitation in neutron-irradiated Fe–Cr model alloys

    SciTech Connect (OSTI)

    Chen, Wei -Ying; Miao, Yinbin; Wu, Yaqiao; Tomchik, Carolyn A.; Mo, Kun; Gan, Jian; Okuniewski, Maria A.; Maloy, Stuart A.; Stubbins, James F.

    2015-07-01

    Atom probe tomography (APT) was performed to study the effects of Cr concentrations, irradiation doses and irradiation temperatures on a' phase formation in Fe-Cr model alloys (10-16 at.%) irradiated at 300 and 450°C to 0.01, 0.1 and 1 dpa. For 1 dpa specimens, α' precipitates with an average radius of 1.0-1.3 nm were observed. The precipitate density varied significantly from 1.1x10²³ to 2.7x10²⁴ 1/m³, depending on Cr concentrations and irradiation temperatures. The volume fraction of α' phase in 1 dpa specimens qualitatively agreed with the phase diagram prediction. For 0.01 dpa and 0.1 dpa, frequency distribution analysis detected slight Cr segregation in high-Cr specimens, but not in Fe-10Cr specimens. Proximity histogram analysis showed that the radial Cr concentration was highest at the center of a' precipitates. For most precipitates, the Cr contents were significantly lower than that predicted by the phase diagram. The Cr concentration at precipitate center increased with increasing precipitate size.

  6. Multiband Optical Absorption Controlled by Lattice Strain in Thin-Film LaCrO3

    SciTech Connect (OSTI)

    Sushko, Peter; Qiao, Liang; Bowden, Mark E.; Varga, Tamas; Exarhos, Gregory J.; Urban, III, Frank K.; Barton, David; Chambers, Scott A.

    2013-02-11

    Experimental measurements and ab initio modeling of the optical transitions in strained G-type antiferromagnetic LaCrO3 resolve two decades of debate regarding the magnitude of the optical band gap and the character of the corresponding transitions in this material. Using time-dependent density functional theory and accounting for thermal disorder effects, we demonstrate that the fourmost prominent low-energy absorption features are due to intra-Cr t2g {eg (2.4, 3.6 eV), inter-Crt2g {t2g (4.4 eV), and inter-ion O 2p { Cr 3d (from ?5 eV) transitions and show that the excitation energies of the latter type can be strongly affected by the lattice strain.

  7. Electronic and magnetic properties of epitaxial perovskite SrCrO3(001)

    SciTech Connect (OSTI)

    Zhang, Hongliang; Du, Yingge; Sushko, Petr; Bowden, Mark E.; Shutthanandan, V.; Qiao, Liang; Cao, Guixin; Gai, Zheng; Sallis, Shawn; Piper, L.F.J.; Chambers, Scott A.

    2015-06-24

    We have investigated the intrinsic properties of SrCrO3 epitaxial thin films synthesized by molecular beam epitaxy. We find compelling evidence that SrCrO3 is a correlated metal. X-ray photoemission valence band and O K-edge x-ray absorption spectra indicate a strongly hybridized Cr3d-O2p state crossing the Fermi level, leading to metallic behavior. Comparison between valence band spectra near the Fermi level and the densities of states calculated using density functional theory (DFT) also suggests the presence of coherent and incoherent states and points to a strong electron-electron correlation effects. The magnetic susceptibility can be described by Pauli paramagnetism at temperatures above 100 K, but reveals antiferromagnetic behavior at lower temperatures resulting from orbital ordering as suggested by Ortega-San-Martin et al. [Phys. Rev. Lett. 99, 255701 (2007)].

  8. Response of 9Cr-ODS Steel to Proton Irradiation at 400 °C

    SciTech Connect (OSTI)

    Jianchao He; Farong Wan; Kumar Sridharan; Todd R. Allen; A. Certain; Y. Q. Wu

    2014-09-01

    The stability of Y–Ti–O nanoclusters, dislocation structure, and grain boundary segregation in 9Cr-ODS steels has been investigated following proton irradiation at 400 °C with damage levels up to 3.7 dpa. A slight coarsening and a decrease in number density of nanoclusters were observed as a result of irradiation. The composition of nanoclusters was also observed to change with a slight increase of Y and Cr concentration in the nanoclusters following irradiation. Size, density, and composition of the nanoclusters were investigated as a function of nanocluster size, specifically classified to three groups. In addition to the changes in nanoclusters, dislocation loops were observed after irradiation. Finally, radiation-induced enrichment of Cr and depletion of W were observed at grain boundaries after irradiation.

  9. The Preparation of an Ultrastable Mesoporous Cr(III)-MOF via Reductive

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Labilization | Center for Gas SeparationsRelevant to Clean Energy Technologies | Blandine Jerome The Preparation of an Ultrastable Mesoporous Cr(III)-MOF via Reductive Labilization Previous Next List Lian, Xizhen; Feng, Dawei; Chen, Ying-Pin; Liu, Tian-Fu; Wang, Xuan; and Zhou, Hong-Cai. The Preparation of an Ultrastable Mesoporous Cr(III)-MOF via Reductive Labilization. Chem. Sci., 6, 7044-7048 (2015). DOI: 10.1039/c5sc02587g preparation.ultrastable Abstract: Kinetic labilization of the

  10. Ti3CrCu4: A possible 2-D ferromagnetic spin fluctuating system (Journal

    Office of Scientific and Technical Information (OSTI)

    Article) | SciTech Connect SciTech Connect Search Results Journal Article: Ti3CrCu4: A possible 2-D ferromagnetic spin fluctuating system Citation Details In-Document Search Title: Ti3CrCu4: A possible 2-D ferromagnetic spin fluctuating system Authors: Dhar, S. K. [1] ; Provino, A. [2] ; Manfrinetti, P. [2] ; Kulkarni, R. [1] ; Goyal, Neeraj [1] ; Paudyal, D. [3] + Show Author Affiliations Department of Condensed Matter Physics & Materials Science, T.I.F.R., Homi Bhabha Road, Colaba,

  11. AB INITIO PHASE STABILITY AT HIGH TEMPERATURES AND PRESSURES IN THE V-Cr

    Office of Scientific and Technical Information (OSTI)

    SYSTEM (Journal Article) | SciTech Connect AB INITIO PHASE STABILITY AT HIGH TEMPERATURES AND PRESSURES IN THE V-Cr SYSTEM Citation Details In-Document Search Title: AB INITIO PHASE STABILITY AT HIGH TEMPERATURES AND PRESSURES IN THE V-Cr SYSTEM Authors: Landa, A ; Soderlind, P ; Yang, L H Publication Date: 2013-10-29 OSTI Identifier: 1116979 Report Number(s): LLNL-JRNL-645443 DOE Contract Number: W-7405-ENG-48 Resource Type: Journal Article Resource Relation: Journal Name: Physical Review

  12. Advanced ODS FeCrAl alloys for accident-tolerant fuel cladding

    SciTech Connect (OSTI)

    Dryepondt, Sebastien N; Unocic, Kinga A; Hoelzer, David T; Pint, Bruce A

    2014-09-01

    ODS FeCrAl alloys are being developed with optimum composition and properties for accident tolerant fuel cladding. Two oxide dispersion strengthened (ODS) Fe-15Cr-5Al+Y2O3 alloys were fabricated by ball milling and extrusion of gas atomized metallic powder mixed with Y2O3 powder. To assess the impact of Mo on the alloy mechanical properties, one alloy contained 1%Mo. The hardness and tensile properties of the two alloys were close and higher than the values reported for fine grain PM2000 alloy. This is likely due to the combination of a very fine grain structure and the presence of nano oxide precipitates. The nano oxide dispersion was however not sufficient to prevent grain boundary sliding at 800 C and the creep properties of the alloys were similar or only slightly superior to fine grain PM2000 alloy. Both alloys formed a protective alumina scale at 1200 C in air and steam and the mass gain curves were similar to curves generated with 12Cr-5Al+Y2O3 (+Hf or Zr) ODS alloys fabricated for a different project. To estimate the maximum temperature limit of use for the two alloys in steam, ramp tests at a rate of 5 C/min were carried out in steam. Like other ODS alloys, the two alloys showed a significant increase of the mas gains at T~ 1380 C compared with ~1480 C for wrought alloys of similar composition. The beneficial effect of Yttrium for wrought FeCrAl does not seem effective for most ODS FeCrAl alloys. Characterization of the hardness of annealed specimens revealed that the microstructure of the two alloys was not stable above 1000 C. Concurrent radiation results suggested that Cr levels <15wt% are desirable and the creep and oxidation results from the 12Cr ODS alloys indicate that a lower Cr, high strength ODS alloy with a higher maximum use temperature could be achieved.

  13. Demonstration of a Full-core Reactivity Equivalence for FeCrAl Enhanced

    Office of Scientific and Technical Information (OSTI)

    Accident Tolerant Fuel in BWRs (Conference) | SciTech Connect Demonstration of a Full-core Reactivity Equivalence for FeCrAl Enhanced Accident Tolerant Fuel in BWRs Citation Details In-Document Search Title: Demonstration of a Full-core Reactivity Equivalence for FeCrAl Enhanced Accident Tolerant Fuel in BWRs Authors: George, Nathan M [1] ; Powers, Jeffrey J [1] ; Maldonado, G Ivan [1] ; Worrall, Andrew [1] ; Terrani, Kurt A [1] + Show Author Affiliations ORNL Publication Date: 2015-01-01

  14. Development of a Full-core Reactivity Equivalence for FeCrAl Enhanced

    Office of Scientific and Technical Information (OSTI)

    Accident Tolerant Fuel in BWRs (Conference) | SciTech Connect Development of a Full-core Reactivity Equivalence for FeCrAl Enhanced Accident Tolerant Fuel in BWRs Citation Details In-Document Search Title: Development of a Full-core Reactivity Equivalence for FeCrAl Enhanced Accident Tolerant Fuel in BWRs Authors: George, Nathan M [1] ; Powers, Jeffrey J [1] ; Maldonado, G Ivan [1] ; Worrall, Andrew [1] ; Terrani, Kurt A [1] + Show Author Affiliations ORNL Publication Date: 2015-01-01 OSTI

  15. Elastic Modulus Measurement of ORNL ATF FeCrAl Alloys

    SciTech Connect (OSTI)

    Thompson, Zachary T.; Terrani, Kurt A.; Yamamoto, Yukinori

    2015-10-01

    Elastic modulus and Poissons ratio for a number of wrought FeCrAl alloys, intended for accident tolerant fuel cladding application, are determined via resonant ultrasonic spectroscopy. The results are reported as a function of temperature from room temperature to 850C. The wrought alloys were in the fully annealed and unirradiated state. The elastic modulus for the wrought FeCrAl alloys is at least twice that of Zr-based alloys over the temperature range of this study. The Poissons ratio of the alloys was 0.28 on average and increased very slightly with increasing temperature.

  16. Development and quality assessments of commercial heat production of ATF FeCrAl tubes

    SciTech Connect (OSTI)

    Yamamoto, Yukinori

    2015-09-01

    Development and quality assessment of the 2nd generation ATF FeCrAl tube production with commercial manufacturers were conducted. The manufacturing partners include Sophisticated Alloys, Inc. (SAI), Butler, PA for FeCrAl alloy casting via vacuum induction melting, Oak Ridge National Laboratory (ORNL) for extrusion process to prepare the master bars/tubes to be tube-drawn, and Rhenium Alloys, Inc. (RAI), North Ridgeville, OH, for tube-drawing process. The masters bars have also been provided to Los Alamos National Laboratory (LANL) who works with Century Tubes, Inc., (CTI), San Diego, CA, as parallel tube production effort under the current program.

  17. Ti3CrCu4: A possible 2-D ferromagnetic spin fluctuating system (Journal

    Office of Scientific and Technical Information (OSTI)

    Article) | DOE PAGES Ti3CrCu4: A possible 2-D ferromagnetic spin fluctuating system Title: Ti3CrCu4: A possible 2-D ferromagnetic spin fluctuating system Authors: Dhar, S. K. [1] ; Provino, A. [2] ; Manfrinetti, P. [2] ; Kulkarni, R. [1] ; Goyal, Neeraj [1] ; Paudyal, D. [3] + Show Author Affiliations Department of Condensed Matter Physics & Materials Science, T.I.F.R., Homi Bhabha Road, Colaba, Mumbai, 400005, India Department of Chemistry, University of Genova, Via Dodecaneso 31, 16146

  18. Uniform Corrosion of model FeCrAl Alloys in LWR Coolants (Conference) |

    Office of Scientific and Technical Information (OSTI)

    SciTech Connect Conference: Uniform Corrosion of model FeCrAl Alloys in LWR Coolants Citation Details In-Document Search Title: Uniform Corrosion of model FeCrAl Alloys in LWR Coolants Authors: Terrani, Kurt A [1] ; Kim, Young-Jin [2] ; Pint, Bruce A [1] + Show Author Affiliations ORNL General Electric (GE) Publication Date: 2015-01-01 OSTI Identifier: 1185956 DOE Contract Number: DE-AC05-00OR22725 Resource Type: Conference Resource Relation: Conference: 2015 American Nuclear Society Annual

  19. EPR and optical investigations of LaMgAl{sub 11}O{sub 19}:Cr{sup 3+} phosphor

    SciTech Connect (OSTI)

    Singh, Vijay; Sivaramaiah, G.; Rao, J.L.; Kim, S.H.

    2014-12-15

    Graphical abstract: The EPR spectrum of as-prepared LaMgAl{sub 11}O{sub 19}:Cr{sup 3+} phosphor at 110 K. - Highlights: • Using the combustion synthesis, LaMgAl{sub 11}O{sub 19}:Cr{sup 3+} phosphor has been prepared in a few minutes. • Optical investigation indicates that Cr{sup 3+} ions are present in octahedral symmetry. • The EPR signals indicate that exchange coupled Cr{sup 3+}–Cr{sup 3+} ion pairs in weakly distorted sites. - Abstract: The LaMgAl{sub 11}O{sub 19}:Cr{sup 3+} phosphor has been prepared by a low-temperature combustion synthesis method. As-prepared combustion synthesized powder was characterized using powder X-ray diffraction (XRD), diffuse reflectance (DRS), electron paramagnetic resonance (EPR) and photoluminescence (PL) studies. The X-ray diffraction pattern reveals crystalline hexagonal phases. The UV–vis diffuse reflectance spectrum exhibits three broad bands characteristic of Cr{sup 3+} ions in octahedral symmetry. The EPR spectrum exhibits several resonance signals. The signals with the effective g values at g = 4.84, 3.64 and 2.26 have been attributed to the isolated Cr{sup 3+} ions. The signal with the effective g value at g = 1.94 has been attributed to exchange coupled Cr{sup 3+}–Cr{sup 3+} ion pairs. The PL studies exhibit several bands characteristic of Cr{sup 3+} ions in octahedral symmetry.

  20. Parity violation in nuclear magnetic resonance frequencies of chiral tetrahedral tungsten complexes NWXYZ (X, Y, Z = H, F, Cl, Br or I)

    SciTech Connect (OSTI)

    Nahrwold, Sophie Berger, Robert; Clemens-Schöpf-Institute, Technical University Darmstadt, Petersenstr. 22, D-64287 Darmstadt ; Schwerdtfeger, Peter; Fachbereich Chemie, Philipps-Universität Marburg, Hans-Meerwein-Str., D-35032 Marburg

    2014-01-14

    Density functional theory within the two-component quasi-relativistic zeroth-order regular approximation (ZORA) is used to predict parity violation shifts in {sup 183}W nuclear magnetic resonance shielding tensors of chiral, tetrahedrally bonded tungsten complexes of the form NWXYZ (X, Y, Z = H, F, Cl, Br or I), as well as for the heavier systems NWHAtF and NWH(117)F for comparison. The calculations reveal that sub-mHz accuracy is required to detect such tiny effects in this class of compounds, and that parity violation effects are very sensitive to the choice of ligands.

  1. Dual and Triple Ion-Beam Irradiations of Fe, Fe(Cr) and Fe(Cr)-ODS Final Report: IAEA SMoRE CRP

    SciTech Connect (OSTI)

    Fluss, M J; Hsiung, L L; Marian, J

    2011-11-20

    Structures of nanoparticles in Fe-16Cr-4.5Al-0.3Ti-2W-0.37Y2O3 (K3) and Fe-20Cr-4.5Al-0.34Ti-0.5Y2O3 (MA956) oxide dispersion strengthened (ODS) ferritic steels produced by mechanical alloying (MA) and followed by hot extrusion have been studied using high-resolution transmission electron microscopy (HRTEM) techniques to gain insight about the formation mechanism of nanoparticles in MA/ODS steels. The observations of Y-Al-O complex-oxide nanoparticles in both ODS steels imply that decomposition of Y2O3 in association with internal oxidation of Al occurred during mechanical alloying. While the majority of oxide nanoparticles formed in both steels is Y4Al2O9, a few oxide particles of YAlO3 are also occasionally observed. These results reveal that Ti (0.3 wt %) plays an insignificant role in forming oxide nanoparticles in the presence of Al (4.5 wt %). HRTEM observations of crystalline nanoparticles larger than {approx}2 nm and amorphous or disordered cluster domains smaller than {approx}2 nm provide an insight into the formation mechanism of oxide nanoparticle in MA/ODS steels, which we believe from our observations involves a solid-state amorphous precursor followed by recrystallization. Dual ion-beam irradiations using He{sup +} + Fe{sup +8} ions were employed to gain more detailed insight about the role of nanoparticles in suppressing radiation-induced swelling. This is elaborated through TEM examinations of cavity distributions in ion-irradiated Fe-14Cr and K3-ODS ferritic steels. HRTEM observations of helium-filled cavities (helium bubbles) preferably trapped at nanoscale oxide particles and clusters in ion-irradiated K3-ODS are presented. Finally, we describe the results from triple ion-beam irradiations using H{sup +} + He{sup +} + Fe{sup +8} ions to emulate fusion first wall radiation effects. Preliminary work is reported that confirms the existence of significant hydrogen synergistic effects described earlier by Tanaka et al., for Fe(Cr) and by Wakai et al., for F82H reduced activation ferritic martensitic (RAF/M) steel. These previous results combined with our data suggest a complex new 'catalytic' mechanism whereby H interacts with the steady state population of defects and the embryonic cavities so as to accelerated cavity (void) growth in both Fe(Cr) and under special conditions in ODS steels.

  2. Ab initio study of structural stability and electronic properties of Ti{sub 1-x}Mg{sub x}Cr{sub 2} and TiMg{sub x}Cr{sub 2-x} laves phase

    SciTech Connect (OSTI)

    Sari, A. Merad, G.

    2015-03-30

    The structural stability and electronic properties of TiMgCr{sub 2} laves phase have been calculated and compared. It is found that Mg prefer to substitutes titanium than chromium. The values of entalpies of formation show that Ti{sub 1-x}Mg{sub x}Cr{sub 2} may exist for only one concentration x=0.125 and the more favorable alloy is Ti{sub 0.875}Mg{sub 0.125}Cr{sub 2}. For TiCr{sub 2}, the optimized structural parameters were in good agreement with experimental values, while for TiMgCr{sub 2}, there is not experimental data. The electronic densities of states (DOS) are given and the nature of bonds are also discussed.

  3. Understanding the solidification and microstructure evolution during CSC-MIG welding of FeCrB-based alloy

    SciTech Connect (OSTI)

    Sorour, A.A. Chromik, R.R. Gauvin, R. Jung, I.-H. Brochu, M.

    2013-12-15

    The present is a study of the solidification and microstructure of Fe28.2%Cr3.8%B1.5%Si1.5%Mn (wt.%) alloy deposited onto a 1020 plain carbon steel substrate using the controlled short-circuit metal inert gas welding process. The as-solidified alloy was a metal matrix composite with a hypereutectic microstructure. Thermodynamic calculation based on the ScheilGulliver model showed that a primary (Cr,Fe){sub 2}B phase formed first during solidification, followed by an eutectic formation of the (Cr,Fe){sub 2}B phase and a body-centered cubic Fe-based solid solution matrix, which contained Cr, Mn and Si. Microstructure analysis confirmed the formation of these phases and showed that the shape of the (Cr,Fe){sub 2}B phase was irregular plate. As the welding heat input increased, the weld dilution increased and thus the volume fraction of the (Cr,Fe){sub 2}B plates decreased while other microstructural characteristics were similar. - Highlights: We deposit FeCrB-based alloy onto plain carbon steel using the CSC-MIG process. We model the solidification behavior using thermodynamic calculation. As deposited alloy consists of (Cr,Fe){sub 2}B plates embedded in Fe-based matrix. We study the effect of the welding heat input on the microstructure.

  4. Changes induced in a ZnS:Cr-based electroluminescent waveguide structure by intrinsic near-infrared laser radiation

    SciTech Connect (OSTI)

    Vlasenko, N. A. Oleksenko, P. F.; Mukhlyo, M. A.; Veligura, L. I.

    2013-08-15

    The causes of changes that occur in a thin-film electroluminescent metal-insulator-semiconductor-insulator-metal waveguide structure based on ZnS:Cr (Cr concentration of {approx}4 Multiplication-Sign 10{sup 20} cm{sup -3}) upon lasing ({lambda} Almost-Equal-To 2.6 {mu}m) and that induce lasing cessation are studied. It is established that lasing ceases because of light-scattering inhomogeneities formed in the structure and, hence, optical losses enhance. The origin of the inhomogeneities and the causes of their formation are clarified by studying the surface topology and the crystal structure of constituent layers of the samples before and after lasing. The studies are performed by means of atomic force microscopy and X-ray radiography. It is shown that a substantial increase in the sizes of grains on the surface of the structure is the manifestation of changes induced in the ZnS:Cr film by recrystallization. Recrystallization is initiated by local heating by absorbed laser radiation in existing Cr clusters and quickened by a strong electric field (>1 MV cm{sup -1}). The changes observed in the ZnS:Cr film are as follows: the textured growth of ZnS crystallites, an increase in the content of Cr clusters, and the appearance of some CrS and a rather high ZnO content. Some ways for improving the stability of lasing in the ZnS:Cr-based waveguide structures are proposed.

  5. Ion irradiation testing and characterization of FeCrAl candidate alloys

    SciTech Connect (OSTI)

    Anderoglu, Osman; Aydogan, Eda; Maloy, Stuart Andrew; Wang, Yongqiang

    2014-10-29

    The Fuel Cycle Research and Development program’s Advanced Fuels Campaign has initiated a multifold effort aimed at facilitating development of accident tolerant fuels. This effort involves development of fuel cladding materials that will be resistant to oxidizing environments for extended period of time such as loss of coolant accident. Ferritic FeCrAl alloys are among the promising candidates due to formation of a stable Al₂O₃ oxide scale. In addition to being oxidation resistant, these promising alloys need to be radiation tolerant under LWR conditions (maximum dose of 10-15 dpa at 250 – 350°C). Thus, in addition to a number of commercially available alloys, nuclear grade FeCrAl alloys developed at ORNL were tested using high energy proton irradiations and subsequent characterization of irradiation hardening and damage microstructure. This report summarizes ion irradiation testing and characterization of three nuclear grade FeCrAl cladding materials developed at ORNL and four commercially available Kanthal series FeCrAl alloys in FY14 toward satisfying FCRD campaign goals.

  6. Cr-doped TiSe2 - A layered dichalcogenide spin glass

    SciTech Connect (OSTI)

    Luo, Huixia; Tao, Jing; Krizan, Jason W.; Seibel, Elizabeth M.; Xie, Weiwei; Sahasrabudhe, Girija S.; Bergman, Susanna L.; Phelan, Brendan F.; Wang, Zhen; Zhang, Jiandi; Cava, R. J.

    2015-09-17

    We report the magnetic characterization of the Cr-doped layered dichalcogenide TiSe2. The temperature dependent magnetic susceptibilities are typical of those seen in geometrically frustrated insulating antiferromagnets. The Cr moment is close to the spin-only value, and the Curie–Weiss temperatures (θcw) are between –90 and –230 K. Freezing of the spin system, which is glassy, characterized by peaks in the ac and dc susceptibility and specific heat, does not occur until below T/θcw = 0.05. The CDW transition seen in the resistivity for pure TiSe2 is still present for 3% Cr substitution but is absent by 10% substitution, above which the materials are metallic and p-type. Structural refinements, magnetic characterization, and chemical considerations indicate that the materials are of the type Ti1–xCrxSe2-x/2 for 0 ≤ x ≤ 0.6.

  7. Oxidation resistance of 9-12% Cr steels: effect of rare earth surface treatment

    SciTech Connect (OSTI)

    Dogan, Omer N.; Alman, David A.; Jablonski, Paul D.

    2005-02-01

    Medium Cr steels have been used in fossil fired power plants for many years because of their excellent high temperature stability and mechanical properties. The environment in a fossil fired power plant is extremely aggressive in terms of corrosion, especially oxidation. This is only accelerated as the operating temperature increases to 650C and beyond. For any new steel to be qualified for power plant use, in addition to adequate strength at the operating temperature, material wastage from all corrosion processes must be kept to a minimum acceptable level. The use of medium Cr steels provides a means to improve overall corrosion resistance. Three medium Cr are under development for use as high temperature power plant steels: 0.08C-(9-12)Cr-1.2Ni-0.7Mo-3.0Cu-3.0Co-0.5Ti. Oxidation tests were performed on the steels for times greater than 1000 hours in order to determine the oxidation kinetics and extent of material wastage. Also, rare earth oxides were incorporated into the outer surface layers of the steels to see if the oxidation resistance could be improved. These results will be compared to current power plant steels.

  8. Zinc protects human peripheral blood lymphocytes from Cr(III)(phenanthroline){sub 3}-induced apoptosis

    SciTech Connect (OSTI)

    Sankaramanivel, Sundararaj; Rajaram, Anantanarayanan; Rajaram, Rama

    2010-03-15

    We have studied the effect of Cr(III)(phen){sub 3} [(tris(1,10-phenanthroline) chromium(III) chloride)] on lymphocytes in order to find out if metallothioneins (MTs) are produced in the process. We also investigated whether zinc pretreatment is able to protect cells from apoptosis reported to occur for this compound. Our results indicate that MT synthesis is induced by Cr(III)(phen){sub 3}, and it has been identified as the MT-3 isoform through RT-PCR which has not been reported earlier. By zinc pretreatment, this apoptosis is reversed as inferred from cytotoxicity studies, Annexin-V/PI staining, ethidium bromide/acridine orange staining and DNA fragmentation pattern and ultrastructural investigations using TEM and SEM. The zinc pretreatment reduces the amount of ROS produced by Cr(III)(phen){sub 3} . The MT-1a and 1b synthesized by zinc (also evidenced through RT-PCR experiments) is possibly able to scavenge ROS which is one of the early signaling molecules that lead to apoptosis. Zinc pretreatment also reverses the changes in downstream signaling events such as mitochondrial membrane potential, ATP levels and the activation of caspase-3. This is the first report on the induction of MT-3 in lymphocytes due to a metal stress or any other stimuli. Even though MT-3 is synthesized here, apoptosis still occurs due to ROS production on Cr(III)(phen){sub 3} exposure when the cells have not been primed with zinc.

  9. Investigation on growth and laser properties of GGG:(Nd,Cr) single crystals

    SciTech Connect (OSTI)

    Zhang; Lin; Liu; Liu; Zhu

    1986-04-04

    Investigation on the growth and laser properties of gadolinium gallium garnet crystal doped with neodymium and chromium is reported. As the segregation coefficient of Nd in GGG is less than 1 and that of Cr is greater than 1, a modified Czochralski method for growth is adopted in order to keep the dopants being uniform in the grown crystal.

  10. Computational discovery of ferromagnetic semiconducting single-layer CrSnTe3

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Zhuang, Houlong L.; Xie, Yu; Kent, P. R. C.; Ganesh, P.

    2015-07-06

    Despite many single-layer materials being reported in the past decade, few of them exhibit magnetism. Here we perform first-principles calculations using accurate hybrid density functional methods (HSE06) to predict that single-layer CrSnTe3 (CST) is a ferromagnetic semiconductor, with band gaps of 0.9 and 1.2 eV for the majority and minority spin channels, respectively. We determine the Curie temperature as 170 K, significantly higher than that of single-layer CrSiTe3 (90K) and CrGeTe3 (130 K). This is due to the enhanced ionicity of the Sn-Te bond, which in turn increases the superexchange coupling between the magnetic Cr atoms. We further explore themore » mechanical and dynamical stability and strain response of this single-layer material for possible epitaxial growth. Lastly, our study provides an intuitive approach to understand and design novel single-layer magnetic semiconductors for a wide range of spintronics and energy applications.« less

  11. Microstructures and Mechanical Properties of Compositionally Complex Co-free FeNiMnCr18 FCC Solid Solution Alloy

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Wu, Zhenggang; Bei, Hongbin

    2015-01-01

    Recently,a structurally-simplebutcompositionally-complex FeNiCoMnCr highentropyalloywasfoundto haveexcellentmechanicalproperties(e.g.,highstrengthandductility).Tounderstandthepotentialof using highentropyalloysasstructuralmaterialsforadvancednuclearreactorandpowerplants,itis necessary tohaveathoroughunderstandingoftheirstructuralstabilityandmechanicalpropertiesde- gradation underneutronirradiation.ThisrequiresustodevelopasimilarmodelalloywithoutCobe- cause materialwithCowillmakepost-neutron-irradiationtestingdifficult duetotheproductionofthe 60Co radioisotope.Toachievethisgoal,aFCC-structuredsingle-phasealloywithacompositionof FeNiMnCr18 wassuccessfullydeveloped.Thisnear-equiatomicFeNiMnCr18 alloy hasgoodmalleability and itsmicrostructurecanbecontrolledbythermomechanicalprocessing.Byrollingandannealing,the as-cast elongated-grained-microstructureisreplacedbyhomogeneousequiaxedgrains.Themechanical properties (e.g.,strengthandductility)oftheFeNiMnCr18 alloy arecomparabletothoseoftheequiatomic FeNiCoMnCr highentropyalloy.Bothstrengthandductilityincreasewithdecreasingdeformation temperature,withthelargestdifferenceoccurringbetween293and77K.Extensivetwin-bandswhich are bundlesofnumerousindividualtwinsareobservedwhenitistensile-fracturedat77K.Notwin bands aredetectedbyEBSDformaterialsdeformedat293Kandhigher.Theunusualtemperature-de- pendencies ofUTSanduniformelongationcouldbecausedbythedevelopmentofthedensetwin substructure, twin-dislocationinteractionsandtheinteractionsbetweenprimaryandsecondarytwin- ning systemswhichresultinamicrostructurerefinement andhencecauseenhancedstrainhardening and postponednecking.

  12. A chopper system for shortening the duration of pulsed supersonic beams seeded with NO or Br{sub 2} down to 13 μs

    SciTech Connect (OSTI)

    Lam, Jessica; Rennick, Christopher J.; Softley, Timothy P.

    2015-05-15

    A chopper wheel construct is used to shorten the duration of a molecular beam to 13 μs. Molecular beams seeded with NO or with Br{sub 2} and an initial pulse width of ≥200 μs were passed through a spinning chopper wheel, which was driven by a brushless DC in vacuo motor at a range of speeds, from 3000 rpm to 80 000 rpm. The resulting duration of the molecular-beam pulses measured at the laser detection volume ranged from 80 μs to 13 μs and was the same for both NO and Br{sub 2}. The duration is consistent with a simple analytical model, and the minimum pulse width measured is limited by the spreading of the beam between the chopper and the detection point as a consequence of the longitudinal velocity distribution of the beam. The setup adopted here effectively eliminates buildup of background gas without the use of a differential pumping stage, and a clean narrow pulse is obtained with low rotational temperature.

  13. Design and experimental testing of the performance of an outdoor LiBr/H{sub 2}O solar thermal absorption cooling system with a cold store

    SciTech Connect (OSTI)

    Agyenim, Francis; Knight, Ian; Rhodes, Michael

    2010-05-15

    A domestic-scale prototype experimental solar cooling system has been developed based on a LiBr/H{sub 2}O absorption system and tested during the 2007 summer and autumn months in Cardiff University, UK. The system consisted of a 12 m{sup 2} vacuum tube solar collector, a 4.5 kW LiBr/H{sub 2}O absorption chiller, a 1000 l cold storage tank and a 6 kW fan coil. The system performance, as well as the performances of the individual components in the system, were evaluated based on the physical measurements of the daily solar radiation, ambient temperature, inlet and outlet fluid temperatures, mass flow rates and electrical consumption by component. The average coefficient of thermal performance (COP) of the system was 0.58, based on the thermal cooling power output per unit of available thermal solar energy from the 12 m{sup 2} Thermomax DF100 vacuum tube collector on a hot sunny day with average peak insolation of 800 W/m{sup 2} (between 11 and 13.30 h) and ambient temperature of 24 C. The system produced an electrical COP of 3.6. Experimental results prove the feasibility of the new concept of cold store at this scale, with chilled water temperatures as low as 7.4 C, demonstrating its potential use in cooling domestic scale buildings. (author)

  14. Analysis of the FeCrAl Accident Tolerant Fuel Concept Benefits during BWR Station Blackout Accidents

    SciTech Connect (OSTI)

    Robb, Kevin R

    2015-01-01

    Iron-chromium-aluminum (FeCrAl) alloys are being considered for fuel concepts with enhanced accident tolerance. FeCrAl alloys have very slow oxidation kinetics and good strength at high temperatures. FeCrAl could be used for fuel cladding in light water reactors and/or as channel box material in boiling water reactors (BWRs). To estimate the potential safety gains afforded by the FeCrAl concept, the MELCOR code was used to analyze a range of postulated station blackout severe accident scenarios in a BWR/4 reactor employing FeCrAl. The simulations utilize the most recently known thermophysical properties and oxidation kinetics for FeCrAl. Overall, when compared to the traditional Zircaloy-based cladding and channel box, the FeCrAl concept provides a few extra hours of time for operators to take mitigating actions and/or for evacuations to take place. A coolable core geometry is retained longer, enhancing the ability to stabilize an accident. Finally, due to the slower oxidation kinetics, substantially less hydrogen is generated, and the generation is delayed in time. This decreases the amount of non-condensable gases in containment and the potential for deflagrations to inhibit the accident response.

  15. Solute redistribution and phase stability at FeCr/TiO2–x interfaces under ion irradiation

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Xu, Y.; Aguiar, J. A.; Yadav, S. K.; Anderoglu, O.; Baldwin, J. K.; Wang, Y. Q.; Valdez, James A.; Misra, A.; Luo, H. M.; Uberuaga, B. P.; et al

    2015-02-26

    Cr diffusion in trilayer thin films of 100 nm Fe–18Cr/125 nm TiO2–x/100 nm Fe–18Cr deposited on MgO substrates at 500 °C was studied by either annealing at 500 °C or Ni3+ ion irradiation at 500 °C. Microchemistry and microstructure evolution at the metal/oxide interfaces were investigated using (high-resolution) transmission electron microscopy, energy-dispersive X-ray spectroscopy and electron energy loss spectroscopy. Diffusion of Cr into the O-deficient TiO2 layer, with negligible segregation to the FeCr/TiO2–x interface itself, was observed under both annealing and irradiation. Cr diffusion into TiO2–x was enhanced in ion-irradiated samples as compared to annealed. Irradiation-induced voids and amorphization ofmore » TiO2–x was also observed. The experimental results are rationalized using first-principles calculations that suggest an energetic preference for substituting Ti with Cr in sub-stoichiometric TiO2. Furthermore, the implications of these results on the irradiation stability of oxide-dispersed ferritic alloys are discussed.« less

  16. Ferromagnetic superexchange in insulating Cr2MoO6 by controlling orbital hybridization

    SciTech Connect (OSTI)

    Zhu, M.; Do, D.; Dela Cruz, Clarina R.; Dun, Zhiling; Cheng, J. -G.; Goto, H.; Uwatoko, Yoshiya; Zou, T.; Zhou, Haidon D.; Mahanti, Subhendra D.; Ke, Xianglin

    2015-09-11

    We report the magnetic and electronic structures of the newly synthesized inverse-trirutile compound Cr2MoO6. Despite the same crystal symmetry and similar bond-lengths and bond-angles to Cr2TeO6, Cr2MoO6 possesses a magnetic structure of the Cr2MoO6 type, different from that seen in Cr2TeO6. Ab-initio electronic structure calculations show that the sign and strength of the Cr-O-Cr exchange coupling is strongly influenced by the hybridization between Mo 4d and O 2p orbitals. This result further substantiates our recently proposed mechanism for tuning the exchange interaction between two magnetic atoms by modifying the electronic states of the non-magnetic atoms in the exchange path through orbital hybridization. This approach is fundamentally different from the conventional methods of controlling the exchange interaction by either carrier injection or through structural distortions.

  17. Anisotropic magnetic properties of Dy{sub 6}Cr{sub 4}Al{sub 43} single

    Office of Scientific and Technical Information (OSTI)

    crystal (Journal Article) | SciTech Connect Anisotropic magnetic properties of Dy{sub 6}Cr{sub 4}Al{sub 43} single crystal Citation Details In-Document Search Title: Anisotropic magnetic properties of Dy{sub 6}Cr{sub 4}Al{sub 43} single crystal We have studied the anisotropic magnetic behavior of the rare earth intermetallic compound Dy{sub 6}Cr{sub 4}Al{sub 43}. This compound crystallizes in the hexagonal symmetry and orders ferromagnetically at 8.3 K as confirmed by the magnetic

  18. Estimation of steady-state and transcient power distributions for the RELAP analyses of the 1963 loss-of-flow and loss-of-pressure tests at BR2.

    SciTech Connect (OSTI)

    Dionne, B.; Tzanos, C. P.

    2011-05-23

    To support the safety analyses required for the conversion of the Belgian Reactor 2 (BR2) from highly-enriched uranium (HEU) to low-enriched uranium (LEU) fuel, the simulation of a number of loss-of-flow tests, with or without loss of pressure, has been undertaken. These tests were performed at BR2 in 1963 and used instrumented fuel assemblies (FAs) with thermocouples (TC) imbedded in the cladding as well as probes to measure the FAs power on the basis of their coolant temperature rise. The availability of experimental data for these tests offers an opportunity to better establish the credibility of the RELAP5-3D model and methodology used in the conversion analysis. In order to support the HEU to LEU conversion safety analyses of the BR2 reactor, RELAP simulations of a number of loss-of-flow/loss-of-pressure tests have been undertaken. Preliminary analyses showed that the conservative power distributions used historically in the BR2 RELAP model resulted in a significant overestimation of the peak cladding temperature during the transient. Therefore, it was concluded that better estimates of the steady-state and decay power distributions were needed to accurately predict the cladding temperatures measured during the tests and establish the credibility of the RELAP model and methodology. The new approach ('best estimate' methodology) uses the MCNP5, ORIGEN-2 and BERYL codes to obtain steady-state and decay power distributions for the BR2 core during the tests A/400/1, C/600/3 and F/400/1. This methodology can be easily extended to simulate any BR2 core configuration. Comparisons with measured peak cladding temperatures showed a much better agreement when power distributions obtained with the new methodology are used.

  19. Feasibility of a super high-energy-density battery of the Li/Br/F sub 3 electrochemical system. Final report, 15 August 1989-14 May 1990

    SciTech Connect (OSTI)

    Frysz, C.A.; Pyszczek, M.F.; Ebel, S.J.

    1990-08-16

    Feasibility studies on the practical aspects of developing a lithium/bromine trifluoride battery have been studied. Efforts directed toward identifying materials for porous electrode separators, glasses for insulated electrical feed-throughs, and metals for lid, case and current collector fabrication via electrochemical testing techniques have resulted in a list of materials suitable for these applications. Prototype cells utilizing a spirally wound electrode configuration have been constructed and discharged. The use of lithium salts as an electrolyte additive has been explored, and has shown a positive effect on discharge performance. Through the use of currently available technology, however, the lithium/bromine trifluoride couple has not delivered energy density comparable to other high energy density lithium systems. This investigation has revealed that practical Li/BrF3 cell development will require further extensive fundamental electrochemical research.

  20. Néel temperature of Cr{sub 2}O{sub 3} in Cr{sub 2}O{sub 3}/Co exchange-coupled system: Effect of buffer layer

    SciTech Connect (OSTI)

    Pati, Satya Prakash E-mail: phy-satya@yahoo.co.in; Shimomura, Naoki; Nozaki, Tomohiro; Sahashi, Masashi; Shibata, Tatsuo

    2015-05-07

    The lattice parameter dependence of the Néel temperature T{sub N} of thin Cr{sub 2}O{sub 3} in a Cr{sub 2}O{sub 3}/Co exchange-coupled system is investigated. Lattice-mismatch-induced strain is generated in Cr{sub 2}O{sub 3} by using different buffer layers. The lattice parameters are determined from out-of-plane and in-plane X-ray diffraction measurements. The Néel temperature is detected by direct temperature-dependent magnetization measurement as well as the temperature-dependent interface exchange coupling energy. It is observed that in-plane lattice contraction can enhance T{sub N} in Cr{sub 2}O{sub 3}, which is consistent with theoretical calculations.

  1. The MSFR as a flexible CR reactor: the viewpoint of safety

    SciTech Connect (OSTI)

    Fiorina, C.; Cammi, A.; Franceschini, F.; Krepel, J.

    2013-07-01

    In this paper, the possibility has first been discussed of using the liquid-fuelled Molten Salt Fast Reactor (MSFR) as a flexible conversion ratio (CR) reactor without design modification. By tuning the reprocessing rate it is possible to determine the content of fission products in the core, which in turn can significantly affect the neutron economy without incurring in solubility problems. The MSFR can thus be operated as U-233 breeder (CR>1), iso-breeder (CR=1) and burner reactor (CR<1). In particular a 40 year doubling time can be achieved, as well as a considerable Transuranics and MA (minor actinide) burning rate equal to about 150 kg{sub HN}/GWE-yr. The safety parameters of the MSFR have then been evaluated for different fuel cycle strategies. Th use and a softer spectrum combine to give a strong Doppler coefficient, one order of magnitude higher compared to traditional fast reactors (FRs). The fuel expansion coefficient is comparable to the Doppler coefficient and is only mildly affected by core compositions, thus assisting the fuel cycle flexibility of the MSFR. ?eff and generation time are comparable to the case of traditional FRs, if a static fuel is assumed. A notable reduction of ?eff is caused by salt circulation, but a low value of this parameter is a limited concern in the MSFR thanks to the lack of a burnup reactivity swing and of positive feedbacks. A simple approach has also been developed to evaluate the MSFR capabilities to withstand all typical double-fault accidents, for different fuel cycle options.

  2. Scaling Effects of Cr(VI) Reduction Kinetics. The Role of Geochemical Heterogeneity

    SciTech Connect (OSTI)

    Wang, Li; Li, Li

    2015-10-22

    The natural subsurface is highly heterogeneous with minerals distributed in different spatial patterns. Fundamental understanding of how mineral spatial distribution patterns regulate sorption process is important for predicting the transport and fate of chemicals. Existing studies about the sorption was carried out in well-mixed batch reactors or uniformly packed columns, with few data available on the effects of spatial heterogeneities. As a result, there is a lack of data and understanding on how spatial heterogeneities control sorption processes. In this project, we aim to understand and develop modeling capabilities to predict the sorption of Cr(VI), an omnipresent contaminant in natural systems due to its natural occurrence and industrial utilization. We systematically examine the role of spatial patterns of illite, a common clay, in determining the extent of transport limitation and scaling effects associated with Cr(VI) sorption capacity and kinetics using column experiments and reactive transport modeling. Our results showed that the sorbed mass and rates can differ by an order of magnitude due to of the illite spatial heterogeneities and transport limitation. With constraints from data, we also developed the capabilities of modeling Cr(VI) in heterogeneous media. The developed model is then utilized to understand the general principles that govern the relationship between sorption and connectivity, a key measure of the spatial pattern characteristics. This correlation can be used to estimate Cr(VI) sorption characteristics in heterogeneous porous media. Insights gained here bridge gaps between laboratory and field application in hydrogeology and geochemical field, and advance predictive understanding of reactive transport processes in the natural heterogeneous subsurface. We believe that these findings will be of interest to a large number of environmental geochemists and engineers, hydrogeologists, and those interested in contaminant fate and transport, water quality and water composition, and natural attenuation processes in natural systems.

  3. Audit Report: CR-B-97-04 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    5, 1997 Audit OF Controls Over The ADP Support Services Contract The Federal Acquisition Regulation requires the Department of Energy (Department) to ensure that efficient methods and effective cost controls are used over its cost-reimbursement contracts. Our objective was to determine whether the program offices at the Department's Headquarters were managing their Automated Data Processing (ADP) support services contract costs. PDF icon Audit Report: CR-B-97-04 More Documents & Publications

  4. Audit Report: CR-B-98-02 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    2 Audit Report: CR-B-98-02 November 14, 1997 Audit of Management of the Laboratory Directed Research and Development Program at the Lawrence Livermore National Laboratory The Department's national laboratories, since their establishment, have been permitted to conduct a limited amount of discretionary research activities. The Department's Defense Program laboratories, such as the Lawrence Livermore National Laboratory, generate funding for Laboratory Directed Research and Development (LDRD)

  5. Audit Report: CR-B-99-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    1 Audit Report: CR-B-99-01 October 1, 1998 Department's Working Capital Fund The Department established the Working Capital Fund (Fund) in January 1996 as a financial management tool for charging the costs of common services provided at Headquarters to Departmental program offices. The objectives in establishing the Fund were to increase efficiency of the Department's operations, improve management of administrative services through the use of flexible and business-like finance methods, and

  6. Audit Report: CR-FS-99-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    9-01 Audit Report: CR-FS-99-01 June 15, 1999 Management Report Audit of the Department of Energy's Consolidated Financial Statements for Fiscal Year 1998 As required by the Government Management Reform Act of 1994, we audited the U.S. Department of Energy's (Department) consolidated financial statements as of and for the years ended September 30, 1998 and 1997 to determine whether they presented fairly, in all material respects, the Department's financial position, net cost, changes in net

  7. Audit Report: CR-L-01-06 | Department of Energy

    Energy Savers [EERE]

    L-01-06 Audit Report: CR-L-01-06 February 8, 2001 Federal Managers' Financial Integrity Act Audit Report We reviewed the Department of Energy's (Department) progress in implementing the Federal Managers' Financial Integrity Act (FMFIA) of 1982. The review was made to assist you in determining whether the evaluations of the systems of management, accounting, and administrative controls were carried out in a reasonable and prudent manner by the Department for Fiscal Year 2000. PDF icon Audit

  8. First-principles study of the structural and elastic properties of Cr{sub 2}AlX (X=N, C) compounds

    SciTech Connect (OSTI)

    Cui Shouxin; Wei Dongqing; Hu Haiquan; Feng Wenxia; Gong Zizheng

    2012-07-15

    The structural, electronic and elastic properties of Cr{sub 2}AlX, with X=N, C, have been investigated at the density functional theory level by applying a plane-wave pseudopotential approach. The band structure and density of states reveal the metallic features of Cr{sub 2}AlX. The total and projected density of states indicate that the bonding is achieved through a hybridization of Cr 3d states with Al and X-atom p states. The Cr 3d-X2p bonds are lower in energy and are stiffer than Cr 3d-Al 3p bonds. The charge density distributions indicate that there exist soft Cr-Al and relatively strong Cr-X covalent bonds, which might be responsible for their hardness. The elastic constants were obtained in the pressure range 0-100 GPa, and satisfy the stability conditions for hexagonal crystal, which indicates that these two compounds are stable in the pressure regime studied. By analyzing bulk modulus to shear modulus ratio and Cauchy pressure, Cr{sub 2}AlC is predicted to be brittleness and Cr{sub 2}AlN is ductile. The Debye temperature was obtained from the average sound velocity. - Graphical abstract: The heterogeneity of chemical bonds in Cr{sub 2}AlX (X=N, C) is observed: soft Cr-Al and relatively strong Cr-X covalent bonds might be contributed to their hardness. Highlights: Black-Right-Pointing-Pointer Cr 3d-X2p (X=N, C) bonds are lower in energy and stiffer than Cr 3d-Al 3p bonds for Cr{sub 2}AlX. Black-Right-Pointing-Pointer The hardness of Cr{sub 2}AlX might be ascribed to soft Cr-Al and relatively strong Cr-X covalent bonds. Black-Right-Pointing-Pointer The predicted brittleness of Cr{sub 2}AlC and ductility of Cr{sub 2}AlN originated from their novel structure.

  9. Thermal stability of intermetallic phases in Fe-rich Fe-Cr-Ni-Mo alloys

    SciTech Connect (OSTI)

    Yang, Ying; Tan, Lizhen; Busby, Jeremy T.

    2015-06-12

    Understanding the stability of precipitate phases in the Fe-rich Fe-Cr-Ni-Mo alloys is critical to the alloy design and application of Mo-containing Austenitic steels. Coupled with thermodynamic modeling, stability of the chi and Laves phases in two Fe-Cr-Ni-Mo alloys were investigated at 1000, 850 and 700 °C for different annealing time. The morphologies, compositions and crystal structures of the matrix and precipitate phases were carefully examined by Scanning Electron Microscopy, Electron Probe Microanalysis, X-ray diffraction and Transmission Electron Microscopy. The two key findings resulted from this work. One is that the chi phase is stable at high temperature and transformed into the Laves phase at low temperature. The other is that both the chi and Laves phases have large solubilites of Cr, Mo and Ni, among which the Mo solubility has a major role on the relative stability of the precipitate phases. The developed thermodynamic models were then applied to evaluating the Mo effect on the stability of precipitate phases in AISI 316 and NF709 alloys.

  10. Blending Cr2O3 into a NiO-Ni electrocatalyst for sustained water splitting

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Gong, Ming; Zhou, Wu; Kenney, Michael James; Kapusta, Rich; Cowley, Sam; Wu, Yingpeng; Lu, Bingan; Lin, Meng -Chang; Wang, Di -Yan; Yang, Jiang; et al

    2015-08-24

    The rising H2 economy demands active and durable electrocatalysts based on low-cost, earth-abundant materials for water electrolysis/photolysis. Here we report nanoscale Ni metal cores over-coated by a Cr2O3-blended NiO layer synthesized on metallic foam substrates. The Ni@NiO/Cr2O3 triphase material exhibits superior activity and stability similar to Pt for the hydrogen-evolution reaction in basic solutions. The chemically stable Cr2O3 is crucial for preventing oxidation of the Ni core, maintaining abundant NiO/Ni interfaces as catalytically active sites in the heterostructure and thus imparting high stability to the hydrogen-evolution catalyst. The highly active and stable electrocatalyst enables an alkaline electrolyzer operating at 20more » mA cm–2 at a voltage lower than 1.5 V, lasting longer than 3 weeks without decay. Thus, the non-precious metal catalysts afford a high efficiency of about 15 % for light-driven water splitting using GaAs solar cells.« less

  11. Rapid preparation and magnetodielectric properties of trirutile Cr{sub 2}WO{sub 6}

    SciTech Connect (OSTI)

    Gaultois, Michael W.; Kemei, Moureen C.; Harada, Jaye K.; Seshadri, Ram

    2015-01-07

    Dense pellets of > 99% purity trirutile Cr{sub 2}WO{sub 6} were prepared in one step from starting oxides using spark plasma sintering, leading to simultaneous reaction and consolidation in 3 min at 1473 K. The reducing environment during processing may be partly responsible for the rapid reaction time in these oxides, with partial reduction of Cr{sup 3+} and the associated oxygen vacancies allowing rapid diffusion of cations. The low-temperature physical properties of Cr{sub 2}WO{sub 6} were examined, and a new transition at T = 5.9 K was observed as an anomaly in the temperature-dependent dielectric permittivity and a corresponding anomaly in the specific heat. A strong enhancement of the magnetocapacitance is observed below this transition temperature at T = 5.9 K and may be associated with a change from collinear spin order to more complex spin order.

  12. Redox Dynamics of Mixed Metal (Mn, Cr, and Fe) Ultrafine Particles

    SciTech Connect (OSTI)

    Nico, Peter S.; Kumfer, Benjamin M.; Kennedy, Ian M.; Anastasio, Cort

    2008-08-01

    The impact of particle composition on metal oxidation state, and on changes in oxidation state with simulated atmospheric aging, are investigated experimentally in flame-generated nanoparticles containing Mn, Cr, and Fe. The results demonstrate that the initial fraction of Cr(VI) within the particles decreases with increasing total metal concentration in the flame. In contrast, the initial Mn oxidation state was only partly controlled by metal loading, suggesting the importance of other factors. Two reaction pathways, one reductive and one oxidative, were found to be operating simultaneously during simulated atmospheric aging. The oxidative pathway depended upon the presence of simulated sunlight and O{sub 3}, whereas the reductive pathway occurred in the presence of simulated sunlight alone. The reductive pathway appears to be rapid but transient, allowing the oxidative pathway to dominate with longer aging times, i.e. greater than {approx}8 hours. The presence of Mn within the particles enhanced the importance of the oxidative pathway, leading to more net Cr oxidation during aging implying that Mn can mediate oxidation by removal of electrons from other particulate metals.

  13. Stability of precipitate phases in Fe-rich Fe-Cr-Ni-Mo alloys

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Yang, Ying; Tan, Lizhen; Busby, Jeremy T

    2015-01-01

    Understanding the stability of precipitate phases in the Fe-rich Fe-Cr-Ni-Mo alloys is critical to the alloy design and application of Mo-containing Austenitic steels. Coupled with thermodynamic modeling, stability of the and phases in two Fe-Cr-Ni-Mo alloys were investigated at 1000, 850 and 700 C for different annealing time. The morphologies, compositions and crystal structures of the matrix and precipitate phases were carefully examined by Scanning Electron Microscopy, Electron Probe Microanalysis, X-ray diffraction and Transmission Electron Microscopy. Two key findings resulted from this work. One is that the phase is stable at high temperature and transformed into the phase at lowmoretemperature. The other is that both the and phases have large solubilites of Cr, Mo and Ni, among which the Mo solubility has a major role on the relative stability of the precipitate phases. The developed thermodynamic models were then applied to evaluating the Mo effect on the stability of precipitate phases in AISI 316 and NF709 alloys.less

  14. Thermal stability of intermetallic phases in Fe-rich Fe-Cr-Ni-Mo alloys

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Yang, Ying; Tan, Lizhen; Busby, Jeremy T.

    2015-06-12

    Understanding the stability of precipitate phases in the Fe-rich Fe-Cr-Ni-Mo alloys is critical to the alloy design and application of Mo-containing Austenitic steels. Coupled with thermodynamic modeling, stability of the chi and Laves phases in two Fe-Cr-Ni-Mo alloys were investigated at 1000, 850 and 700 °C for different annealing time. The morphologies, compositions and crystal structures of the matrix and precipitate phases were carefully examined by Scanning Electron Microscopy, Electron Probe Microanalysis, X-ray diffraction and Transmission Electron Microscopy. The two key findings resulted from this work. One is that the chi phase is stable at high temperature and transformed intomore » the Laves phase at low temperature. The other is that both the chi and Laves phases have large solubilites of Cr, Mo and Ni, among which the Mo solubility has a major role on the relative stability of the precipitate phases. The developed thermodynamic models were then applied to evaluating the Mo effect on the stability of precipitate phases in AISI 316 and NF709 alloys.« less

  15. Ferromagnetic ordering of Cr and Fe doped p-type diamond: An ab initio study

    SciTech Connect (OSTI)

    Benecha, E. M.; Lombardi, E. B.

    2014-02-21

    Ferromagnetic ordering of transition metal dopants in semiconductors holds the prospect of combining the capabilities of semiconductors and magnetic systems in single hybrid devices for spintronic applications. Various semiconductors have so far been considered for spintronic applications, but low Curie temperatures have hindered room temperature applications. We report ab initio DFT calculations on the stability and magnetic properties of Fe and Cr impurities in diamond, and show that their ground state magnetic ordering and stabilization energies depend strongly on the charge state and type of co-doping. We predict that divacancy Cr{sup +2} and substitutional Fe{sup +1} order ferromagnetically in p-type diamond, with magnetic stabilization energies (and magnetic moment per impurity ion) of 16.9 meV (2.5 μ{sub B}) and 33.3 meV (1.0 μ{sub B}), respectively. These magnetic stabilization energies are much larger than what has been achieved in other semiconductors at comparable impurity concentrations, including the archetypal dilute magnetic semiconductor GaAs:Mn. In addition, substitutional Fe{sup +1} exhibits a strong half-metallic character, with the Fermi level crossing bands in only the spin down channel. These results, combined with diamond’s extreme properties, demonstrate that Cr or Fe dopedp-type diamond may successfully be considered in the search for room temperature spintronic materials.

  16. Cr-doped TiSe2 - A layered dichalcogenide spin glass

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Luo, Huixia; Tao, Jing; Krizan, Jason W.; Seibel, Elizabeth M.; Xie, Weiwei; Sahasrabudhe, Girija S.; Bergman, Susanna L.; Phelan, Brendan F.; Wang, Zhen; Zhang, Jiandi; et al

    2015-09-17

    We report the magnetic characterization of the Cr-doped layered dichalcogenide TiSe2. The temperature dependent magnetic susceptibilities are typical of those seen in geometrically frustrated insulating antiferromagnets. The Cr moment is close to the spin-only value, and the Curie–Weiss temperatures (θcw) are between –90 and –230 K. Freezing of the spin system, which is glassy, characterized by peaks in the ac and dc susceptibility and specific heat, does not occur until below T/θcw = 0.05. The CDW transition seen in the resistivity for pure TiSe2 is still present for 3% Cr substitution but is absent by 10% substitution, above which themore » materials are metallic and p-type. Structural refinements, magnetic characterization, and chemical considerations indicate that the materials are of the type Ti1–xCrxSe2-x/2 for 0 ≤ x ≤ 0.6.« less

  17. Sintered Cr/Pt and Ni/Au ohmic contacts to B12P2

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Frye, Clint D.; Kucheyev, Sergei O.; Edgar, James H.; Voss, Lars F.; Conway, Adam M.; Shao, Qinghui; Nikolic, Rebecca J.

    2015-04-09

    With this study, icosahedral boron phosphide (B12P2) is a wide-bandgap semiconductor possessing interesting properties such as high hardness, chemical inertness, and the reported ability to self-heal from irradiation by high energy electrons. Here, the authors developed Cr/Pt and Ni/Au ohmic contacts to epitaxially grown B12P2 for materials characterization and electronic device development. Cr/Pt contacts became ohmic after annealing at 700 °C for 30 s with a specific contact resistance of 2×10–4 Ω cm2, as measured by the linear transfer length method. Ni/Au contacts were ohmic prior to any annealing, and their minimum specific contact resistance was ~l–4 × 10–4 Ωmore » cm2 after annealing over the temperature range of 500–800 °C. Rutherford backscattering spectrometry revealed a strong reaction and intermixing between Cr/Pt and B12P2 at 700 °C and a reaction layer between Ni and B12P2 thinner than ~25 nm at 500 °C.« less

  18. Effect of lattice deformation on exchange coupling constants in Cr{sub 2}O{sub 3}

    SciTech Connect (OSTI)

    Kota, Yohei; Imamura, Hiroshi; Sasaki, Munetaka

    2014-05-07

    We studied lattice deformation effect on exchange interaction in the corundum-type Cr{sub 2}O{sub 3} theoretically. First-principles electronic structure calculations were performed to evaluate the total energy and exchange coupling constants of Cr{sub 2}O{sub 3} under lattice deformation. We found that a few percent elastic deformation is expected via misfit strain and that the first- and second-nearest neighbor exchange coupling constants of Cr{sub 2}O{sub 3} strongly depend on the lattice deformation. These results imply a possibility for improving the thermal stability of Cr{sub 2}O{sub 3} based magnetoelectric devices by lattice deformation.

  19. LaCrO{sub 3} heteroepitaxy on SrTiO{sub 3}(001) by molecular beam epitaxy

    SciTech Connect (OSTI)

    Qiao, L.; Droubay, T. C.; Bowden, M. E.; Shutthanandan, V.; Kaspar, T. C.; Chambers, S. A.

    2011-08-08

    Stoichiometric, epitaxial LaCrO{sub 3} films have been grown on SrTiO{sub 3}(001) by molecular beam epitaxy using O{sub 2} as the oxidant. Films grew in a layer-by-layer fashion, giving rise to coherently strained, structurally excellent films and surfaces which preserve the step-terrace structure of the substrate. The critical thickness is in excess of 500 A. Cr(III) near the surface is easily oxidized to Cr(V) upon exposure to atomic oxygen and reduction back to Cr(III) is readily achieved by vacuum annealing, resulting in tunability of the charge state at the B-site cation.

  20. LaCrO3 heteroepitaxy on SrTiO3(001) by molecular beam epitaxy

    SciTech Connect (OSTI)

    Qiao, Liang; Droubay, Timothy C.; Bowden, Mark E.; Shutthanandan, V.; Kaspar, Tiffany C.; Chambers, Scott A.

    2011-08-09

    Stoichiometric, epitaxial LaCrO3 films have been grown on TiO2-terminated SrTiO3(001) substrates by molecular beam epitaxy using O2 as the oxidant. Film growth occurred in a layer-by-layer fashion, giving rise to structurally excellent films and surfaces which preserve the step-terrace structure of the substrate. The critical thickness is in excess of 500 . Near-surface Cr(III) is highly susceptible to further oxidation to Cr(V), leading to the formation of a disordered phase upon exposure to atomic oxygen. Recovery of the original epitaxial LaCrO3 phase is readily achieved by vacuum annealing.

  1. Cr-W-V bainitic/ferritic steel with improved strength and toughness and method of making

    DOE Patents [OSTI]

    Klueh, Ronald L.; Maziasz, Philip J.

    1994-01-01

    A high strength, high toughness Cr-W-V ferritic steel composition suitable for fast induced-radioactivity (FIRD) decay after irradiation in a fusion reactor comprises 2.5-3.5 wt % Cr, 2. This invention was made with Government support under contract DE-AC05-840R21400 awarded by the U.S. Department of Energy to Martin Marietta Energy Systems, Inc. and the Government has certain rights in this invention.

  2. Strain induced ferromagnetism in epitaxial Cr{sub 2}O{sub 3} thin films integrated on Si(001)

    SciTech Connect (OSTI)

    Punugupati, Sandhyarani Narayan, Jagdish; Hunte, Frank

    2014-09-29

    We report on the epitaxial growth and magnetic properties of antiferromagnetic and magnetoelectric (ME) Cr{sub 2}O{sub 3} thin films deposited on cubic yttria stabilized zirconia (c-YSZ)/Si(001) using pulsed laser deposition. The X-ray diffraction (2ϴ and Φ) and TEM characterizations confirm that the films were grown epitaxially. The Cr{sub 2}O{sub 3}(0001) growth on YSZ(001) occurs with twin domains. There are four domains of Cr{sub 2}O{sub 3} with in-plane rotation of 30° or 150° from each other about the [0001] growth direction. The epitaxial relation between the layers is given as [001]Si ‖ [001]YSZ ‖ [0001]Cr{sub 2}O{sub 3} and [100]Si ǁ [100]YSZ ǁ [101{sup ¯}0] Cr{sub 2}O{sub 3} or [112{sup ¯}0] Cr{sub 2}O{sub 3}. Though the bulk Cr{sub 2}O{sub 3} is an antiferromagnetic with T{sub N} = 307 K, we found that the films exhibit ferromagnetic like hysteresis loops with high saturation and finite coercive field up to 400 K. The thickness dependent magnetizations together with oxygen annealing results suggest that the ferromagnetism (FM) is due to oxygen related defects whose concentration is controlled by strain present in the films. This FM, in addition to the intrinsic magneto-electric properties of Cr{sub 2}O{sub 3}, opens the door to relevant spintronics applications.

  3. CR108, a novel vitamin K3 derivative induces apoptosis and breast tumor inhibition by reactive oxygen species and mitochondrial dysfunction

    SciTech Connect (OSTI)

    Yang, Chun-Ru; Liao, Wei-Siang; Wu, Ya-Hui; Murugan, Kaliyappan; Chen, Chinpiao; Chao, Jui-I

    2013-12-15

    Vitamin K3 derivatives have been shown to exert anticancer activities. Here we show a novel vitamin K3 derivative (S)-2-(2-hydroxy-3-methylbutylthio)naphthalene-1,4-dione, which is named as CR108 that induces apoptosis and tumor inhibition through reactive oxygen species (ROS) and mitochondrial dysfunction in human breast cancer. CR108 is more effective on the breast cancer cell death than other vitamin K3 derivatives. Moreover, CR108 induced apoptosis in both the non-HER-2-overexpressed MCF-7 and HER-2-overexpressed BT-474 breast cancer cells. CR108 caused the loss of mitochondrial membrane potential, cytochrome c released from mitochondria to cytosol, and cleaved PARP proteins for apoptosis induction. CR108 markedly increased ROS levels in breast cancer cells. N-acetylcysteine (NAC), a general ROS scavenger, completely blocked the CR108-induced ROS levels, mitochondrial dysfunction and apoptosis. Interestingly, CR108 increased the phosphorylation of p38 MAP kinase but conversely inhibited the survivin protein expression. NAC treatment prevented the activation of p38 MAP kinase and rescued the survivin protein levels. SB202190, a specific p38 MAP kinase inhibitor, recovered the survivin protein levels and attenuated the cytotoxicity of CR108-treated cells. Furthermore, CR108 inhibited the xenografted human breast tumor growth in nude mice. Together, we demonstrate that CR108 is a novel vitamin K3 derivative that induces apoptosis and tumor inhibition by ROS production and mitochondrial dysfunction and associates with the phosphorylation of p38 MAP kinase and the inhibition of survivin in the human breast cancer. - Highlights: CR108 is more effective on the cell death than other vitamin K3 derivatives. CR108 induces apoptosis and tumor inhibition by ROS and mitochondrial dysfunction. CR108 induces apoptosis by p38 kinase activation and survivin inhibition. CR108 is a potent vitamin K3 analog that can develop for breast cancer therapy.

  4. Ultrathin nanosheets of CrSiTe3. A semiconducting two-dimensional ferromagnetic material

    SciTech Connect (OSTI)

    Lin, Ming -Wei; Zhung, Houlong L.; Yan, Jiaqiang; Ward, Thomas Zac; Puretzky, Alexander A.; Rouleau, Christopher M.; Gai, Zheng; Liang, Liangbo; Meunier, Vincent; Ganesh, Panchapakesan; Kent, Paul R. C.; Sumpter, Bobby G.; Mandrus, David G.; Geohegan, David B.; Xiao, Kai

    2015-11-27

    Finite range ferromagnetism and antiferromagnetism in two-dimensional (2D) systems within an isotropic Heisenberg model at non-zero temperature were originally proposed to be impossible. However, recent theoretical studies using an Ising model have recently shown that 2D magnetic crystals can exhibit magnetism. Experimental verification of existing 2D magnetic crystals in this system has remained elusive. In this work we for the first time exfoliate the CrSiTe3, a bulk ferromagnetic semiconductor, to mono- and few-layer 2D crystals onto a Si/SiO2 substrate. The Raman spectra show the good stability and high quality of the exfoliated flakes, consistent with the computed phonon spectra of 2D CrSiTe3, giving a strong evidence for the existence of 2D CrSiTe3 crystals. When the thickness of the CrSiTe3 crystals is reduced to few-layers, we observed a clear change in resistivity at 80~120 K, consistent with the theoretical calculations on the Curie temperature (Tc) of ~80 K for the magnetic ordering of 2D CrSiTe3 crystals. As a result, the ferromagnetic mono- and few-layer 2D CrSiTe3 indicated here should enable numerous applications in nano-spintronics.

  5. Hole-induced insulator-to-metal transition in La1-xSrxCrO3 epitaxial films

    SciTech Connect (OSTI)

    Zhang, Hongliang; Du, Yingge; Sushko, Petr; Bowden, Mark E.; Shutthanandan, V.; Sallis, Shawn; Piper, Louis F. J.; Chambers, Scott A.

    2015-04-01

    We have investigated the evolution of the structural and electronic properties of La1-xSrxCrO3 (0 ? x ? 1) epitaxial films deposited by molecular beam epitaxy (MBE) using x-ray diffraction, x-ray photoemission spectroscopy, x-ray absorption spectroscopy, electrical transport, and ab initio modeling. LaCrO3 is an antiferromagnetic Mott insulator whereas stoichiometric SrCrO3 is a metal. Substituting Sr2+ for La3+ in LaCrO3 effectively dopes holes into the top of valence band, leading to Cr4+ (3d2) local electron configurations. Core-level and valence-band features monotonically shift to lower binding energy with increasing x, indicating downward movement of the Fermi level toward the valence band maximum. An insulator-to-metal like transition is observed at x ? 0. 65 even as the material becomes a p-type semiconductor at lower doping level and eventually becomes degenerately doped. Valence band x-ray photoemission spectroscopy reveals diminution of electronic state density at the top of the valence band while O K-edge x-ray absorption spectroscopy shows the development of a new unoccupied state above the Fermi level as holes are doped into LaCrO3. These results indicate a pronounced redistribution of electronic state density of states upon hole doping, a result that is also obtained by density functional theory with a Hubbard U correction.

  6. Synthesis and characterization of Cr-doped ZnO nanorod-array photocatalysts with improved activity

    SciTech Connect (OSTI)

    Chang, Chi-Jung Yang, Tsung-Lin; Weng, Yu-Ching

    2014-06-01

    Immobilized photocatalysts with high catalytic activity under UV light were prepared by growing Cr-doped ZnO nanorods on glass substrates by a hydrothermal method. The effects of Cr dopant on the surface texture, crystallinity, surface chemistry, and photoinduced charge separation and their relation with the photocatalytic degradation of Cr-doped ZnO were investigated by scanning electron microscopy, diffuse reflectance spectra, photoelectrochemical scanning electrochemical microscopy, and X-ray photoemission spectroscopy. Adding the appropriate amount of Cr dopant is a powerful way to enhance the separation of charge carriers in ZnO photocatalyst. The photocatalytic activity was improved due to the increase in surface oxygen vacancies, the separation of charge carriers, modification of the band gap, and the large surface area of the doped ZnO nanorod photocatalyst. - Graphical abstract: Photoinduced charge separation and its relation with the photocatalytic degradation activity of Cr-doped ZnO were investigated by photoelectrochemical scanning electrochemical microscopy. - Highlights: Cr dopant enhances separation of charge carries in ZnO nanorod photocatalyst. Photoinduced charge carries separation monitored by PEC-SECM. The higher the photocurrent is, the higher the photocatalytic activity is. Degradation of DB86 dye solutions under visible light finished within 50 min. Higher activity due to more oxygen vacancy, tuned band gap and more surface area.

  7. Characterization of Cr poisoning in a solid oxide fuel cell cathode using a high-energy x-ray microbeam.

    SciTech Connect (OSTI)

    Liu, D. J.; Almer, J.; Cruse, T.

    2010-01-01

    A key feature of planar solid oxide fuel cells (SOFCs) is the feasibility of using metallic interconnects made of high temperature ferritic stainless steels, which reduce system cost while providing excellent electric conductivity. Such interconnects, however, contain high levels of chromium, which has been found to be associated with SOFC cathode performance degradation at SOFC operating temperatures; a phenomenon known as Cr poisoning. Here, we demonstrate an accurate measurement of the phase and concentration distributions of Cr species in a degraded SOFC, as well as related properties including deviatoric strain, integrated porosity, and lattice parameter variation, using high energy microbeam X-ray diffraction and radiography. We unambiguously identify (MnCr){sub 3}O{sub 4} and Cr{sub 2}O{sub 3} as the two main contaminant phases and find that their concentrations correlate strongly with the cathode layer composition. Cr{sub 2}O{sub 3} deposition within the active cathode region reduces porosity and produces compressive residual strains, which hinders the reactant gas percolation and can cause structural breakdown of the SOFC cathode. The information obtained through this study can be used to better understand the Cr-poisoning mechanism and improve SOFC design.

  8. Incommensurate magnetic ordering in Cu{sub 2}Te{sub 2}O{sub 5}X{sub 2} (X=Cl,Br) studied by single crystal neutron diffraction

    SciTech Connect (OSTI)

    Zaharko, O.; Roennow, H.; Mesot, J.; Crowe, S. J.; Paul, D. McK.; Brown, P. J.; Daoud-Aladine, A.; Meents, A.; Wagner, A.; Prester, M.; Berger, H.

    2006-02-01

    Polarized and unpolarized neutron-diffraction studies have been carried out on single crystals of the coupled spin tetrahedra systems Cu{sub 2}Te{sub 2}O{sub 5}X{sub 2} (X=Cl,Br). A model of the magnetic structure associated with the propagation vectors k{sup '}{sub Cl}{approx_equal}(-0.150,0.422,(1/2)) and k{sup '}{sub Br}{approx_equal}(-0.172,0.356,(1/2)) and stable below T{sub N}=18 K for X=Cl and T{sub N}=11 K for X=Br is proposed. A feature of the model, common to both the bromide and chloride, is a canted coplanar motif for the four Cu{sup 2+} spins on each tetrahedron which rotates on a helix from cell to cell following the propagation vector. The Cu{sup 2+} magnetic moment determined for X=Br,0.395(5){mu}{sub B}, is significantly less than for X=Cl,0.88(1){mu}{sub B} at 2 K. The magnetic structure of the chloride associated with the wave vector k{sup '} differs from that determined previously for the wave vector k{approx_equal}(0.150,0.422,(1/2)) [O. Zaharko et al., Phys. Rev. Lett. 93, 217206(E) (2004)].

  9. Laser Raman spectroscopy study of the zinc and bromide ion complex equilibrium in zinc/bromine battery electrolytes. [2M ZnBr/sub 2/ and 1M KBr solution

    SciTech Connect (OSTI)

    Grimes, P.G.; Larrabee, J.A.

    1985-01-01

    Laser Raman spectroscopy was used to study the zinc and bromide ion complex equilibrium in zinc bromine battery model electrolytes. Solutions of zinc bromide with added KBr, HBr and N-methyl, N-ethyl morpholinium (MEM) bromide were examined and compared. Solutions studied ranged from 1 to 3 molar in zinc and from 2.5 to 8 molar in bromide. A typical Raman spectrum of a zinc bromide solution is shown in Figure 1. Each of the zinc species is identified, Zn/sup + +/ (aq), ZnBr/sup +/, ZnBr/sub 2/ (aq), ZnBr/sub 3//sup -/ and ZnBr/sub 4//sup 2 -/. By the use of peak heights or deconvolution/integration along with published Raman cross sections, the amount of each zinc species could be quantitatively determined. The addition of bromide ions to the zinc bromide solutions will shift the equilibrium toward higher bromide complexes. The added cations will influence the shifts. It has been noted that the conductivity of the electrolyte decreases when the quaternary ammonium ions are present compared to cations such as potassium or hydrogen. Significantly more free zinc is present in zinc bromide solutions with added KBr than with either MEMBr or HBr. Shifts are also noted with the other zinc ion containing species. It appears that the quaternary ammonium ions and possibly the pH could have a stabilizing effect on zinc bromide complex ion formation. 2 figs.

  10. Correlation between morphology, chemical environment, and ferromagnetism in the intrinsic-vacancy dilute magnetic semiconductor Cr-doped Ga2Se3/Si(001)

    SciTech Connect (OSTI)

    Yitamben, E.N.; Arena, D.; Lovejoy, T.C.; Pakhomov, A.B.; Heald, S.M.; Negusse, E.; Ohuchi, F.S.; Olmstead, M.A.

    2011-01-28

    Chromium-doped gallium sesquiselenide, Cr:Ga{sub 2}Se{sub 3}, is a member of a new class of dilute magnetic semiconductors exploiting intrinsic vacancies in the host material. The correlation among room-temperature ferromagnetism, surface morphology, electronic structure, chromium concentration, and local chemical and structural environments in Cr:Ga{sub 2}Se{sub 3} films grown epitaxially on silicon is investigated with magnetometry, scanning tunneling microscopy, photoemission spectroscopy, and x-ray absorption spectroscopy. Inclusion of a few percent chromium in Ga{sub 2}Se{sub 3} results in laminar, semiconducting films that are ferromagnetic at room temperature with a magnetic moment 4{micro}{sub B}/Cr. The intrinsic-vacancy structure of defected-zinc-blende {beta}-Ga{sub 2}Se{sub 3} enables Cr incorporation in a locally octahedral site without disrupting long-range order, determined by x-ray absorption spectroscopy, as well as strong overlap between Cr 3d states and the Se 4p states lining the intrinsic-vacancy rows, observed with photoemission. The highest magnetic moment per Cr is observed near the solubility limit of roughly one Cr per three vacancies. At higher Cr concentrations, islanded, metallic films result, with a magnetic moment that depends strongly on surface morphology. The effective valence is Cr{sup 3+} in laminar films, with introduction of Cr{sup 0} upon islanding. A mechanism is proposed for laminar films whereby ordered intrinsic vacancies mediate ferromagnetism.

  11. Effect of annealing treatment on the electrical characteristics of Pt/Cr-embedded ZnO/Pt resistance random access memory devices

    SciTech Connect (OSTI)

    Chang, Li-Chun; Kao, Hsuan-Ling; Liu, Keng-Hao

    2014-03-15

    ZnO/Cr/ZnO trilayer films sandwiched with Pt electrodes were prepared for nonvolatile resistive memory applications. The threshold voltage of a ZnO device embedded with a 3-nm Cr interlayer was approximately 50% lower than that of a ZnO monolayer device. This study investigated threshold voltage as a function of Cr thickness. Both the ZnO monolayer device and the Cr-embedded ZnO device structures exhibited resistance switching under electrical bias both before and after rapid thermal annealing (RTA) treatment, but resistive switching effects in the two cases exhibited distinct characteristics. Compared with the as-fabricated device, the memory cell after RTA demonstrated remarkable device parameter improvements, including a lower threshold voltage, a lower write current, and a higher R{sub off}/R{sub on} ratio. Both transmission electron microscope observations and Auger electron spectroscopy revealed that the Cr charge trapping layer in Cr-embedded ZnO dispersed uniformly into the storage medium after RTA, and x-ray diffraction and x-ray photoelectron spectroscopy analyses demonstrated that the Cr atoms lost electrons to become Cr{sup 3+} ions after dispersion. These results indicated that the altered status of Cr in ZnO/Cr/ZnO trilayer films during RTA treatment was responsible for the switching mechanism transition.

  12. Thermal aging modeling and validation on the Mo containing Fe-Cr-Ni alloys

    SciTech Connect (OSTI)

    Yang, Ying; Tan, Lizhen; Busby, Jeremy T.

    2015-04-01

    Thermodynamics of intermetallic phases in Fe-rich Fe-Cr-Ni-Mo alloys is critical knowledge to understand thermal aging effect on the phase stability of Mo-containing austenitic steels, which subsequently facilitates alloy design/improvement and degradation mitigation of these materials for reactor applications. Among the intermetallic phases, Chi (χ), Laves, and Sigma (σ) are often of concern because of their tendency to cause embrittlement of the materials. The focus of this study is thermal stability of the Chi and Laves phases as they were less studied compared to the Sigma phase. Coupled with thermodynamic modeling, thermal stability of intermetallic phases in Mo containing Fe-Cr-Ni alloys was investigated at 1000, 850 and 700 C for different annealing times. The morphologies, compositions and crystal structures of the precipitates of the intermetallic phases were carefully examined by scanning electron microscopy, electron probe microanalysis, X-ray diffraction, and transmission electron microscopy. Three key findings resulted from this study. First, the Chi phase is stable at high temperature, and with decreasing temperature it transforms into the Laves phase that is stable at low temperature. Secondly, Cr, Mo, Ni are soluble in both the Chi and Laves phases, with the solubility of Mo playing a major role in the relative stability of the intermetallic phases. Thirdly, in situ transformation from Chi phase to Laves phase was directly observed, which increased the local strain field, generated dislocations in the intermetallic phases, and altered the precipitate phase orientation relationship with the austenitic matrix. The thermodynamic models that were developed and validated were then applied to evaluating the effect of Mo on the thermal stability of intermetallic phases in type 316 and NF709 stainless steels.

  13. Effects of Partial Phase Transformation on Characteristics of 9Cr Nanostructured Ferritic Alloy

    SciTech Connect (OSTI)

    Ji Hyun, Yoon; Byun, Thak Sang; Hoelzer, David T

    2014-01-01

    The core structures of future nuclear systems require tolerance to extreme irradiation, and some critical components, for example, the fuel cladding in Sodium-cooled Fast Reactors (SFRs), have to maintain mechanical integrity to very high doses of 200 -400 dpa at high temperatures up to 700 degrees C. The high Cr nanostructured ferritic alloys (NFAs) are under intense research worldwide as a candidate core material. Although the NFAs have some admirable characteristics for high-temperature applications, their crack sensitivity is very high at high temperatures. The fracture toughness of high strength NFAs is unacceptably low above 300 degrees C. The objective of this study is to develop processes and microstructures with improved high temperature fracture toughness and ductility. To optimize the afterextrusion heat treatment condition, both the computational simulation technique on phase equilibrium and the basic microstructural and mechanical characterization have been carried out. 9 Cr-NFA was produced by the mechanical alloying of pre-alloyed Fe-9Cr base metallic powder and yttria particles, and subsequent extrusion. The post-extrusion heat-treatments of various conditions were applied to the asextruded NFA. The tensile and fracture toughness tests were conducted for as-extruded and heat-treated samples at up to 700 degrees C. Fracture toughness of the NFA has increased by more than 40% at every testing temperature after heat-treatment in the inter-critical temperature range. The increment of fracture toughness of the NFA after post-extrusion heat-treatment is attributed to the increased strength at below 500 degrees C, and an increased ductility at 700 degrees C.

  14. Alloy Design and Development of Cast Cr-W-V Ferritic Steels for Improved High-Temperature Strength for Power Generation Applications

    SciTech Connect (OSTI)

    Klueh, R.L.; Maziasz, P.J.; Vitek, J.M.; Evans, N.D.; Hashimoto, N.

    2006-09-23

    Economic and environmental concerns demand that the power-generation industry seek increased efficiency for gas turbines. Higher efficiency requires higher operating temperatures, with the objective temperature for the hottest sections of new systems {approx} 593 C, and increasing to {approx} 650 C. Because of their good thermal properties, Cr-Mo-V cast ferritic steels are currently used for components such as rotors, casings, pipes, etc., but new steels are required for the new operating conditions. The Oak Ridge National Laboratory (ORNL) has developed new wrought Cr-W-V steels with 3-9% Cr, 2-3% W, 0.25% V (compositions are in wt.%), and minor amounts of additional elements. These steels have the strength and toughness required for turbine applications. Since cast alloys are expected to behave differently from wrought material, work was pursued to develop new cast steels based on the ORNL wrought compositions. Nine casting test blocks with 3, 9, and 11% Cr were obtained. Eight were Cr-W-V-Ta-type steels based on the ORNL wrought steels; the ninth was COST CB2, a 9Cr-Mo-Co-V-Nb cast steel, which was the most promising cast steel developed in a European alloy-development program. The COST CB2 was used as a control to which the new compositions were compared, and this also provided a comparison between Cr-W-V-Ta and Cr-Mo-V-Nb compositions. Heat treatment studies were carried out on the nine castings to determine normalizing-and-tempering treatments. Microstructures were characterized by both optical and transmission electron microscopy (TEM). Tensile, impact, and creep tests were conducted. Test results on the first nine cast steel compositions indicated that properties of the 9Cr-Mo-Co-V-Nb composition of COST CB2 were better than those of the 3Cr-, 9Cr-, and 11Cr-W-V-Ta steels. Analysis of the results of this first iteration using computational thermodynamics raised the question of the effectiveness in cast steels of the Cr-W-V-Ta combination versus the Cr-Mo-V-Nb combination in COST CB2. To explore this question, nine more casting test blocks, four 3Cr steels and five 11Cr steels were purchased, and microstructure and mechanical properties studies similar to those described above for the first iteration of test blocks were conducted. Experimental results from the second iteration indicated that 11 Cr steels with excellent properties are possible. The 11Cr-1.5Mo-V-Nb steels were superior to 11Cr-2W-V-Ta steels, and it appears the former class of steels can be developed to have tensile and creep properties exceeding those of COST CB2. The W-Nb combination in an 11Cr-2W-V-Nb steel had tensile and short-time creep properties at 650 C better than the 11Cr-1.5Mo-V-Nb steels, although long-time low-stress properties may not be as good because of Laves phase formation. Based on the results, the next step in the development of improved casting steels involves acquisition of 11Cr-1.5Mo-V-Nb-N-B-C and 11Cr-2W-V-Nb-N-B-C steels on which long-term creep-rupture tests (>10,000 h) be conducted. For better oxidation and corrosion resistance, development of 11Cr steels, as opposed to a 9Cr steels, such as COST CB2, are important for future turbine designs that envision operating temperatures of 650 C.

  15. Creep and oxidation behavior of modified CF8C-plus with W, Cu, Ni, and Cr

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Unocic, Kinga A.; Dryepondt, Sebastien N.; Yamamoto, Yukinori; Maziasz, Philip J.

    2016-02-01

    Here, the microstructures of modified CF8C-Plus (Fe-19Cr-12Ni-0.4W-3.8Mn-0.2Mo-0.6Nb-0.5Si-0.9C) with W and Cu (CF8CPWCu) and CF8CPWCu enhanced with 21Cr + 15Ni or 22Cr + 17.5Ni were characterized in the as-cast condition and after creep testing. When imaged at lower magnifications, the as-cast microstructure was similar among all three alloys as they all contained a Nb-rich interdendritic phase and Mn-based inclusions. Transmission electron microscopy (TEM) analysis showed the presence of nanoscale Cu-rich nanoprecipitates distributed uniformly throughout the matrix of CF8CPWCu, whereas in CF8CPWCu22/17, Cu precipitates were found primarily at the grain boundaries. The presence of these nanoscale Cu-rich particles, in addition to W-richmore » Cr23C6, nanoscale Nb carbides, and Z-phase (Nb2Cr2N2), improved the creep strength of the CF8CPWCu steel. Modification of CF8CPWCu with Cr and Ni contents slightly decreased the creep strength but significantly improved the oxidation behavior at 1073 K (800 °C). In particular, the addition of 22Cr and 17.5Ni strongly enhanced the oxidation resistance of the stainless steel resulting in a 100 degrees or greater temperature improvement, and this composition provided the best balance between improving both mechanical properties and oxidation resistance.« less

  16. Nanostructured Cu-Cr alloy with high strength and electrical conductivity

    SciTech Connect (OSTI)

    Islamgaliev, R. K. Nesterov, K. M.; Bourgon, J.; Champion, Y.; Valiev, R. Z.

    2014-05-21

    The influence of nanostructuring by high pressure torsion (HPT) on strength and electrical conductivity in the Cu-Cr alloy has been investigated. Microstructure of HPT samples was studied by transmission electron microscopy with special attention on precipitation of small chromium particles after various treatments. Effect of dynamic precipitation leading to enhancement of strength and electrical conductivity was observed. It is shown that nanostructuring leads to combination of high ultimate tensile strength of 790–840 MPa, enhanced electrical conductivity of 81%–85% IACS and thermal stability up to 500 °C. The contributions of grain refinement and precipitation to enhanced properties of nanostructured alloy are discussed.

  17. Corrosion and degradation of a polyurethane/Co-Ni-Cr-Mo pacemaker lead

    SciTech Connect (OSTI)

    Sung, P.; Fraker, A.C.

    1987-12-01

    An investigation to study changes in the metal surfaces and the polyurethane insulation of heart pacemaker leads under controlled in vitro conditions was conducted. A polyurethane (Pellethane 2363-80A)/Co-Ni-Cr-Mo (MP35N) wire lead was exposed in Hanks' physiological saline solution for 14 months and then analyzed using scanning electron microscopy, x-ray energy dispersive analysis, and small angle x-ray scattering. Results showed that some leakage of solution into the lead had occurred and changes were present on both the metal and the polyurethane surfaces.

  18. Audit Report: CR-B-02-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    1 Audit Report: CR-B-02-01 October 15, 2001 Fixed-Price Contracting for Department of Energy Cleanup Activities As part of its Contract Reform effort, the Department of Energy (Department) acted to increase its use of fixed-price contracts. This shift was designed to increase the cost-effectiveness of operations. Since October 1994, the Office of Environmental Management (EM) has awarded a number of fixed-price contracts for environmental cleanup activities. In so doing, EM expected significant

  19. Audit Report: CR-B-98-01 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    1 Audit Report: CR-B-98-01 October 8, 1997 Audit of the Internal Control Structure of the Department of Energy's Working Capital Fund The Subcommittee on Energy and Water Development of the Committee on Appropriations, in its report dated July 16, 1996, approved the implementation of a Working Capital Fund (Fund) at the U.S. Department of Energy. The Subcommittee also directed the Office of Inspector General to conduct periodic audits of the Fund. This audit was conducted to determine if the

  20. Audit Report: CR-B-99-02 | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    2 Audit Report: CR-B-99-02 September 30, 1999 Management of Unneeded Materials and Chemicals For more than 50 years, the U.S. Department of Energy (Department) and its contractors operated large production facilities and laboratories that acquired and produced directly or as by-products enormous amounts of non-nuclear materials such as sodium, lead, chemicals, and scrap metal. However, a mission change resulting from the end of the Cold War called into question the need for continued stockpiling

  1. Testing Novel CR-39 Detector Deployment System For Identification of Subsurface Fractures, Soda Springs, ID

    SciTech Connect (OSTI)

    McLing, Travis; Carpenter, Michael; Brandon, William; Zavala, Bernie

    2015-06-01

    The Environmental Protection Agency (EPA) has teamed with Battelle Energy Alliance, LLC (BEA) at Idaho National Laboratory (INL) to facilitate further testing of geologic-fracture-identification methodology at a field site near the Monsanto Superfund Site located in Soda Springs, Idaho. INL has the necessary testing and technological expertise to perform this work. Battelle Memorial Institute (BMI) has engaged INL to perform this work through a Work for Others (WFO) Agreement. This study continues a multi-year collaborative effort between INL and EPA to test the efficacy of using field deployed Cr-39 radon in soil portals. This research enables identification of active fractures capable of transporting contaminants at sites where fractures are suspected pathways into the subsurface. Current state of the art methods for mapping fracture networks are exceedingly expensive and notoriously inaccurate. The proposed WFO will evaluate the applicability of using cheap, readily available, passive radon detectors to identify conductive geologic structures (i.e. fractures, and fracture networks) in the subsurface that control the transport of contaminants at fracture-dominated sites. The proposed WFO utilizes proven off-the-shelf technology in the form of CR-39 radon detectors, which have been widely deployed to detect radon levels in homes and businesses. In an existing collaborative EPA/INL study outside of this workscope,. CR-39 detectors are being utilized to determine the location of active transport fractures in a fractured granitic upland adjacent to a landfill site at the Fort Devens, MA that EPA-designated as National Priorities List (NPL) site. The innovative concept of using an easily deployed port that allows the CR-39 to measure the Rn-222 in the soil or alluvium above the fractured rock, while restricting atmospheric Rn-222 and soil sourced Ra from contaminating the detector is unique to INL and EPA approach previously developed. By deploying a series of these inexpensive detector-casing combinations statistical samples of the Rn-222 flux can be measured, elucidating the most communicative fractures (i.e. fractures that are actively transporting water and gasses). The Rn-222 measurements can then be used as an input to create a more accurate conceptual model to be used for transport modeling and related cleanup activities. If the team’s approach is demonstrated to be applicable to a wide variety of rock types and soil conditions it might potentially offer significant cost saving without a reduction in data quality at Monsanto Superfund and other sites underlain by fracture-dominated bedrock.

  2. Model independent interpretation of recent CR lepton data after AMS-02

    SciTech Connect (OSTI)

    Gaggero, Daniele; Maccione, Luca E-mail: luca.maccione@lmu.de

    2013-12-01

    We model the CR leptonic fluxes above 20 GeV in terms of a superposition of a standard and a charge symmetric extra component, which we generically describe as power-laws in momentum. We investigate under these hypotheses the compatibility between AMS-02, Fermi-LAT and PAMELA datasets on positron fraction, electron+positron spectrum and electron spectrum respectively. We find that it is possible to reconcile AMS and Fermi-LAT data within uncertainties, if energy-dependent effects are present in Fermi-LAT systematics. We also study possible deviations from charge symmetry in the extra component and find no compelling evidence for them.

  3. Reactive oxygen species mediate Cr(VI)-induced carcinogenesis through PI3K/AKT-dependent activation of GSK-3β/β-catenin signaling

    SciTech Connect (OSTI)

    Son, Young-Ok; Pratheeshkumar, Poyil; Wang, Lei; Wang, Xin; Fan, Jia; Kim, Dong-Hern; Lee, Ju-Yeon; Zhang, Zhuo; Lee, Jeong-Chae; Shi, Xianglin

    2013-09-01

    Cr(VI) compounds are known human carcinogens that primarily target the lungs. Cr(VI) produces reactive oxygen species (ROS), but the exact effects of ROS on the signaling molecules involved in Cr(VI)-induced carcinogenesis have not been extensively studied. Chronic exposure of human bronchial epithelial cells to Cr(VI) at nanomolar concentrations (10–100 nM) for 3 months not only induced cell transformation, but also increased the potential of these cells to invade and migrate. Injection of Cr(VI)-stimulated cells into nude mice resulted in the formation of tumors. Chronic exposure to Cr(VI) increased levels of intracellular ROS and antiapoptotic proteins. Transfection with catalase or superoxide dismutase (SOD) prevented Cr(VI)-mediated increases in colony formation, cell invasion, migration, and xenograft tumors. While chronic Cr(VI) exposure led to activation of signaling cascades involving PI3K/AKT/GSK-3β/β-catenin and PI3K/AKT/mTOR, transfection with catalase or SOD markedly inhibited Cr(VI)-mediated activation of these signaling proteins. Inhibitors specific for AKT or β-catenin almost completely suppressed the Cr(VI)-mediated increase in total and active β-catenin proteins and colony formation. In particular, Cr(VI) suppressed autophagy of epithelial cells under nutrition deprivation. Furthermore, there was a marked induction of AKT, GSK-3β, β-catenin, mTOR, and carcinogenic markers in tumor tissues formed in mice after injection with Cr(VI)-stimulated cells. Collectively, our findings suggest that ROS is a key mediator of Cr(VI)-induced carcinogenesis through the activation of PI3K/AKT-dependent GSK-3β/β-catenin signaling and the promotion of cell survival mechanisms via the inhibition of apoptosis and autophagy. - Highlights: • Chronic exposure to Cr(VI) induces carcinogenic properties in BEAS-2B cells. • ROS play an important role in Cr(VI)-induced tumorigenicity of BEAS-2B cells. • PI3K/AKT/GSK-3β/β-catenin signaling involved in Cr(VI) carcinogenesis. • The inhibition of apoptosis and autophagy contributes to Cr(VI) carcinogenesis.

  4. Highly tunable magnetism in silicene doped with Cr and Fe atoms under isotropic and uniaxial tensile strain

    SciTech Connect (OSTI)

    Zheng, Rui; Ni, Jun; Chen, Ying

    2015-12-28

    We have investigated the magnetic properties of silicene doped with Cr and Fe atoms under isotropic and uniaxial tensile strain by the first-principles calculations. We find that Cr and Fe doped silicenes show strain-tunable magnetism. (1) The magnetism of Cr and Fe doped silicenes exhibits sharp transitions from low spin states to high spin states by a small isotropic tensile strain. Specially for Fe doped silicene, a nearly nonmagnetic state changes to a high magnetic state by a small isotropic tensile strain. (2) The magnetic moments of Fe doped silicene also show a sharp jump to ∼2 μ{sub B} at a small threshold of the uniaxial strain, and the magnetic moments of Cr doped silicene increase gradually to ∼4 μ{sub B} with the increase of uniaxial strain. (3) The electronic and magnetic properties of Cr and Fe doped silicenes are sensitive to the magnitude and direction of the external strain. The highly tunable magnetism may be applied in the spintronic devices.

  5. Impact of x-ray dose on track formation and data analysis for CR-39-based proton diagnostics

    SciTech Connect (OSTI)

    Rinderknecht, H. G. Rojas-Herrera, J.; Zylstra, A. B.; Frenje, J. A.; Gatu Johnson, M.; Sio, H.; Sinenian, N.; Rosenberg, M. J.; Li, C. K.; Séguin, F. H.; Petrasso, R. D.; Filkins, T.; Steidle, Jessica A.; Traynor, N.; Freeman, C.; Steidle, Jeffrey A.

    2015-12-15

    The nuclear track detector CR-39 is used extensively for charged particle diagnosis, in particular proton spectroscopy, at inertial confinement fusion facilities. These detectors can absorb x-ray doses from the experiments in the order of 1–100 Gy, the effects of which are not accounted for in the previous detector calibrations. X-ray dose absorbed in the CR-39 has previously been shown to affect the track size of alpha particles in the detector, primarily due to a measured reduction in the material bulk etch rate [Rojas-Herrera et al., Rev. Sci. Instrum. 86, 033501 (2015)]. Similar to the previous findings for alpha particles, protons with energies in the range 0.5–9.1 MeV are shown to produce tracks that are systematically smaller as a function of the absorbed x-ray dose in the CR-39. The reduction of track size due to x-ray dose is found to diminish with time between exposure and etching if the CR-39 is stored at ambient temperature, and complete recovery is observed after two weeks. The impact of this effect on the analysis of data from existing CR-39-based proton diagnostics on OMEGA and the National Ignition Facility is evaluated and best practices are proposed for cases in which the effect of x rays is significant.

  6. Room temperature ferromagnetism in epitaxial Cr{sub 2}O{sub 3} thin films grown on r-sapphire

    SciTech Connect (OSTI)

    Punugupati, Sandhyarani Narayan, Jagdish; Hunte, Frank

    2015-05-21

    We report on the epitaxial growth and magnetic properties of Cr{sub 2}O{sub 3} thin films grown on r-sapphire substrate using pulsed laser deposition. The X-ray diffraction (XRD) (2θ and Φ) and TEM characterization confirm that the films are grown epitaxially. The r-plane (011{sup ¯}2) of Cr{sub 2}O{sub 3} grows on r-plane of sapphire. The epitaxial relations can be written as [011{sup ¯}2] Cr{sub 2}O{sub 3} ‖ [011{sup ¯}2] Al{sub 2}O{sub 3} (out-of-plane) and [1{sup ¯}1{sup ¯}20] Cr{sub 2}O{sub 3} ‖ [1{sup ¯}1{sup ¯}20] Al{sub 2}O{sub 3} (in-plane). The as-deposited films showed ferromagnetic behavior up to 400 K but ferromagnetism almost vanishes with oxygen annealing. The Raman spectroscopy data together with strain measurements using high resolution XRD indicate that ferromagnetism in r-Cr{sub 2}O{sub 3} thin films is due to the strain caused by defects, such as oxygen vacancies.

  7. On the peculiar properties of triangular-chain EuCr{sub 3}(BO{sub 3}){sub 4} antiferromagnet

    SciTech Connect (OSTI)

    Gondek, ?.; Szytu?a, A.; Przewo?nik, J.; ?ukrowski, J.; Prokhorov, A.; Chernush, L.; Zubov, E.; Dyakonov, V.; Tyvanchuk, Yu.

    2014-02-15

    In this paper we report studies on EuCr{sub 3}(BO{sub 3}){sub 4} compound, that is a member of newly discovered family of huntite-related specimens for non-linear optics. For the first time, the uncommon temperature dependence of the EuCr{sub 3}(BO{sub 3}){sub 4} lattice parameters is reported. Additionally, the magnetism of this compound is extremely interesting. Namely, a possible interplay in between potentially magnetic rare-earth ions and 3d metal stacked within quasi-1D chain that can lead to a great variety of magnetic behaviour. Indeed, in our studies we have found 3D-long range ordering with metamagnetic behaviour, while at higher temperature the magnetic chains become uncoupled. - Graphical abstract: Torsion-like vibrations are the key to understand negative thermal expansion along the a-axis. Display Omitted - Highlights: EuCr{sub 3}(BO{sub 3}){sub 4} is a peculiar triangular-chain antiferromagnet. Rare earth sublattice is non-magnetic with Eu{sup 3+} configuration. Cr{sup 3+} magnetic moments show 1-D behaviour along with spin fluctuations. Torsion vibrations of Cr triangular tubes lead to anomalous expansion of unit cell.

  8. Localized Corrosion of a Neutron Absorbing Ni-Cr-Mo-Gd Alloy

    SciTech Connect (OSTI)

    R.E. Mizia; T. E. Lister; P. J. Pinhero; T. L. Trowbridge

    2005-04-01

    The National Spent Nuclear Fuel Program, located at the Idaho National Laboratory (INL), has developed a new nickel-chromium-molybdenum-gadolinium structural alloy for storage and long-term disposal of spent nuclear fuel (SNF). The new alloy will be used for SNF storage container inserts for nuclear criticality control. Gadolinium has been chosen as the neutron absorption alloying element due to its high thermal neutron absorption cross section. This alloy must be resistant to localized corrosion when exposed to postulated Yucca Mountain in-package chemistries. The corrosion resistance properties of three experimental heats of this alloy are presented. The alloys performance are be compared to Alloy 22 and borated stainless steel. The results show that initially the new Ni-Cr-Mo-Gd alloy is less resistant to corrosion as compared to another Ni-Cr-Mo-Gd alloy (Alloy 22); but when the secondary phase that contains gadolinium (gadolinide) is dissolved, the alloy surface becomes passive. The focus of this work is to qualify these gadolinium containing materials for ASME code qualification and acceptance in the Yucca Mountain Repository.

  9. Origin of spin gapless semiconductor behavior in CoFeCrGa: Theory and Experiment

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Bainsla, Lakhan; Mallick, A. I.; Raja, M. Manivel; Coelho, A. A.; Nigam, A. K.; Johnson, D. D.; Alam, Aftab; Suresh, K. G.

    2015-07-08

    Despite a plethora of materials suggested for spintronic applications, a new class of materials has emerged, namely spin gapless semiconductors (SGS), which offers potentially more advantageous properties than existing ones. These magnetic semiconductors exhibit a finite band gap for one spin channel and a closed gap for the other. Supported by electronic-structure calculations, we report evidence of SGS behavior in equiatomic quaternary CoFeCrGa, having a cubic Heusler (prototype LiMgPdSn) structure but exhibiting chemical disorder (DO3 structure). CoFeCrGa is found to transform from SGS to half-metallic phase under pressure, which is attributed to unique electronic-structure features. The saturation magnetization (MS) wasmore » obtained at 8K agrees with the Slater-Pauling rule and the Curie temperature (TC) is found to exceed 400K. Carrier concentration (up to 250K) and electrical conductivity are observed to be nearly temperature independent, prerequisites for SGS. The anomalous Hall coefficient is estimated to be 185S/cm at 5K. Considering the SGS properties and high TC, this material appears to be promising for spintronic applications.« less

  10. Magnetic Correlations in the Quasi-2D Semiconducting Ferromagnet CrSiTe3

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Williams, Travis J.; Aczel, Adam A.; Lumsden, Mark D.; Nagler, Stephen E.; Stone, Matthew B.; Yan, Jiaqiang; Mandrus, D.

    2015-10-02

    Intrinsic, two-dimensional ferromagnetic semiconductors are an important class of materials for overcoming the limitations of dilute magnetic semiconductors for spintronics applications. CrSiTe3 is a particularly interesting member of this class, since it can likely be exfoliated down to single layers, where Tc is predicted to increase dramatically. Establishing the nature of the magnetism in the bulk is a necessary precursor to understanding the magnetic behavior in thin film samples and the possible applications of this material. In this work, we use elastic and inelastic neutron scattering to measure the magnetic properties of single crystalline CrSiTe3. We find that there ismorea very small single ion anisotropy favoring magnetic ordering along the c-axis and that the measured spin waves fit well to a model where the moments are only weakly coupled along that direction. Finally, we find that both static and dynamic correlations persist within the ab-plane up to at least 300 K, strong evidence of this material's two-dimensional characteristics that are relevant for future studies on thin film and monolayer samples.less

  11. Subtask 12B1: Welding development for V-Cr-Ti alloys

    SciTech Connect (OSTI)

    King, J.F.; Goodwin, G.M.; Grossbeck, M.L.; Alexander, D.J.

    1995-03-01

    Development of the metallurgical and technological basis for the welding of thick sections of V-Cr-Ti alloys. The weldability and weldment properties of the V-5Cr-5Ti alloy have been evaluated. Results for the Sigmajig test of the vanadium alloy were similar to the cracking resistance of stainless steels, and indicates hot-cracking is unlikely to be a problem. Subsize Charpy test results for GTA weld metal in the as-welded condition have shown a significant reduction in toughness compared to the base metal. The weld metal toughness properties were restored to approximately that of the base metal after exposure to a PWHT 950{degrees}C. The subsize Charpy toughness results for the EB weld metal from this same heat of vanadium alloy has shown significant improvement in properties compared to the GTA weld metal and the base metal. Further testing and analysis will be conducted to more fully characterize the properties of weld metal for each welding process and develop a basic understanding of the cause of the toughness decrease in the GTA welds. 5 figs., 1 tab.

  12. Influence of fatigue on the nanohardness of NiTiCr-wires

    SciTech Connect (OSTI)

    Frotscher, M.; Young, M. L.; Bei, Hongbin; George, Easo P; Neuking, K.; Eggeler, G.

    2009-01-01

    Testing parameters, such as rotational speed and bending radius, have a strong influence on the fatigue life of pseudoelastic NiTi shape-memory alloys during bending rotation fatigue (BRF) experiments [M. F. X. Wagner, Int. J. Mat. Res. 97 (2006), p. 1687-1696. and M. Frotscher, et al., Thermomechanical processing, microstructure and bending rotation fatigue of ultra-fine grained NiTiCr-wires, Proceedings of the International Conference for Shape Memory and Superelastic Technologies (SMST 2007), Tsukuba, Japan, ASM International, (2008), p. 149-158.]. Previous studies showed a decrease in the fatigue life for smaller bending radius (i.e. higher equivalent strain) and larger rotational speed. This observation is associated with an increase of dislocation density, the stabilization of stressinduced martensite during cycling, and an increase of the plateau stresses due to self-heating. In the present study, we examine the influence of these fatigue parameters on the nanohardness and shape recovery of pseudoelastic NiTiCr shape-memory alloy wires by nanoindentation. We show that nanoindentation is a suitable method for the characterization of fatigue-related microstructural changes, which affect the mechanical properties.

  13. Magnetic Correlations in the Quasi-Two-Dimensional Semiconducting Ferromagnet CrSiTe3

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Williams, Travis J.; Aczel, Adam A.; Lumsden, Mark D.; Nagler, Stephen E.; Stone, Matthew B.; Yan, Jiaqiang -Q.; Mandrus, D.

    2015-10-02

    Intrinsic, 2D ferromagnetic semiconductors are an important class of materials for overcoming dilute magnetic semiconductors’ limitations for spintronics. CrSiTe3 is a particularly interesting material of this class, since it can likely be exfoliated to single layers, for which Tc is predicted to increase dramatically. Establishing the nature of the bulk material’s magnetism is necessary for understanding the thin-film magnetic behavior and the material’s possible applications. In this work, we use elastic and inelastic neutron scattering to measure the magnetic properties of single crystalline CrSiTe3. We find a very small single ion anisotropy that favors magnetic ordering along the c-axis andmore » that the measured spin waves fit well to a model in which the moments are only weakly coupled along that direction. Then, we find that both static and dynamic correlations persist within the ab-plane up to at least 300 K, which is strong evidence of the material's 2D characteristics that are relevant for future studies on thin film and monolayer samples.« less

  14. Oxidation Resistant, Cr Retaining, Electrically Conductive Coatings on Metallic Alloys for SOFC Interconnects

    SciTech Connect (OSTI)

    Vladimir Gorokhovsky

    2008-03-31

    This report describes significant results from an on-going, collaborative effort to enable the use of inexpensive metallic alloys as interconnects in planar solid oxide fuel cells (SOFCs) through the use of advanced coating technologies. Arcomac Surface Engineering, LLC, under the leadership of Dr. Vladimir Gorokhovsky, is investigating filtered-arc and filtered-arc plasma-assisted hybrid coating deposition technologies to promote oxidation resistance, eliminate Cr volatility, and stabilize the electrical conductivity of both standard and specialty steel alloys of interest for SOFC metallic interconnect (IC) applications. Arcomac has successfully developed technologies and processes to deposit coatings with excellent adhesion, which have demonstrated a substantial increase in high temperature oxidation resistance, stabilization of low Area Specific Resistance values and significantly decrease Cr volatility. An extensive matrix of deposition processes, coating compositions and architectures was evaluated. Technical performance of coated and uncoated sample coupons during exposures to SOFC interconnect-relevant conditions is discussed, and promising future directions are considered. Cost analyses have been prepared based on assessment of plasma processing parameters, which demonstrate the feasibility of the proposed surface engineering process for SOFC metallic IC applications.

  15. Origin of spin gapless semiconductor behavior in CoFeCrGa: Theory and Experiment

    SciTech Connect (OSTI)

    Bainsla, Lakhan; Mallick, A. I.; Raja, M. Manivel; Coelho, A. A.; Nigam, A. K.; Johnson, D. D.; Alam, Aftab; Suresh, K. G.

    2015-07-08

    Despite a plethora of materials suggested for spintronic applications, a new class of materials has emerged, namely spin gapless semiconductors (SGS), which offers potentially more advantageous properties than existing ones. These magnetic semiconductors exhibit a finite band gap for one spin channel and a closed gap for the other. Supported by electronic-structure calculations, we report evidence of SGS behavior in equiatomic quaternary CoFeCrGa, having a cubic Heusler (prototype LiMgPdSn) structure but exhibiting chemical disorder (DO3 structure). CoFeCrGa is found to transform from SGS to half-metallic phase under pressure, which is attributed to unique electronic-structure features. The saturation magnetization (MS) was obtained at 8K agrees with the Slater-Pauling rule and the Curie temperature (TC) is found to exceed 400K. Carrier concentration (up to 250K) and electrical conductivity are observed to be nearly temperature independent, prerequisites for SGS. The anomalous Hall coefficient is estimated to be 185S/cm at 5K. Considering the SGS properties and high TC, this material appears to be promising for spintronic applications.

  16. Hanford Speakers Bureau<br>>Frequently Asked Questions - Hanford...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    of the topics covered by the Hanford Speakers Bureau? The presentation covers various strategies for cleaning up the 586 square miles Hanford Site. Speakers can provide an...

  17. INFLUENCE OF CARBON AND DPA RATE ON NEUTRON-INDUCED SWELLING OF Fe-15Cr-16Ni-0.25Ti IN FFTF AT ~400 DEGREES C

    SciTech Connect (OSTI)

    Okita, Taira; Sekimura, Naoto; Garner, Francis A.; Wolfer, W. G.

    2002-12-31

    The purpose of this effort is to determine the influence of dpa rate and composition on the void swelling of simple austenitic Fe-Cr-Ni alloys. Contrary to the swelling behavior of fcc Fe-15Cr-16Ni and Fe-15Cr-16Ni-0.25Ti alloys irradiated in the same FFTF-MOTA experiment, Fe-15Cr-16Ni-0.25Ti-0.04C does not exhibit a dependence of swelling on dpa rate at approximately 400 degrees C. The transient regime of swelling is prolonged by carbon addition, however.

  18. Magnetic and Structural Phase Transitions in the Spinel Compound Fe1+xCr2 xO4

    SciTech Connect (OSTI)

    Ma, Jie; Garlea, Vasile O; Rondinone, Adam Justin; Aczel, Adam A; Calder, Stuart A; Dela Cruz, Clarina R; Sinclair, R.; Tian, Wei; Chi, Songxue; Kiswandhi, Andhika; Brooks, James S.; Zhou, Haidong; Matsuda, Masaaki

    2014-01-01

    Neutron diffraction, X-ray diffraction, magnetic susceptibility, and specific heat measurements have been used to investigate the magnetic and structural phase transitions of the spinel system Fe1+xCr2 xO4 (0.0 x 1.0). The temperature versus Fe concentration (x) phase diagram contains two magnetically ordered phases and four structural phases below 420 K. The complicated transitions are closely related to the change in the spin and orbital degrees of freedom induced by substitution of Fe ions for Cr ions. The systematic change in the crystal structure is explained by the combined effects of Jahn-Teller distortion, spin-lattice interaction, Fe2+-Fe3+ hopping, and disorder among Fe2+, Fe3+, and Cr3+ ions.

  19. Ab initio study on noncompensated CrO codoping of GaN for enhanced solar energy conversion

    SciTech Connect (OSTI)

    Pan, Hui; Gu, Baohua; Eres, Gyula; Zhang, Zhenyu

    2010-03-01

    We describe a novel photocatalyst obtained by codoping GaN with CrO, according to a new "noncompensated" codoping concept based on first-principles calculations. The approach enables controllable narrowing of the GaN band gap with significantly enhanced carrier mobility and photocatalytic activity in the visible light region and thus offers immense potential for application in solar energy conversion, water splitting, and a variety of solar-assisted photocatalysis. Our calculations indicate that the formation energy for the cation doping is greatly reduced by noncompensated codoping with an anion. Although Cr doping alone can split the band gap with the formation of an intermediate band, the mobility is low due to carrier trapping by the localized states. The first-principles calculations also demonstrate that CrO codoping of GaN shifts the Fermi level into the conduction band resulting in high carrier density and mobility.

  20. Total Reducing Capacity in Aquifer Minerals and Sediments: Quantifying the Potential to Attenuate Cr(VI) in Groundwater

    SciTech Connect (OSTI)

    Sisman, S. Lara

    2015-07-20

    Hexavalent chromium, Cr(VI), is present in the environment as a byproduct of industrial processes. Due to its mobility and toxicity, it is crucial to attenuate or remove Cr(VI) from the environment. The objective of this investigation was to quantify potential natural attenuation, or reduction capacity, of reactive minerals and aquifer sediments. Samples of reduced-iron containing minerals such as ilmenite, as well as Puye Formation sediments representing a contaminated aquifer in New Mexico, were reacted with chromate. The change in Cr(VI) during the reaction was used to calculate reduction capacity. This study found that minerals that contain reduced iron, such as ilmenite, have high reducing capacities. The data indicated that sample history may impact reduction capacity tests due to surface passivation. Further, this investigation identified areas for future research including: a) refining the relationships between iron content, magnetic susceptibility and reduction capacity, and b) long term kinetic testing using fresh aquifer sediments.

  1. Weldability of Fe-Al-Cr Overlay Coatings for CorrosionProtection in Oxidizing/Sulfidizing Environments

    SciTech Connect (OSTI)

    Regina, JR

    2003-03-04

    The effect of chromium additions to the weldability of Fe-Al based overlay claddings are currently being investigated for the corrosion protection of boiler tubes in Low NOx furnaces. The primary objective of this research is to identify weldable (crack-free) Fe-Al-Cr weld overlay coating compositions that provide corrosion resistance over long exposure times. During the current project phase, preliminary corrosion testing was conducted on several ternary Fe-Al-Cr alloys in two types of gaseous corrosion environments. These long-term corrosion tests were used to develop a target weld composition matrix and serve as a base line for future corrosion tests. Preliminary Fe-Al based welds with various aluminum concentrations and one ternary Fe-Al-Cr weld overlay were successfully deposited using a Gas Tungsten Arc Welding (GTAW) process and cracking susceptibility was evaluated on these coatings.

  2. Low voltage tunneling magnetoresistance in CuCrO{sub 2}-based semiconductor heterojunctions at room temperature

    SciTech Connect (OSTI)

    Li, X. R.; Han, M. J.; Shan, C.; Hu, Z. G. Zhu, Z. Q.; Chu, J. H.; Wu, J. D.

    2014-12-14

    CuCrO{sub 2}-based heterojunction diodes with rectifying characteristics have been fabricated by combining p-type Mg-doped CuCrO{sub 2} and n-type Al-doped ZnO. It was found that the current for the heterojunction in low bias voltage region is dominated by the trap-assisted tunneling mechanism. Positive magnetoresistance (MR) effect for the heterojunction can be observed at room temperature due to the tunneling-induced antiparallel spin polarization near the heterostructure interface. The MR effect becomes enhanced with the magnetic field, and shows the maximum at a bias voltage around 0.5 V. The phenomena indicate that the CuCrO{sub 2}-based heterojunction is a promising candidate for low-power semiconductor spintronic devices.

  3. MASS MEASUREMENT OF {sup 45}Cr AND ITS IMPACT ON THE Ca-Sc CYCLE IN X-RAY BURSTS

    SciTech Connect (OSTI)

    Yan, X. L.; Xu, H. S.; Litvinov, Yu. A.; Zhang, Y. H.; Tu, X. L.; Zhou, X. H.; He, J. J.; Sun, Y.; Wang, M.; Yuan, Y. J.; Xia, J. W.; Yang, J. C.; Jia, G. B.; Hu, Z. G.; Ma, X. W.; Mao, R. S.; Schatz, H.; Blaum, K.; Sun, B. H.; Audi, G.; and others

    2013-03-20

    Masses of neutron-deficient {sup 58}Ni projectile fragments have been measured at the HIRFL-CSR facility in Lanzhou, China employing the isochronous mass spectrometry technique. Masses of a series of short-lived T{sub z} = -3/2 nuclides including the {sup 45}Cr nucleus have been measured with a relative uncertainty of about 10{sup -6}-10{sup -7}. The new {sup 45}Cr mass turned out to be essential for modeling the astrophysical rp-process. In particular, we find that the formation of the predicted Ca-Sc cycle in X-ray bursts can be excluded.

  4. Stress-corrosion cracking and surface-pitting tests of NiCrFe alloy bolts (LWBR development program)

    SciTech Connect (OSTI)

    Keller, K.L.

    1983-02-01

    Accelerated corrosion tests confirmed the adequate resistance to stress corrosion cracking (SCC) of the specific heats of NiCrFe X-750 and NiCrFe 600 used as bolts in the LWBR. SCC acceleration was achieved by running autoclave corrosion tests at 680/sup 0/F (well above the LWBR core operating temperatures of approximately 525/sup 0/F to 560/sup 0/F). Component stress levels were representative of maximum service stresses. No specimens from heats of either alloy suffered SCC.

  5. Note: Application of CR-39 plastic nuclear track detectors for quality assurance of mixed oxide fuel pellets

    SciTech Connect (OSTI)

    Kodaira, S. Kurano, M.; Hosogane, T.; Ishikawa, F.; Kageyama, T.; Sato, M.; Kayano, M.; Yasuda, N.

    2015-05-15

    A CR-39 plastic nuclear track detector was used for quality assurance of mixed oxide fuel pellets for next-generation nuclear power plants. Plutonium (Pu) spot sizes and concentrations in the pellets are significant parameters for safe use in the plants. We developed an automatic Pu detection system based on dense α-radiation tracks in the CR-39 detectors. This system would greatly improve image processing time and measurement accuracy, and will be a powerful tool for rapid pellet quality assurance screening.

  6. Improvement of {gamma}-ray energy resolution of LaBr{sub 3}:Ce{sup 3+} scintillation detectors by Sr{sup 2+} and Ca{sup 2+} co-doping

    SciTech Connect (OSTI)

    Alekhin, M. S.; Haas, J. T. M. de; Khodyuk, I. V.; Dorenbos, P.; Kraemer, K. W.; Menge, P. R.; Ouspenski, V.

    2013-04-22

    Commercially available LaBr{sub 3}:5% Ce{sup 3+} scintillators show with photomultiplier tube readout about 2.7% energy resolution for the detection of 662 keV {gamma}-rays. Here we will show that by co-doping LaBr{sub 3}:Ce{sup 3+} with Sr{sup 2+} or Ca{sup 2+} the resolution is improved to 2.0%. Such an improvement is attributed to a strong reduction of the scintillation light losses that are due to radiationless recombination of free electrons and holes during the earliest stages (1-10 ps) inside the high free charge carrier density parts of the ionization track.

  7. Letter Report Documenting Progress of Second Generation ATF FeCrAl Alloy Fabrication

    SciTech Connect (OSTI)

    Yamamoto,, Y.; Yang, Y.; Field, K. G.; Terrani, K.; Pint, B. A.; Snead, L. L.

    2014-06-10

    Development of the 2nd generation ATF FeCrAl alloy has been initiated, and a candidate alloy was selected for trial tube fabrication through hot-extrusion and gun-drilling processes. Four alloys based on Fe-13Cr-4.5Al-0.15Y in weight percent were newly cast with minor alloying additions of Mo, Si, Nb, and C to promote solid-solution and second-phase precipitate strengthening. The alloy compositions were selected with guidance from computational thermodynamic tools. The lab-scale heats of ~ 600g were arc-melted and drop-cast, homogenized, hot-forged and -rolled, and then annealed producing plate shape samples. An alloy with Mo and Nb additions (C35MN) processed at 800°C exhibits very fine sub-grain structure with the sub-grain size of 1-3μm which exhibited more than 25% better yield and tensile strengths together with decent ductility compared to the other FeCrAl alloys at room temperature. It was found that the Nb addition was key to improving thermal stability of the fine sub-grain structure. Optimally, grains of less than 30 microns are desired, with grains up to and order of magnitude in desired produced through Nb addition. Scale-up effort of the C35MN alloy was made in collaboration with a commercial cast company who has a capability of vacuum induction melting. A 39lb columnar ingot with ~81mm diameter and ~305mm height (with hot-top) was commercially cast, homogenized, hot-extruded, and annealed providing 10mm-diameter bar-shape samples with the fine sub-grain structure. This commercial heat proved consistent with materials produced at ORNL at the lab-scale. Tubes and end caps were machined from the bar sample and provided to another work package for the ATF-1 irradiation campaign in the milestone M3FT-14OR0202251.

  8. Luteolin inhibits Cr(VI)-induced malignant cell transformation of human lung epithelial cells by targeting ROS mediated multiple cell signaling pathways

    SciTech Connect (OSTI)

    Pratheeshkumar, Poyil; Son, Young-Ok; Divya, Sasidharan Padmaja; Roy, Ram Vinod; Hitron, John Andrew; Wang, Lei; Kim, Donghern; Dai, Jin; Asha, Padmaja; Zhang, Zhuo; Wang, Yitao; Shi, Xianglin

    2014-12-01

    Hexavalent chromium [Cr(VI)] is a well-known human carcinogen associated with the incidence of lung cancer. Inhibition of metal induced carcinogenesis by a dietary antioxidant is a novel approach. Luteolin, a natural dietary flavonoid found in fruits and vegetables, possesses potent antioxidant and anti-inflammatory activity. We found that short term exposure of human bronchial epithelial cells (BEAS-2B) to Cr(VI) (5 μM) showed a drastic increase in ROS generation, NADPH oxidase (NOX) activation, lipid peroxidation, and glutathione depletion, which were significantly inhibited by the treatment with luteolin in a dose dependent manner. Treatment with luteolin decreased AP-1, HIF-1α, COX-2, and iNOS promoter activity induced by Cr(VI) in BEAS-2B cells. In addition, luteolin protected BEAS-2B cells from malignant transformation induced by chronic Cr(VI) exposure. Moreover, luteolin also inhibited the production of pro-inflammatory cytokines (IL-1β, IL-6, IL-8, TNF-α) and VEGF in chronic Cr(VI) exposed BEAS-2B cells. Western blot analysis showed that luteolin inhibited multiple gene products linked to survival (Akt, Fak, Bcl-2, Bcl-xL), inflammation (MAPK, NF-κB, COX-2, STAT-3, iNOS, TNF-α) and angiogenesis (HIF-1α, VEGF, MMP-9) in chronic Cr(VI) exposed BEAS-2B cells. Nude mice injected with BEAS-2B cells chronically exposed to Cr(VI) in the presence of luteolin showed reduced tumor incidence compared to Cr(VI) alone treated group. Overexpression of catalase (CAT) or SOD2, eliminated Cr(VI)-induced malignant transformation. Overall, our results indicate that luteolin protects BEAS-2B cells from Cr(VI)-induced carcinogenesis by scavenging ROS and modulating multiple cell signaling mechanisms that are linked to ROS. Luteolin, therefore, serves as a potential chemopreventive agent against Cr(VI)-induced carcinogenesis. - Highlights: • Luteolin inhibited Cr(VI)-induced oxidative stress. • Luteolin inhibited chronic Cr(VI)-induced malignant transformation. • Luteolin inhibited chronic Cr(VI)-induced inflammation. • Luteolin inhibited chronic Cr(VI)-induced angiogenesis.

  9. Heat treated 9 Cr-1 Mo steel material for high temperature application

    DOE Patents [OSTI]

    Jablonski, Paul D.; Alman, David; Dogan, Omer; Holcomb, Gordon; Cowen, Christopher

    2012-08-21

    The invention relates to a composition and heat treatment for a high-temperature, titanium alloyed, 9 Cr-1 Mo steel exhibiting improved creep strength and oxidation resistance at service temperatures up to 650.degree. C. The novel combination of composition and heat treatment produces a heat treated material containing both large primary titanium carbides and small secondary titanium carbides. The primary titanium carbides contribute to creep strength while the secondary titanium carbides act to maintain a higher level of chromium in the finished steel for increased oxidation resistance, and strengthen the steel by impeding the movement of dislocations through the crystal structure. The heat treated material provides improved performance at comparable cost to commonly used high-temperature steels such as ASTM P91 and ASTM P92, and requires heat treatment consisting solely of austenization, rapid cooling, tempering, and final cooling, avoiding the need for any hot-working in the austenite temperature range.

  10. Properties and features of structure formation CuCr-contact alloys in electron beam cladding

    SciTech Connect (OSTI)

    Durakov, Vasiliy G.; Dampilon, Bair V. E-mail: gnusov@rambler.ru; Gnyusov, Sergey F. E-mail: gnusov@rambler.ru

    2014-11-14

    The microstructure and properties of the contact CuCr alloy produced by electron-beam cladding have been investigated. The effect of the electron beam cladding parameters and preheating temperature of the base metal on the structure and the properties of the coatings has been determined. The bimodal structure of the cladding coating has been established. The short circuit currents tests have been carried out according to the Weil-Dobke synthetic circuit simulating procedure developed for vacuum circuit breakers (VCB) test in real electric circuits. Test results have shown that the electron beam cladding (EBC) contact material has better breaking capacity than that of commercially fabricated sintered contact material. The application of the technology of electron beam cladding for production of contact material would significantly improve specific characteristics and reliability of vacuum switching equipment.

  11. Structure of Oxide Nanoparticles in Fe-16Cr MA/ODS Ferritic Steel

    SciTech Connect (OSTI)

    Hsiung, L; Fluss, M; Kimura, A

    2010-04-06

    Oxide nanoparticles in Fe-16Cr ODS ferritic steel fabricated by mechanical alloying (MA) method have been examined using high-resolution transmission electron microscopy (HRTEM) techniques. A partial crystallization of oxide nanoparticles was frequently observed in as-fabricated ODS steel. The crystal structure of crystalline oxide particles is identified to be mainly Y{sub 4}Al{sub 2}O{sub 9} (YAM) with a monoclinic structure. Large nanoparticles with a diameter larger than 20 nm tend to be incoherent and have a nearly spherical shape, whereas small nanoparticles with a diameter smaller than 10 nm tend to be coherent or semi-coherent and have faceted boundaries. The oxide nanoparticles become fully crystallized after prolonged annealing at 900 C. These results lead us to propose a three-stage formation mechanism of oxide nanoparticles in MA/ODS steels.

  12. Thermo-mechanical processing (TMP) of Ti-48Al-2Nb-2Cr based alloys

    SciTech Connect (OSTI)

    Fuchs, G.E.

    1995-02-01

    The effects of heat treatment and deformation processing on the microstructures and properties of {gamma}-TiAl based alloys produced by ingot metallurgy (I/M) and powder metallurgy (P/M) techniques were examined. The alloy selected for this work is the second generation {gamma}-TiAl based alloy -- Ti-48Al-2Nb-2Cr (at %). Homogenization of I/M samples was performed at a variety of temperatures, followed by hot working by isothermal forging. P/M samples were prepared from gas atomized powders, consolidated by both HIP and extrusion and some of the HIPed material was then hot worked by isothermal forging. The effects of processing, heat treatment and hot working on the microstructures and properties will be discussed.

  13. The Russian-American Gallium Experiment (SAGE) Cr Neutrino Source Measurement

    SciTech Connect (OSTI)

    Abdurashitov, J.; Gavrin, V.; Girin, S.; Gorbachev, V.; Ibragimova, T.; Kalikhov, A.; Khairnasov, N.; Knodel, T.; Kornoukhov, V.; Mirmov, I.; Shikhin, A.; Veretenkin, E.; Vermul, V.; Yants, V.; Zatsepin, G.; Bowles, T.; Nico, J.; Teasdale, W.; Wark, D.; Cherry, M.; Karaulov, V.; Levitin, V.; Maev, V.; Nazarenko, P.; Shkolnik, V.; Skorikov, N.; Cleveland, B.; Daily, T.; Davis, R. Jr.; Lande, K.; Lee, C.; Wildenhain, P.; Khomyakov, Y.; Zvonarev, A.; Elliott, S.; Wilkerson, J.

    1996-12-01

    The solar neutrino capture rate measured by SAGE is well below that predicted by solar models. To check the overall experimental efficiency, we exposed 13tonnes of Ga metal to a reactor-produced 517kCi source of {sup 51}Cr. The ratio of the measured production rate to that predicted from the source activity is 0.95{plus_minus}0.11(stat)+0.05/{minus}0.08(syst). This agreement verifies that the experimental efficiency is measured correctly, establishes that there are no unknown systematic errors at the 10{percent} level, and provides considerable evidence for the reliability of the solar neutrino measurement. {copyright} {ital 1996 The American Physical Society.}

  14. Thermodynamic modeling and experimental validation of the Fe-Al-Ni-Cr-Mo alloy system

    SciTech Connect (OSTI)

    Teng, Zhenke; Zhang, F; Miller, Michael K; Liu, Chain T; Huang, Shenyan; Chou, Y.T.; Tien, R; Chang, Y A; Liaw, Peter K

    2012-01-01

    NiAl-type precipitate-strengthened ferritic steels have been known as potential materials for the steam turbine applications. In this study, thermodynamic descriptions of the B2-NiAl type nano-scaled precipitates and body-centered-cubic (BCC) Fe matrix phase for four alloys based on the Fe-Al-Ni-Cr-Mo system were developed as a function of the alloy composition at the aging temperature. The calculated phase structure, composition, and volume fraction were validated by the experimental investigations using synchrotron X-ray diffraction and atom probe tomography. With the ability to accurately predict the key microstructural features related to the mechanical properties in a given alloy system, the established thermodynamic model in the current study may significantly accelerate the alloy design process of the NiAl-strengthened ferritic steels.

  15. Thermomechanical treatment for improved neutron irradiation resistance of austenitic alloy (Fe-21Cr-32Ni)

    SciTech Connect (OSTI)

    L. Tan; J. T. Busby; H. J. M. Chichester; K. Sridharan; T. R. Allen

    2013-06-01

    An optimized thermomechanical treatment (TMT) applied to austenitic alloy 800H (Fe-21Cr-32Ni) had shown significant improvements in corrosion resistance and basic mechanical properties. This study examined its effect on radiation resistance by irradiating both the solution-annealed (SA) and TMT samples at 500 degrees C for 3 dpa. Microstructural characterization using transmission electron microscopy revealed that the radiation-induced Frank loops, voids, and y'-Ni3(Ti,Al) precipitates had similar sizes between the SA and TMT samples. The amounts of radiation-induced defects and more significantly y' precipitates, however, were reduced in the TMT samples. These reductions would approximately reduce by 40.9% the radiation hardening compared to the SA samples. This study indicates that optimized-TMT is an economical approach for effective overall property improvements.

  16. 2011 HONDA CR-Z 2982 - HYBRID ELECTRIC VEHICLE BATTERY TEST RESULTS

    SciTech Connect (OSTI)

    Gray, Tyler; Shirk, Matthew; Wishart, Jeffrey

    2014-09-01

    The U.S. Department of Energy’s Advanced Vehicle Testing Activity Program consists of vehicle, battery, and infrastructure testing on advanced technology related to transportation. The activity includes tests on hybrid electric vehicles, including testing traction batteries when both the vehicles and batteries are new and at the conclusion of 160,000 miles of on-road fleet testing. This report documents battery testing performed for the 2011 Honda CR-Z (VIN JHMZF1C64BS002982). Battery testing was performed by Intertek Testing Services NA. The Idaho National Laboratory and Intertek collaborate on the Advanced Vehicle Testing Activity for the Vehicle Technologies Office of the U.S. Department of Energy.

  17. Ion polished Cr/Sc attosecond multilayer mirrors for high water window reflectivity

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Guggenmos, Alexander; Radünz, Stefan; Rauhut, Roman; Hofstetter, Michael; Venkatesan, Sriram; Wochnik, Angela; Gullikson, Eric M.; Fischer, Stefan; Nickel, Bert; Scheu, Christina; et al

    2014-01-20

    Recent advances in the development of attosecond soft X-ray sources ranging into the water window spectral range, between the 1s states of carbon and oxygen (284 eV–543 eV), are also driving the development of suited broadband multilayer optics for steering and shaping attosecond pulses. The relatively low intensity of current High Harmonic Generation (HHG) soft X-ray sources calls for an efficient use of photons, thus the development of low-loss multilayer optics is of uttermost importance. Here, we report about the realization of broadband Cr/Sc attosecond multilayer mirrors with nearly atomically smooth interfaces by an optimized ion beam deposition and assistedmore » interface polishing process. This yields to our knowledge highest multilayer mirror reflectivity at 300 eV near normal incidence. The results are verified by transmission electron microscopy (TEM) and soft/hard X-ray reflectometry.« less

  18. Bose-Einstein condensation of triplons in Ba3Cr2O8

    SciTech Connect (OSTI)

    Jaime, Marcelo [Los Alamos National Laboratory; Kohama, Y [Los Alamos National Laboratory; Aczel, A [MCMASTER UNIV; Ninios, K [UNIV OF FL; Chan, H [UNIV OF FL; Balicas, L [NHMFL; Dabkowska, H [MCMASTER UNIV; Like, G [MCMASTER UNIV

    2009-01-01

    By performing heat capacity, magnetocaloric effect, torque magnetometry and force magnetometry measurements up to 33 T, we have mapped out the T-H phase diagram of the S = 1/2 spin dimer compound Ba{sub 3}Cr{sub 2}O{sub 8}. We found evidence for field-induced magnetic order between H{sub cl} = 12.52(2) T and H{sub c2} = 23.65(5) T, with the maximum transition temperature T{sub c} {approx} 2.7 K at H {approx} 18 T. The lower transition can likely be described by Bose-Einstein condensation of triplons theory, and this is consistent with the absence of any magnetization plateaus in our magnetic torque and force measurements. In contrast, the nature of the upper phase transition appears to be quite different as our measurements suggest that this transition is actually first order.

  19. Mn-Fe base and Mn-Cr-Fe base austenitic alloys

    DOE Patents [OSTI]

    Brager, Howard R.; Garner, Francis A.

    1987-01-01

    Manganese-iron base and manganese-chromium-iron base austenitic alloys designed to have resistance to neutron irradiation induced swelling and low activation have the following compositions (in weight percent): 20 to 40 Mn; up to about 15 Cr; about 0.4 to about 3.0 Si; an austenite stabilizing element selected from C and N, alone or in combination with each other, and in an amount effective to substantially stabilize the austenite phase, but less than about 0.7 C, and less than about 0.3 N; up to about 2.5 V; up to about 0.1 P; up to about 0.01 B; up to about 3.0 Al; up to about 0.5 Ni; up to about 2.0 W; up to about 1.0 Ti; up to about 1.0 Ta; and with the remainder of the alloy being essentially iron.

  20. Ion polished Cr/Sc attosecond multilayer mirrors for high water window reflectivity

    SciTech Connect (OSTI)

    Guggenmos, Alexander; Radünz, Stefan; Rauhut, Roman; Hofstetter, Michael; Venkatesan, Sriram; Wochnik, Angela; Gullikson, Eric M.; Fischer, Stefan; Nickel, Bert; Scheu, Christina; Kleineberg, Ulf

    2014-01-20

    Recent advances in the development of attosecond soft X-ray sources ranging into the water window spectral range, between the 1s states of carbon and oxygen (284 eV–543 eV), are also driving the development of suited broadband multilayer optics for steering and shaping attosecond pulses. The relatively low intensity of current High Harmonic Generation (HHG) soft X-ray sources calls for an efficient use of photons, thus the development of low-loss multilayer optics is of uttermost importance. Here, we report about the realization of broadband Cr/Sc attosecond multilayer mirrors with nearly atomically smooth interfaces by an optimized ion beam deposition and assisted interface polishing process. This yields to our knowledge highest multilayer mirror reflectivity at 300 eV near normal incidence. The results are verified by transmission electron microscopy (TEM) and soft/hard X-ray reflectometry.

  1. Super-High Temperature Alloys and Composites from NbW-Cr Systems

    SciTech Connect (OSTI)

    Shailendra Varma

    2008-12-31

    Nickel base superalloys must be replaced if the demand for the materials continues to rise for applications beyond 1000{sup o}C which is the upper limit for such alloys at this time. There are non-metallic materials available for such high temperature applications but they all present processing difficulties because of the lack of ductility. Metallic systems can present a chance to find materials with adequate room temperature ductility. Obviously the system must contain elements with high melting points. Nb has been chosen by many investigators which has a potential of being considered as a candidate if alloyed properly. This research is exploring the Nb-W-Cr system for the possible choice of alloys to be used as a high temperature material.

  2. Photo-transport properties of Pb{sub 2}CrO{sub 5} single crystals

    SciTech Connect (OSTI)

    Mondal, P. S.; Okazaki, R. Taniguchi, H.; Terasaki, I.

    2014-11-21

    We report photo-thermoelectric transport phenomena in Pb{sub 2}CrO{sub 5} single crystals. Without illumination, this material exhibits an insulating behavior characterized by an activation-type temperature variation of the electrical conductivity. The Seebeck coefficient contrastingly shows a crossover from high-temperature insulating to low-temperature metallic behavior, which is attributed to degenerate carriers in a donor level. We have found that under illumination, both the conductivity and the Seebeck coefficient increase in magnitude with increasing photon flux density in the degenerate-conduction regime. This result is difficult to understand within a simple photo-doping effect, which usually leads to a decrease in the Seebeck coefficient under illumination. The observed phenomenon is discussed in terms of a two-carrier contribution to the transport properties.

  3. 2011 Honda CR-Z 4466 - Hybrid Electric Vehicle Battery Test Results

    SciTech Connect (OSTI)

    Tyler Gray; Matthew Shirk; Jeffrey Wishart

    2014-09-01

    The U.S. Department of Energy’s Advanced Vehicle Testing Activity Program consists of vehicle, battery, and infrastructure testing on advanced technology related to transportation. The activity includes tests on hybrid electric vehicles, including testing traction batteries when both the vehicles and batteries are new and at the conclusion of 160,000 miles of on-road fleet testing. This report documents battery testing performed for the 2011 Honda CR-Z (VIN JHMZF1C67BS004466). Battery testing was performed by Intertek Testing Services NA. The Idaho National Laboratory and Intertek collaborate on the Advanced Vehicle Testing Activity for the Vehicle Technologies Office of the U.S. Department of Energy.

  4. Feasibility of correlating V-Cr-Ti alloy weld strength with weld chemistry. CRADA final report

    SciTech Connect (OSTI)

    Grossbeck, M.L.; Odom, R.W.

    1998-06-01

    The mechanical properties of refractory metals such as vanadium are determined to a large extent by the interstitial impurities in the alloy. In the case of welding, interstitial impurities are introduced in the welding process from the atmosphere and by dissolution of existing precipitates in the alloy itself. Because of the necessity of having an ultra-pure atmosphere, a vacuum chamber or a glove box is necessary. In the V-Cr-Ti system, the titanium serves as a getter to control the concentration of oxygen and nitrogen in solid solution in the alloy. In this project the secondary ion mass spectrometry (SIMS) technique was used to detect, measure, and map the spacial distribution of impurity elements in welds in the alloy V-4Cr-4Ti. An attempt was then made to correlate the concentrations and distributions of the impurities with mechanical properties of the welds. Mechanical integrity of the welds was determined by Charpy V-notch testing. Welds were prepared by the gas-tungsten-arc (GTA) method. Charpy testing established a correlation between weld impurity concentration and the ductile to brittle transition temperature (DBTT). Higher concentrations of oxygen resulted in a higher DBTT. An exception was noted in the case of a low-oxygen weld which had a high hydrogen concentration resulting in a brittle weld. The concentrations and distributions of the impurities determined by SIMS could not be correlated with the mechanical properties of the welds. This research supports efforts to develop fusion reactor first wall and blanket structural materials.

  5. Microstructural characterization of as-cast biocompatible Co-Cr-Mo alloys

    SciTech Connect (OSTI)

    Giacchi, J.V.; Morando, C.N.; Fornaro, O.; Palacio, H.A.

    2011-01-15

    The microstructure of a cobalt-base alloy (Co-Cr-Mo) obtained by the investment casting process was studied. This alloy complies with the ASTM F75 standard and is widely used in the manufacturing of orthopedic implants because of its high strength, good corrosion resistance and excellent biocompatibility properties. This work focuses on the resulting microstructures arising from samples poured under industrial environment conditions, of three different Co-Cr-Mo alloys. For this purpose, we used: 1) an alloy built up from commercial purity constituents, 2) a remelted alloy and 3) a certified alloy for comparison. The characterization of the samples was achieved by using optical microscopy (OM) with a colorant etchant to identify the present phases and scanning electron microscopy (SE-SEM) and energy dispersion spectrometry (EDS) techniques for a better identification. In general the as-cast microstructure is a Co-fcc dendritic matrix with the presence of a secondary phase, such as the M{sub 23}C{sub 6} carbides precipitated at grain boundaries and interdendritic zones. These precipitates are the main strengthening mechanism in this type of alloys. Other minority phases were also reported and their presence could be linked to the cooling rate and the manufacturing process variables and environment. - Research Highlights: {yields}The solidification microstructure of an ASTM-F75 type alloy were studied. {yields}The alloys were poured under an industrial environment. {yields}Carbides and sigma phase identified by color metallography and scanning microscopy (SEM and EDS). {yields}Two carbide morphologies were detected 'blocky type' and 'pearlite type'. {yields}Minority phases were also detected.

  6. HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3...

    Office of Scientific and Technical Information (OSTI)

    ...6Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel Citation Details In-Document Search Title: HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel You are accessing a ...

  7. Investigations of the optical and EPR properties of LiGa{sub 5}O{sub 8}:Cr{sup 3+} phosphor

    SciTech Connect (OSTI)

    Singh, Vijay; Ravikumar, R.V.S.S.N.; Sivaramaiah, G.; Rao, J.L.; Kim, S.H.

    2015-01-15

    Highlights: • Cr{sup 3+} doped LiGa{sub 5}O{sub 8} phosphor was synthesized by solution combustion synthesis. • Morphological studies show the non-uniform distribution of particles. • Photoluminescence spectra of Cr{sup 3+} doped LiGa{sub 5}O{sub 8} showed the characteristic Cr{sup 3+} peaks. • EPR spectrum showed Cr{sup 3+} ions in tetragonally distorted octahedral symmetry. - Abstract: Red emitting LiGa{sub 5}O{sub 8} doped with Cr{sup 3+} ions has been prepared by a low temperature solution combustion route. The as-prepared phosphor was studied using X-ray diffraction and scanning electron microscopic techniques. The optical spectrum exhibits two broad bands characteristic of Cr{sup 3+} ions in an octahedral symmetry. Upon excitation at 590 nm, the material displays narrow red emission line centered at 715 nm due to the {sup 2}E{sub g} → {sup 4}A{sub 2g} transition of Cr{sup 3+} ions. Electron paramagnetic resonance analyses of the sample confirm the presence of Cr{sup 3+} in the LiGa{sub 5}O{sub 8} matrix.

  8. Reversible nano-structuring of SrCrO3-? through oxidization and reduction at low temperatures

    SciTech Connect (OSTI)

    Zhang, Hongliang; Sushko, Petr; Colby, Robert J.; Du, Yingge; Bowden, Mark E.; Chambers, Scott A.

    2014-08-18

    Oxygen vacancies are often present in complex oxides as point defects and their effect on the electronic properties of the oxides is typically uniform and isotropic. Exploiting oxygen deficiency in order to generate controllably, novel structures and functional properties remains a challenging goal. We show that epitaxial strontium chromite films can be transformed, reversibly and at low temperature, from the cubic metallic perovskite SrCrO3-? to the rhombohedral semiconducting SrCrO2.8. Oxygen vacancies aggregate and give rise to ordered arrays of {111}-oriented SrO2 planes interleaved between layers of tetrahedrally-coordinated Cr4+ and separated by ~1 nm. First-principle calculations provide insight into the origin of the stability of such nanostructures and, consistent with the experimental data, predict that the barrier for oxide ion diffusion along these quasi-2D nanostructures is ~5 times lower than that in the cubic SrCrO3-? a property of considerable importance in, for example, solid oxide fuel cells.

  9. Effect of Austenization Temperature on the Microstructure and Strength of 9% and 12% Cr Ferritic-Martensitic Steels

    SciTech Connect (OSTI)

    Terry C. Totemeier

    2004-10-01

    The effect of reduced-temperature austenization on the microstructure and strength of two ferritic-martensitic steels was studied. Prototypic 9% and 12% Cr steels, grade 91 (9Cr-1MoVNb) and type 422 stainless (12Cr-1MoVW), respectively, were austenized at 925C and 1050C and tempered at 760C. The reduced austenization temperature was intended to simulate potential inadequate austenization during field construction of large structures and also the thermal cycle experienced in the Type IV region of weld heat affected zones (HAZ). The microstructure, tensile behavior, and creep strength were characterized for both steels treated at each condition. The reduced austenization temperature resulted in general coarsening of carbides in both steels and polygonization of the tempered martensite structure in type 422. For this steel, a marked reduction in microhardness was observed, while there was little change in microhardness for grade 91. Slight reductions in tensile strength were observed for both steels at room temperature and elevated temperatures of 450 and 550C. The strength reduction was greater for type 422 than for grade 91. At 650C the tensile strength reduction was minimal for both steels. Marked reductions in creep rupture lives were observed for both steels at 650C; the reductions were less at 600C and minimal at 550C. Overall, the higher Cr content steel was observed to be more sensitive to variations in heat treatment conditions.

  10. Giant magnetocaloric effect and temperature induced magnetization jump in GdCrO{sub 3} single crystal

    SciTech Connect (OSTI)

    Yin, L. H.; Yang, J.; Kan, X. C.; Song, W. H.; Dai, J. M.; Sun, Y. P.

    2015-04-07

    We report on a systematic study of the single-crystal GdCrO{sub 3}, which shows various novel magnetic features, such as temperature-induced magnetization reversal (TMR), temperature-induced magnetization jump (TMJ), spin reorientation, and giant magnetocaloric effect (MCE). In the field-cooled cooling process with modest magnetic field along the c axis, GdCrO{sub 3} first shows a TMR at T{sub comp}∼120−130 K and then an abrupt TMJ with a sign change of magnetization at T{sub jump}∼52−120 K, and finally a spin reorientation at T{sub SR}∼4−7 K. Interestingly, the remarkable TMJ behavior, which was not reported ever before, persists at higher fields up to 10 kOe even when TMR disappears. In addition, giant MCE with the maximum value of magnetic entropy change reaching ∼31.6 J/kg K for a field change of 44 kOe was also observed in GdCrO{sub 3} single crystal, suggesting it could be a potential material for low-T magnetic refrigeration. A possible mechanism for these peculiar magnetic behaviors is discussed based on the various competing magnetic interactions between the 3d electrons of Cr{sup 3+} ions and 4f electrons of Gd{sup 3+} ions.

  11. Measuring the activity of a {sup 51}Cr neutrino source based on the gamma-radiation spectrum

    SciTech Connect (OSTI)

    Gorbachev, V. V. Gavrin, V. N.; Ibragimova, T. V.; Kalikhov, A. V.; Malyshkin, Yu. M.; Shikhin, A. A.

    2015-12-15

    A technique for the measurement of activities of intense β sources by measuring the continuous gamma-radiation (internal bremsstrahlung) spectra is developed. A method for reconstructing the spectrum recorded by a germanium semiconductor detector is described. A method for the absolute measurement of the internal bremsstrahlung spectrum of {sup 51}Cr is presented.

  12. Modulation of physical and photocatalytic properties of (Cr, N) codoped TiO{sub 2} nanorods using soft solution processing

    SciTech Connect (OSTI)

    Lu, Wen-Chung; Nguyen, Hoang-Diem; Wu, Chun-Yi; Chang, Kao-Shuo Yoshimura, Masahiro

    2014-04-14

    Facile polymerized complex reactions together with a hydrothermal reaction were implemented to make single crystalline TiO{sub 2} nanorods for the first time. Chromium (Cr) and nitrogen (N{sub 2}) co-doping was performed to tailor the physical properties. Transmission electron microscopy and x-ray diffraction study illustrated that highly reactive facets of (101), (111), and (001) dominated rutile TiO{sub 2} nanorods. A growth model, based on formation of complex species, was proposed to elucidate effectiveness of the soft solution processing in making TiO{sub 2} nanorods. X-ray photoelectron spectroscopy analysis and consideration of fundamentals of charge neutrality showed N{sub 2} doping could inhibit formation of Cr{sup 6+} and oxygen vacancies (V{sub O}{sup 2+}). An investigation of the photocatalytic properties exhibited high efficiency of photodegradation of methylene blue in 15 min under pH = 10, using a nanocomposite of (7% Cr, 0.0021% N) codoped and 3% Cr doped TiO{sub 2} nanorods.

  13. Magnetic behavior in Cr{sub 2}@Ge{sub n} (1?n?12) clusters: A density functional investigation

    SciTech Connect (OSTI)

    Dhaka, Kapil Trivedi, Ravi Bandyopadhyay, Debashis

    2014-04-24

    With a goal to produce magnetic moment in Cr{sub 2} Doped Ge{sub n} clusters which will be useful for practical applications, we have considered the structure and magnetic properties of Pure Germanium clusters and substitutionally doped it with Cr dimer to produce Cr{sub 2}@Ge{sub n} clusters. As the first step of calculation, geometrical optimizations of the nanoclusters have been done. These optimized geometries have been used in calculate the average binding energy per atom (BE), HOMO-LUMO gap and hence the relative stability of the clusters. These parameters have been demonstrated as structural and electronic properties of the clusters. Gap between highest occupied molecular orbital and lowest unoccupied molecular orbital indicate cluster to be a potential motif for generating magnetic cluster assembled materials. Based on these values a comparative study on different sized clusters has been done in order to understand the origin of structures, electronic and magnetic properties of Cr{sub 2}@Ge{sub n} nanoclusters.

  14. Re-Evaluation of Results in NUREG/CR-6674 for Carbon and Low-Alloy Steel Components (MRP-76)

    SciTech Connect (OSTI)

    A. Deardorff; D. Harris; D. Dedhia

    2002-11-30

    This report evaluates the conservatisms and uncertainties reported in NUREG/CR-6674 that lead to high probabilities of cracking in carbon and low-alloy steel for reactor piping. The report uses additional data generated since the completion of the report to eliminate uncertainties and show lower probabilities of cracking.

  15. Optical absorption and luminescence spectroscopy of U{sup 3+} in K{sub 2}La{ital X}{sub 5} ({ital X}=Cl,Br,I)

    SciTech Connect (OSTI)

    Andres, H.P.; Kraemer, K.; Guedel, H.

    1996-08-01

    The title compounds were synthesized and high-resolution absorption and luminescence spectra measured in the near-infrared, VIS, and near UV regions. The visible absorption spectra are dominated by very intense 5{ital f}{r_arrow}6{ital d} bands overlapping with {ital f}-{ital f} transitions. The onset of the first {ital f}-{ital d} absorption is shifted from 46000 cm{sup {minus}1} in K{sub 2}LaCl{sub 5}:Nd{sup 3+} to 15000 cm{sup {minus}1} in K{sub 2}LaCl{sub 5}:U{sup 3+}. Crystal-field splittings in corresponding {sup 2{ital S}+1}{ital L}{sub {ital J}} multiplets are greater by typically a factor of 2 in the U{sup 3+} doped crystal, thus reflecting the larger extension and stronger interaction of the 5{ital f} electrons with the ligands. {ital f}-{ital f} transitions are typically two orders of magnitude more intense in K{sub 2}LaCl{sub 5}:U{sup 3+} than in K{sub 2}LaCl{sub 5}:Nd{sup 3+}. Along the halide series K{sub 2}La{ital X}{sub 5}:U{sup 3+} ({ital X}=Cl,Br,I) the differences in the position of corresponding {ital f}-{ital d} and {ital f}-{ital f} transitions, crystal-field splittings, vibronic intensities, and excited-state lifetimes can be explained with the increasing covalency, the decreasing phonon energies, the increasing electron-phonon coupling, and the increasing U-{ital X} distances. The {ital f}-{ital d} excited states provide a nonradiative bypass of some {ital f}-{ital f} excited states in the case of all these halide lattices. The excited-state dynamics are determined by a delicate interplay of radiative and nonradiative relaxation processes, they are strongly dependent on the nature of {ital X}. Multiphonon relaxation processes are least competitive in the iodide due to the very low value of 106 cm{sup {minus}1} for the highest-energy phonons. A cross-relaxation mechanism determines the dynamics of the iodide at room temperature. {copyright} {ital 1996 The American Physical Society.}

  16. Cr-doped Ge{sub 2}Sb{sub 2}Te{sub 5} for ultra-long data retention phase change memory

    SciTech Connect (OSTI)

    Wang, Qing; Xia, Yangyang; Zheng, Yonghui; Zhang, Qi; Liu, Bo Song, Sannian; Cheng, Yan; Song, Zhitang; Feng, Songlin; Huo, Ruru

    2015-11-30

    Phase change memory is regarded as one of the most promising candidates for the next-generation non-volatile memory. Its storage medium, phase change material, has attracted continuous exploration. Ge{sub 2}Sb{sub 2}Te{sub 5} (GST) is the most popular phase change material, but its thermal stability needs to be improved when used in some fields at high temperature (more than 120 °C). In this paper, we doped Cr atoms into GST and obtained Cr{sub 10}(Ge{sub 2}Sb{sub 2}Te{sub 5}){sub 90} (labeled as Cr-GST) with high thermal stability. For Cr-GST film, the sheet resistance ratio between amorphous and crystalline states is high up to 3 orders of magnitude. The crystalline Cr-GST film inherits the phase structure of GST, with metastable face-centered cubic phase and/or stable hexagonal phase. The doped Cr atoms not only bond with other atoms but also help to improve the anti-oxidation property of Cr-GST. As for the amorphous thermal stability, the calculated temperature for 10-year-data-retention of Cr-GST film, based on the Arrhenius equation, is about 180 °C. The threshold current and threshold voltage of a cell based on Cr-GST are about 6 μA and 2.7 V. The cell could be operated by suitable voltages for more than 40 000 cycles. Thus, Cr-GST is proved to be a promising phase change material with ultra-long data retention.

  17. Structure and physical properties of single crystal PrCr{sub 2}Al{sub 20} and CeM{sub 2}Al{sub 20} (M=V, Cr): A comparison of compounds adopting the CeCr{sub 2}Al{sub 20} structure type

    SciTech Connect (OSTI)

    Kangas, Michael J.; Schmitt, Devin C.; Sakai, Akito; Nakatsuji, Satoru; Institute of Solid State Physics, University of Tokyo, Kashiwa, Chiba 277-8581 ; Chan, Julia Y.

    2012-12-15

    Crystal growth and full structure determination of compounds adopting the CeCr{sub 2}Al{sub 20} structure type, LnTi{sub 2}Al{sub 20} (Ln=La-Pr, Sm, and Yb), LnV{sub 2}Al{sub 20} (Ln=La-Pr, and Sm), and LnCr{sub 2}Al{sub 20} (Ln=La-Pr, Sm, and Yb), are reported. Resistivity, magnetic susceptibility, and heat capacity of flux grown single crystals of the nonmagnetic CeM{sub 2}Al{sub 20} (Ln=Ce, Yb; M=Ti, V) compounds are compared to PrCr{sub 2}Al{sub 20}. Of particular interest is PrCr{sub 2}Al{sub 20} which does not show any phase transition down to the lowest temperature of the measurement (400 mK in resistivity measurement and 1.8 K for magnetic susceptibility measurements) and exhibits Kondo behavior at low temperatures. - Graphical abstract: Crystal structure of SmV{sub 2}Al{sub 20} showing the interpenetrating diamond-like samarium network and pyrochlore-like vanadium network. Highlights: Black-Right-Pointing-Pointer Single crystals of LnM{sub 2}Al{sub 20} were grown from a molten aluminum flux. Black-Right-Pointing-Pointer Magnetic, electrical, and specific heat of single crystal LnM{sub 2}Al{sub 20} are presented. Black-Right-Pointing-Pointer PrCr{sub 2}Al{sub 20} exhibits evidence of Kondo effect.

  18. Corrosion and Stress Corrosion Cracking of High Cr Ferritic-Martensitic Steels in Supercritical Water

    SciTech Connect (OSTI)

    Jinsung, Jang; Seong Sik, Hwang; Chang Hee, Han; Byung Hak, Lee

    2006-07-01

    Corrosion behavior of the F-M (ferritic-martensitic) steels (T91, T92, T122) and Fe-base ODS (oxide dispersion strengthened) alloy (MA956{sup TM}) were evaluated in an aerated (8 ppm D.O.) SCW (supercritical water) at the temperature range between 300 and 627 deg C under 25 MPa. In aerated SCW the weight change of the F-M steel specimens became greater as the test temperature increased. However, the extent of the weight change at 350 deg C, just below the critical temperature appeared not to be less than those at 550 deg C. And the weight changes of all the F-M steel specimens in the deaerated SCW (for 347 hrs in 100 ppb D.O. for 347 hrs, and in 10 ppb D.O. for 432 hrs) tended to converge to about 1 mgcm{sup -2}. In aerated or deaerated conditions 20Cr Fe-base ODS alloy appeared to be very resistant to a SCW corrosion at all the test temperatures up to 500 hrs. Stress corrosion cracking (SCC) behavior of 9Cr F-M steels (T91 and T92) was investigated by CERT (Constant Extension Rate Test) in SCW at various temperatures and D.O. levels with different strain rates. T91 did not show any evidence of a SCC in a fully deaerated (below 10 ppb D.O.) SCW at 500, 550, and 600 deg C at the test conditions. T92 specimens were tested at 500 deg C in SCW with different D.O. levels. The strain rate did not seem to affect the SCC behavior of the T92 steel, but D.O. in SCW seems to affect the SCC behavior to some extent. The total elongation of T92 in SCW of 100 ppb or of 500 ppb D.O. was significantly smaller than that at a fully deaerated (below 10 ppb D.O.) SCW (about 15 vs. 20%), and it appears to provide a clue to a SCC on the fracture surface after the CERT test. (authors)

  19. Microstructural evolution during solution treatment of Co-Cr-Mo-C biocompatible alloys

    SciTech Connect (OSTI)

    Giacchi, J.V.; Fornaro, O.; Palacio, H.

    2012-06-15

    Three different Co-Cr-Mo-C alloys conforming to ASTM F75 standard were poured in an industrial environment and subjected to a conventional solution treatment at 1225 Degree-Sign C for several time intervals. The microstructural changes and transformations were studied in each case in order to evaluate the way in which treatment time influences the secondary phase fraction and clarify the microstructural changes that could occur. To assess how treatment time affects microstructure, optical microscopy and image analyzer software, scanning electron microscopy and energy dispersion spectrometry analysis were employed. The main phases detected in the as-cast state were: {sigma}-phase, M{sub 6}C, and M{sub 23}C{sub 6} carbides. The latter presented two different morphologies, blocky type and lamellar type. Despite being considered the most detrimental feature to mechanical properties, {sigma}-phase and lamellar carbides dissolution took place in the early stages of solution treatment. M{sub 23}C{sub 6} carbides featured two different behaviors. In the alloy obtained by melting an appropriate quantity of alloyed commercial materials, a decrease in size, spheroidization and transformation into M{sub 6}C carbides were simultaneously observed. In the commercial ASTM F75 alloy, in turn, despite being the same phase, only a marked decrease in precipitates size was noticed. These different behaviors could be ascribed to the initial presence of other phases in the alloy obtained from alloyed materials, such as {sigma}-phase and 'pearlitic' carbides, or to the initial precipitate size which was much larger in the first than in the commercial ASTM F75 alloy studied. M{sub 6}C carbides dissolved directly in the matrix as they could not be detected in samples solution-treated for 15 min. - Highlights: Black-Right-Pointing-Pointer Three different Co-Cr-Mo alloys were poured under an industrial environment. Black-Right-Pointing-Pointer Transformation of existing phases followed during conventional solution treatment. Black-Right-Pointing-Pointer In as-cast/treated samples, phases were identified by color metallography, SEM and EDS. Black-Right-Pointing-Pointer M{sub 23}C{sub 6} {yields} M{sub 6}C transformation was corroborated by SEM and EDS analysis. Black-Right-Pointing-Pointer Carbide spheroidization was also detected prior a noticeably carbide size decreasing.

  20. Investigation of structural changes in chiral magnet Cr{sub 1?3}NbS{sub 2} under application of pressure

    SciTech Connect (OSTI)

    Mito, M. Tsuruta, K.; Deguchi, H.; Tajiri, T.; Kishine, J.; Inoue, K.; Kousaka, Y.; Nakao, Y.; Akimitsu, J.

    2015-05-14

    We perform structural analysis experiments on the chiral magnet Cr{sub 1?3}NbS{sub 2}, in which Cr{sup 3+} ions are inserted between hexagonal NbS{sub 2} layers. The noncentrosymmetrical nature of the inserted Cr{sup 3+} appears as a distorted CrS{sub 6} octahedron. Under the application of hydrostatic pressure, the lattice shrinks significantly along the c-axis rather than the a-axis. However, at a pressure P of approximately 34?GPa, a kink in the rate of decrease in the lattice parameters is observed, and the slight movement of a Nb atom along the c-axis brings about a decrease in the distortion of the CrS{sub 6} octahedron. This structural change qualitatively suggests a decrease in the strength of the Dzyaloshinskii-Moriya (D-M) interaction. Under hydrostatic pressure, the magnetic ordering temperature T{sub C} decreases, and dT{sub C}/dP exhibits a slight change at around 3?GPa. A series of experiments indicates that the change in the structural symmetry of the CrS{sub 6} octahedron influences the exchange network between Cr{sup 3+} ions as well as the D-M interaction.

  1. Synthesis and Luminescence Characteristics of Cr3+ doped Y3Al5O12 Phosphors

    SciTech Connect (OSTI)

    Smith, Brenda A.; Dabestani, Reza T.; Lewis, Linda A.; Thompson, Cyril V.; Collins, Case T.; Aytug, Tolga

    2015-10-01

    Luminescence performance of yttrium aluminum garnet (Y3Al5O12) phosphors as a function of Cr3+ concentration has been investigated via two different wet-chemical synthesis techniques, direct- (DP) and hydrothermal-precipitation (HP). Using either of these methods, the red-emitting phosphor [Y3Al5-xCrxO12 (YAG: Cr3+)] showed similar photoluminescence (PL) intensities once the dopant concentration was optimized. Specifically, the YAG: Cr3+ PL emission intensity reached a maximum at Cr3+ concentrations of x = 0.02 (0.4 at.%) and x = 0.13 (2.6 at.%) for DP and HP processed samples, respectively. The results indicated the strong influence of the processing method on the optimized YAG: Cr3+ performance, where a more effective energy transfer rate between a pair of Cr3+ activators at low concentration levels was observed by using the DP synthesis technique. Development of a highly efficient phosphor, using a facile synthesis approach, could significantly benefit consumer and industrial applications by improving the operational efficiency of a wide range of practical devices.

  2. Impact of x-ray dose on the response of CR-39 to 1–5.5 MeV alphas

    SciTech Connect (OSTI)

    Rojas-Herrera, J. Rinderknecht, H. G.; Zylstra, A. B.; Gatu Johnson, M.; Orozco, D.; Rosenberg, M. J.; Sio, H.; Seguin, F. H.; Frenje, J. A.; Li, C. K.; Petrasso, R. D.

    2015-03-15

    The CR-39 nuclear track detector is used in many nuclear diagnostics fielded at inertial confinement fusion (ICF) facilities. Large x-ray fluences generated by ICF experiments may impact the CR-39 response to incident charged particles. To determine the impact of x-ray exposure on the CR-39 response to alpha particles, a thick-target bremsstrahlung x-ray generator was used to expose CR-39 to various doses of 8 keV Cu-K{sub α} and K{sub β} x-rays. The CR-39 detectors were then exposed to 1–5.5 MeV alphas from an Am-241 source. The regions of the CR-39 exposed to x-rays showed a smaller track diameter than those not exposed to x-rays: for example, a dose of 3.0 ± 0.1 Gy causes a decrease of (19 ± 2)% in the track diameter of a 5.5 MeV alpha particle, while a dose of 60.0 ± 1.3 Gy results in a decrease of (45 ± 5)% in the track diameter. The reduced track diameters were found to be predominantly caused by a comparable reduction in the bulk etch rate of the CR-39 with x-ray dose. A residual effect depending on alpha particle energy is characterized using an empirical formula.

  3. Synthesis and mechanical properties of CrMoC{sub x}N{sub 1-x} coatings deposited by a hybrid coating system

    SciTech Connect (OSTI)

    Yun, Ji Hwan; Heo, Su Jeong; Kim, Kwang Ryul; Kim, Kwang Ho

    2008-01-15

    Quaternary CrMoC{sub x}N{sub 1-x} coatings were deposited on steel substrates (AISI D2) and Si wafers by a hybrid coating system combining an arc-ion plating technique and a dc reactive magnetron sputtering technique using Cr and Mo targets in an Ar/N{sub 2}/CH{sub 4} gaseous mixture. The carbon content of CrMoC{sub x}N{sub 1-x} coatings was linearly increased with increasing CH{sub 4}/(CH{sub 4}+N{sub 2}) gas flow rate ratio. The maximum hardness of 44 GPa was obtained from the CrMoC{sub x}N{sub 1-x} coatings containing a carbon content of x=0.33 with a residual stress of -4.4 GPa. The average friction coefficient of Cr-Mo-N coatings was 0.42, and it is decreased to 0.31 after applying CrMoC{sub x}N{sub 1-x} coatings. This result was caused by the formation of a carbon-rich transfer layer that acted as a solid lubricant to reduce contact between the coating surface and steel ball. The microstructure of the coatings was investigated by x-ray diffraction, scanning electron microscopy, and x-ray photoelectron spectroscopy. In this work, the microstructure and mechanical properties of the CrMoC{sub x}N{sub 1-x} coatings were systematically investigated with the instrumental analyses.

  4. Impact of x-ray dose on the response of CR-39 to 1–5.5 MeV alphas

    SciTech Connect (OSTI)

    Rojas-Herrera, J.; Rinderknecht, H. G.; Zylstra, A. B.; Gatu Johnson, M.; Orozco, D.; Rosenberg, M. J.; Sio, H.; Seguin, F. H.; Frenje, J. A.; Li, C. K.; Petrasso, R. D.

    2015-03-01

    The CR-39 nuclear track detector is used in many nuclear diagnostics fielded at inertial confinement fusion (ICF) facilities. Large x-ray uences generated by ICF experiments may impact the CR-39 response to incident charged particles. To determine the impact of x-ray exposure on the CR-39 response to alpha particles, a thick-target bremsstrahlung x-ray generator was used to expose CR-39 to various doses of 8 keV Cu-Kα and Kβ x-rays. The CR-39 detectors were then exposed to 1-5.5 MeV alphas from an Am-241 source. The regions of the CR-39 exposed to x-rays showed a smaller track diameter than those not exposed to x-rays: for example, a dose of 3.0 ± 0.1 Gy causes a decrease of (19 ± 2)% in the track diameter of a 5.5 MeV alpha particle, while a dose of 60.0 ± 1.3 Gy results in a decrease of (45 ± 5)% in the track diameter. The reduced track diameters were found to be predominantly caused by a comparable reduction in the bulk etch rate of the CR-39 with x-ray dose. A residual effect depending on alpha particle energy is characterized using an empirical formula.

  5. Impact of x-ray dose on the response of CR-39 to 1–5.5 MeV alphas

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Rojas-Herrera, J.; Rinderknecht, H. G.; Zylstra, A. B.; Gatu Johnson, M.; Orozco, D.; Rosenberg, M. J.; Sio, H.; Seguin, F. H.; Frenje, J. A.; Li, C. K.; et al

    2015-03-01

    The CR-39 nuclear track detector is used in many nuclear diagnostics fielded at inertial confinement fusion (ICF) facilities. Large x-ray uences generated by ICF experiments may impact the CR-39 response to incident charged particles. To determine the impact of x-ray exposure on the CR-39 response to alpha particles, a thick-target bremsstrahlung x-ray generator was used to expose CR-39 to various doses of 8 keV Cu-Kα and Kβ x-rays. The CR-39 detectors were then exposed to 1-5.5 MeV alphas from an Am-241 source. The regions of the CR-39 exposed to x-rays showed a smaller track diameter than those not exposed tomore » x-rays: for example, a dose of 3.0 ± 0.1 Gy causes a decrease of (19 ± 2)% in the track diameter of a 5.5 MeV alpha particle, while a dose of 60.0 ± 1.3 Gy results in a decrease of (45 ± 5)% in the track diameter. The reduced track diameters were found to be predominantly caused by a comparable reduction in the bulk etch rate of the CR-39 with x-ray dose. A residual effect depending on alpha particle energy is characterized using an empirical formula.« less

  6. Impact of x-ray dose on the response of CR-39 to 15.5 MeV alphas

    SciTech Connect (OSTI)

    Rojas-Herrera, J.; Rinderknecht, H. G.; Zylstra, A. B.; Gatu Johnson, M.; Orozco, D.; Rosenberg, M. J.; Sio, H.; Seguin, F. H.; Frenje, J. A.; Li, C. K.; Petrasso, R. D.

    2015-03-01

    The CR-39 nuclear track detector is used in many nuclear diagnostics #12;fielded at inertial con#12;nement fusion (ICF) facilities. Large x-ray uences generated by ICF experiments may impact the CR-39 response to incident charged particles. To determine the impact of x-ray exposure on the CR-39 response to alpha particles, a thick-target bremsstrahlung x-ray generator was used to expose CR-39 to various doses of 8 keV Cu-K?#11; and K#12;? x-rays. The CR-39 detectors were then exposed to 1-5.5 MeV alphas from an Am-241 source. The regions of the CR-39 exposed to x-rays showed a smaller track diameter than those not exposed to x-rays: for example, a dose of 3.0#6; 0.1 Gy causes a decrease of (19 #6;2)% in the track diameter of a 5.5 MeV alpha particle, while a dose of 60.0 #6;1.3 Gy results in a decrease of (45 #6;5)% in the track diameter. The reduced track diameters were found to be predominantly caused by a comparable reduction in the bulk etch rate of the CR-39 with x-ray dose. A residual eff#11;ect depending on alpha particle energy is characterized using an empirical formula.

  7. Formation of less-known structurally complex ?{sub b} and orthorhombic quasicrystalline approximant ?{sub n} on solidification of selected AlPdCr alloys

    SciTech Connect (OSTI)

    Adamech, M.; ?erni?kov, I.; ?urika, L.; Kolesr, V.; Drienovsk, M.; Bednar?k, J.; Svoboda, M.; Janovec, J.

    2014-11-15

    The evolution of phases was investigated on cooling of Al{sub 71}Pd{sub 24}Cr{sub 5}, Al{sub 73}Pd{sub 20}Cr{sub 7}, and Al{sub 73}Pd{sub 23}Cr{sub 4} alloys from 1350 C down to ambient temperature with the rate of 10 Cmin{sup ?1}. To perform the investigation, differential thermal analysis, synchrotron X-ray powder diffraction, and scanning electron microscopy coupled with energy-dispersive X-ray spectroscopy were used. In all the investigated alloys structurally complex phases ?{sub n} (?{sub 6} + ?{sub 28}) and ?{sub b}, as well as the ?-phase were identified. Based on the results of differential thermal analysis, sequences of phase transformations were determined. The Al{sub 71}Pd{sub 24}Cr{sub 5} alloy started to solidify at 1031.4 C through ?. Primary dendrites of ?{sub b} were observed in Al{sub 73}Pd{sub 20}Cr{sub 7} and Al{sub 73}Pd{sub 23}Cr{sub 4} alloys. In the second step of solidification ? and/or ?{sub b} were formed. The peritectic reaction, liquid + ?{sub b} + ? ? ?{sub n} + ?{sub b} + ?, leading to the formation of the quasicrystalline approximant ?{sub n} (?{sub 6} + ?{sub 28}) took place in the final step of solidification at approximately 792 C. - Highlights: Structurally complex ?{sub n} (?{sub 6} + ?{sub 28}), ?{sub b} and ?-phases were identified. The Al{sub 71}Pd{sub 24}Cr{sub 5} alloy started to solidify at 1031.4 C through the primary ? phase. The Al{sub 73}Pd{sub 20}Cr{sub 7} and Al{sub 73}Pd{sub 23}Cr{sub 4} alloys solidified in the same way. The quasicrystalline approximant ?{sub n} (?{sub 6} + ?{sub 28}) was formed at approximately 792 C.

  8. High-temperature phase transformation in Cr added TiAl base alloy

    SciTech Connect (OSTI)

    Abe, E.; Niinobe, K.; Nobuki, M.; Nakamura, M.; Tsujimoto, T.

    1999-07-01

    The authors have investigated a microstructure evolution of a Ti-48Al-3.5Cr (in at.%) alloy at high-temperatures ({gt} 1,473K). In the alloy annealed at 1673K for 1.8ks, followed by air-cooling, a characteristic microstructure with a feathery fashion was uniformly formed. From a cooling-rate-controlling study, it was found that formation of the feathery structure is accomplished during continuous cooling from 1673K to 1573K, within the {alpha} + {gamma} two-phase region. Transmission electron microscopy revealed that the feathery structure is composed of lamellar colonies (5--10{micro}m) which are crystallographically tilted slightly (a few degree) with their neighbors. A surprising fact is that lamellae in each colony are mostly the {gamma} phase with few {alpha}{sub 2} phase less than 5% in volume. This suggests that the feathery structure is a metastable product and has not resulted from the {alpha} {r{underscore}arrow} {alpha} + {gamma} transformation above 1,573 K. Instead, the feathery structure formation should be attributed to the non-equilibrium {alpha} {r{underscore}arrow} {gamma} transformation which occurs at high-temperatures with a small degree of supercooling. The authors discuss this interesting phase transformation in terms of the {alpha} {r{underscore}arrow} {gamma} massive transformation, based on the continuous-cooling-transformation (CCT) diagram constructed for the present alloy.

  9. Study on the influence of CR-39 detector size on radon progeny detection in indoor environments

    SciTech Connect (OSTI)

    Pereira, L. A.; Hadler, J. C.; Lixandro F, A. L.; Guedes, S.; Takizawa, R. H.

    2014-11-11

    It is well known that radon daughters up to {sup 214}Po are the real contaminants to be considered in case of indoor radon contamination. Assemblies consisting of 6 circular bare sheets of CR-39, a nuclear track detector, with radius varying from 0.15 to 1.2 cm were exposed far from any material surface for periods of approximately 6 months in 13 different indoor rooms (7 workplaces and 6 dwellings), where ventilation was moderate or poor. It was observed that track density was as greater as smaller was the detector radius. Track density data were fitted using an equation deduced based on the assumption that the behavior of radon and its progeny in the air was described by Fick's Law, i.e., when the main mechanism of transport of radon progeny in the air is diffusion. As many people spend great part of their time in closed or poorly ventilated environments, the confirmation they present equilibrium between radon and its progeny is an interesting start for dosimetric calculations concerning this contamination.

  10. Preliminary Results on FeCrAl Alloys in the As-received and Welded State Designed to Have Enhanced Weldability and Radiation Tolerance

    SciTech Connect (OSTI)

    Field, Kevin G.; Gussev, Maxim N.; Hu, Xunxiang; Yamamoto, Yukinori

    2015-09-30

    The present report summarizes and discusses the recent results on developing a modern, nuclear grade FeCrAl alloy designed to have enhanced radiation tolerance and weldability. The alloys used for these investigations are modern FeCrAl alloys based on a Fe-13Cr-5Al-2Mo-0.2Si-0.05Y alloy (in wt.%, designated C35M). Development efforts have focused on assessing the influence of chemistry and microstructure on the fabricability and performance of these newly developed alloys. Specific focus was made to assess the weldability, thermal stability, and radiation tolerance.

  11. Nature of =~SiOCrO(2)CI And (=~SiO)(2)CrO(2) Sites Prepared By Grafting CrO(2)CI(2) Onto Silica

    SciTech Connect (OSTI)

    Demmelmaier, C.A.; White, R.E.; Bokhoven, J.A.van; Scott, S.L.

    2009-05-14

    The room-temperature reaction between chromyl chloride and Sylopol 952 silicas pretreated at 200, 450, and 800 C was investigated using IR, XANES, and EXAFS spectroscopy, as well as by DFT modeling. On the silicas pretreated at 200 and 450 C, the structurally uniform sites formed by the reaction with one surface hydroxyl group are described as {triple_bond}SiOCrO{sub 2}Cl. Unreacted silanols persist on these silicas even in the presence of excess CrO{sub 2}Cl{sub 2}, and on the silica pretreated at 200 C some participate in hydrogen bonding with the grafted monochlorochromate sites. On the silica pretreated at 800 C, both {triple_bond}SiOCrO{sub 2}Cl and ({triple_bond}SiO){sub 2}CrO{sub 2} sites are formed. The latter are produced despite the absence of hydrogen-bonded hydroxyl pairs on the support. The origin of the chromate sites is proposed to be the reaction between CrO{sub 2}Cl{sub 2} and hydroxyl-substituted siloxane 2-rings. These rings are likely formed at 800 C by condensation between a pair of vicinal silanols in which one of the silanols is also a member of a geminal pair.

  12. Location of gap nodes in the organic superconductors {kappa}-(ET){sub 2}Cu(NCS){sub 2} and {kappa}-(ET){sub 2}Cu[N(CN){sub 2}Br determined by magnetocalorimetry.

    SciTech Connect (OSTI)

    Malone, L.; Taylor, O. J.; Schlueter, J. A.; Carrington, A.; Materials Science Division; Univ. Bristol

    2010-07-16

    We report specific-heat measurements of the organic superconductors {kappa}-(ET){sub 2}Cu(NCS){sub 2} and {kappa}-(ET){sub 2}Cu[N(CN){sub 2}]Br. When the magnetic field is rotated in the highly conducting planes at low temperature (T = 0.4 K), we observe clear oscillations of specific heat which have a strong fourfold component. The observed strong field and temperature dependence of this fourfold component identifies it as originating from nodes in the superconducting energy gap which point along the in-plane crystal axes (d{sub xy} symmetry).

  13. Photocatalytic H{sub 2} production from spinels ZnGa{sub 2−x}Cr{sub x}O{sub 4} (0≤x≤2) solid solutions

    SciTech Connect (OSTI)

    Xu, Xiaoxiang; Xie, Yinghao; Ni, Shuang; Azad, Abul K.; Cao, Tongcheng

    2015-10-15

    Solid solutions of ZnGa{sub 2−x}Cr{sub x}O{sub 4} (0≤x≤2) were successfully prepared by solid state reactions. Introducing Cr into ZnGa{sub 2}O{sub 4} crystal structure significantly improves its light absorption and greatly enhances its photocatalytic activity. An optimized Cr content (x=1.5 for ZnGa{sub 0.5}Cr{sub 1.5}O{sub 4}) was found for the solid solutions with the highest photocatalytic hydrogen production rate (~775 μmol/h). Compositional analysis suggests there is a strong enrichment of Cr at the surface of sample ZnGa{sub 0.5}Cr{sub 1.5}O{sub 4} compared with other samples. Theoretical calculations suggest their electronic structures involve spin-polarized conduction band (CB) and valence band (VB) that are mainly composed of Cr 3d orbitals. The highest photocatalytic activity observed in ZnGa{sub 0.5}Cr{sub 1.5}O{sub 4} is probably due to the higher Cr content at the surface that favors the Cr 3d orbital overlapping. - Graphical abstract: Electronic structure and density of states of ZnGa{sub 2}O{sub 4} after partially substituting Ga with Cr. - Highlights: • Complete solid solution can be formed between ZnGa{sub 2}O{sub 4} and ZnCr{sub 2}O{sub 4}. • Optical properties and catalytic activity are improved by adding Cr into ZnGa{sub 2}O{sub 4}. • An optimized Cr content exists for the highest activity. • Enrichment of Cr in the surface is beneficial for a better performance.

  14. Formation of a regular domain structure in TGS–TGS + Cr crystals with a profile impurity distribution

    SciTech Connect (OSTI)

    Belugina, N. V. Gainutdinov, R. V.; Tolstikhina, A. L.; Ivanova, E. S.; Kashevich, I. F.; Shut, V. N.; Mozzharov, S. E.

    2015-07-15

    A complex investigation of TGS–TGS + Cr crystals with a profile impurity distribution of chromium ions Cr{sup 3+} has been carried out at the macrolevel (measurement of dielectric properties by the method of nematic liquid crystals) and microlevel (domain structure according to atomic force microscopy data). It is established that periodic doped layers are formed only in individual growth pyramids in the regions where the polarization vector has a nonzero component along the normal to the growth faces rather than throughout the entire crystal volume. The domain configuration at the boundary of growth layers with different impurity compositions has been studied by piezoelectric force microscopy. The static unipolarity of layers with and without chromium impurity is approximately identical, whereas the domain-wall density in doped regions is higher than that in undoped ones by a factor of about 7.

  15. Measurement of the {sup 208}Pb({sup 52}Cr,n){sup 259}Sg excitation function

    SciTech Connect (OSTI)

    Folden III, C. M.; Dragojevic, I.; Garcia, M. A.; Gates, J. M.; Nelson, S. L.; Hoffman, D. C.; Nitsche, H.; Duellmann, Ch. E.; Sudowe, R.; Gregorich, K. E.; Eichler, R.

    2009-02-15

    The excitation function for the {sup 208}Pb({sup 52}Cr,n){sup 259}Sg reaction has been measured using the Berkeley Gas-filled Separator at the Lawrence Berkeley National Laboratory 88-Inch Cyclotron. The maximum cross section of 320{sub -100}{sup +110} pb is observed at a center-of-target laboratory-frame energy of 253.0 MeV. In total, 25 decay chains originating from {sup 259}Sg were observed and the measured decay properties are in good agreement with previous reports. In addition, a partial excitation function for the {sup 208}Pb({sup 52}Cr,2n){sup 258}Sg reaction was obtained, and an improved {sup 258}Sg half-life of 2.6{sub -0.4}{sup +0.6} ms was calculated by combining all available experimental data.

  16. AN UNBIASED SPECTRAL LINE SURVEY TOWARD R CrA IRS7B IN THE 345 GHz WINDOW WITH ASTE

    SciTech Connect (OSTI)

    Watanabe, Yoshimasa; Sakai, Nami; Yamamoto, Satoshi; Lindberg, Johan E.; Bisschop, Suzanne E.; Jorgensen, Jes K.

    2012-02-01

    We have conducted a spectral line survey in the 332-364 GHz region with the Atacama Submillimeter Telescope Experiment 10 m telescope toward R CrA IRS7B, a low-mass protostar in the Class 0 or Class 0/I transitional stage. We have also performed some supplementary observations in the 450 GHz band. In total, 16 molecular species are identified in the 332-364 GHz region. Strong emission lines of CN and CCH are observed, whereas complex organic molecules and long carbon-chain molecules, which are characteristics of hot corino and warm carbon-chain chemistry (WCCC) source, respectively, are not detected. The rotation temperature of CH{sub 3}OH is evaluated to be 31 K, which is significantly lower than that reported for the prototypical hot corino IRAS 16293-2422 ({approx}85 K). The deuterium fractionation ratios for CCH and H{sub 2}CO are obtained to be 0.038 and 0.050, respectively, which are much lower than those in the hot corino. These results suggest a weak hot corino activity in R CrA IRS7B. On the other hand, the carbon-chain related molecules, CCH and c-C{sub 3}H{sub 2}, are found to be abundant. However, this source cannot be classified as a WCCC source, since long carbon-chain molecules are not detected. If WCCC and hot corino chemistry represent the two extremes in chemical compositions of low-mass Class 0 sources, R CrA IRS7B would be a source with a mixture of these two chemical characteristics. The UV radiation from the nearby Herbig Ae star R CrA may also affect the chemical composition. The present line survey demonstrates further chemical diversity in low-mass star-forming regions.

  17. Phase diagram and magnetocaloric effects in Ni{sub 50}Mn{sub 35}(In{sub 1?x}Cr{sub x}){sub 15} and (Mn{sub 1?x}Cr{sub x})NiGe{sub 1.05} alloys

    SciTech Connect (OSTI)

    Quetz, Abdiel Muchharla, Baleeswaraiah; Dubenko, Igor; Talapatra, Saikat; Ali, Naushad; Samanta, Tapas; Stadler, Shane

    2014-05-07

    The magnetocaloric and thermomagnetic properties of Ni{sub 50}Mn{sub 35}(In{sub 1?x}Cr{sub x}){sub 15} and (Mn{sub 1?x}Cr{sub x}) NiGe{sub 1.05} systems for 0???x???0.105 and 0???x???0.1, respectively, have been studied by x-ray diffraction, differential scanning calorimetry, and magnetization measurements. Partial substitution of Cr for Mn in (Mn{sub 1?x}Cr{sub x})NiGe{sub 1.05} results in a first order magnetostructural transition from a hexagonal paramagnetic to an orthorhombic paramagnetic phase near T{sub M}???380?K (for x?=?0.07). Partial substitution of Cr for In in Ni{sub 50}Mn{sub 35}(In{sub 1?x}Cr{sub x}){sub 15} shifts the magnetostructural transition to a higher temperature (T?=?T{sub M}???450?K) for x?=?0.1. Large magnetic entropy changes of ?S?=??12 (J/(kgK)) and ?S?=??11 (J/(kgK)), both for a magnetic field change of 5?T, were observed in the vicinity of T{sub M} for (Mn{sub 1?x}Cr{sub x})NiGe{sub 1.05} and Ni{sub 50}Mn{sub 35}(In{sub 1?x}Cr{sub x}){sub 15}, respectively.

  18. Synthesis of Cr-doped CaTiSiO{sub 5} ceramic pigments by spray drying

    SciTech Connect (OSTI)

    Lyubenova, T. Stoyanova Matteucci, F.; Costa, A.L.; Dondi, M.; Ocana, M.

    2009-04-02

    Cr-doped CaTiSiO{sub 5} was synthesized by spray drying and conventional ceramic method in order to assess its potential as ceramic pigment. The evolution of the phase composition with thermal treatment was investigated by X-ray powder diffraction (XRPD) and thermal analyses (DTA-TGA-EGA). Powder morphology and particle size distribution were analyzed by scanning electron microscopy (SEM) and laser diffraction, respectively. The color efficiency of pigments was evaluated by optical spectroscopy (UV-vis-NIR) and colorimetric analysis (CIE Lab). Results proved that spray drying is an efficient procedure to prepare highly reactive pigment precursors. The spray-dried powders consist of hollow spherical particles with aggregate size in the 1-10 {mu}m range, developing a brown coloration. Optical spectra reveal the occurrence of Cr(III) and Cr(IV), both responsible for the brown color of this pigment. The former occupies the octahedral site of titanite, in substitution of Ti(IV), while the latter is located at the tetrahedral site, where replaces Si(IV)

  19. Deformation Behavior of Laser Welds in High Temperature Oxidation Resistant Fe-Cr-Al Alloys for Fuel Cladding Applications

    SciTech Connect (OSTI)

    Field, Kevin G; Gussev, Maxim N; Yamamoto, Yukinori; Snead, Lance Lewis

    2014-11-01

    Ferritic-structured Fe-Cr-Al alloys are being developed and show promise as oxidation resistant accident tolerant light water reactor fuel cladding. This study focuses on investigating the weldability of three model alloys in a range of Fe-(13-17.5)Cr-(3-4.4)Al in weight percent with a minor addition of yttrium using laser-welding techniques. A detailed study on the mechanical performance of bead-on-plate welds has been carried out to determine the performance of welds as a function of alloy composition. Laser welding resulted in a defect free weld devoid of cracking or inclusions for all alloys studied. Results indicated a reduction in the yield strength within the fusion zone compared to the base metal. Yield strength reduction was found to be primarily constrained to the fusion zone due to grain coarsening with a less severe reduction in the heat affected zone. No significant correlation was found between the deformation behavior/mechanical performance of welds and the level of Cr or Al in the alloy ranges studied.

  20. Comparison of Crevice Corrosion of Fe-Based Amorphous Metal and Crystalline Ni-Cr-Mo Alloy

    SciTech Connect (OSTI)

    Shan, X; Ha, H; Payer, J H

    2008-07-24

    The crevice corrosion behaviors of an Fe-based bulk metallic glass alloy (SAM1651) and a Ni-Cr-Mo crystalline alloy (C-22) were studied in 4M NaCl at 100 C with cyclic potentiodynamic polarization and constant potential tests. The corrosion damage morphologies, corrosion products and the compositions of corroded surfaces of these two alloys were studied with optical 3D reconstruction, Scanning Electron Microscopy (SEM), Energy Dispersive Spectroscopy (EDS) and Auger Electron Spectroscopy (AES). It was found that the Fe-based bulk metallic glass (amorphous alloy) SAM1651 had a more positive breakdown potential and repassivation potential than crystalline alloy C-22 in cyclic potentiodynamic polarization tests and required a more positive oxidizing potential to initiate crevice corrosion in constant potential test. Once crevice corrosion initiated, the corrosion propagation of C-22 was more localized near the crevice border compared to SAM1651, and SAM1651 repassivated more readily than C-22. The EDS results indicated that the corrosion products of both alloys contained high amount of O and were enriched in Mo and Cr. The AES results indicated that a Cr-rich oxide passive film was formed on the surfaces of both alloys, and both alloys were corroded congruently.

  1. Properties of molecular beam epitaxy grown Eu{sub x}(transition metal){sub y} films (transition metals: Mn, Cr)

    SciTech Connect (OSTI)

    Balin, K.; Nowak, A.; Gibaud, A.; Szade, J.; Celinski, Z.

    2011-04-01

    The electronic and crystallographic structures, as well as the magnetic properties, of Eu{sub x}(transition metal){sub y} (transition metals: Mn, Cr) thin films grown by molecular beam epitaxy were studied. Relative changes of the Eu/Mn and Eu/Cr ratios derived from the XPS lines, as well as x-ray reflectivity, indicate mixing of the Eu/Mn and Eu/Cr layers. Valency transitions from Eu{sup 2+} to Eu{sup 3+} were observed in both systems for most studied stoichiometries. A transition to a magnetically ordered phase was observed at 15 K, 40 K, and 62 K for selected films in the Eu-Mn system, and at 50 K for the film with a Eu/Cr ratio of 0.5.

  2. Laser welding and post weld treatment of modified 9Cr-1MoVNb steel.

    SciTech Connect (OSTI)

    Xu, Z.

    2012-04-03

    Laser welding and post weld laser treatment of modified 9Cr-1MoVNb steels (Grade P91) were performed in this preliminary study to investigate the feasibility of using laser welding process as a potential alternative to arc welding methods for solving the Type IV cracking problem in P91 steel welds. The mechanical and metallurgical testing of the pulsed Nd:YAG laser-welded samples shows the following conclusions: (1) both bead-on-plate and circumferential butt welds made by a pulsed Nd:YAG laser show good welds that are free of microcracks and porosity. The narrow heat affected zone has a homogeneous grain structure without conventional soft hardness zone where the Type IV cracking occurs in conventional arc welds. (2) The laser weld tests also show that the same laser welder has the potential to be used as a multi-function tool for weld surface remelting, glazing or post weld tempering to reduce the weld surface defects and to increase the cracking resistance and toughness of the welds. (3) The Vicker hardness of laser welds in the weld and heat affected zone was 420-500 HV with peak hardness in the HAZ compared to 240 HV of base metal. Post weld laser treatment was able to slightly reduce the peak hardness and smooth the hardness profile, but failed to bring the hardness down to below 300 HV due to insufficient time at temperature and too fast cooling rate after the time. Though optimal hardness of weld made by laser is to be determined for best weld strength, methods to achieve the post weld laser treatment temperature, time at the temperature and slow cooling rate need to be developed. (4) Mechanical testing of the laser weld and post weld laser treated samples need to be performed to evaluate the effects of laser post treatments such as surface remelting, glazing, re-hardening, or tempering on the strength of the welds.

  3. Effect of externally applied pressure on the magnetic behavior of Cu{sub 2}Te{sub 2}O{sub 5}(Br{sub x}Cl{sub 1-x}){sub 2}

    SciTech Connect (OSTI)

    Crowe, S. J.; Lees, M. R.; Paul, D. M. K.; Bewely, R. I.; Taylor, J.; McIntyre, G.; Zaharko, O.; Berger, H.

    2006-04-01

    The effect of externally applied pressure on the magnetic behavior of Cu{sub 2}Te{sub 2}O{sub 5}(Br{sub x}Cl{sub 1-x}){sub 2} with x=0, 0.73, and 1, is investigated by a combination of magnetic susceptibility, neutron diffraction, and neutron inelastic scattering measurements. The magnetic transition temperatures of the x=0 and 0.73 compositions are observed to increase linearly with increasing pressure at a rate of 0.23(2) and 0.04(1) K/kbar, respectively. However, the bromide shows contrasting behavior with a large suppression of the transition temperature under pressure, at a rate of -0.95(9) K/kbar. In neutron inelastic scattering measurements of Cu{sub 2}Te{sub 2}O{sub 5}Br{sub 2} under pressure only a small change to the ambient pressure magnetic excitations were observed. A peak in the density of states was seen to shift from {approx}5 meV in ambient pressure to {approx}6 meV under an applied pressure of 11.3 kbar, which was associated with an increase in the overall magnetic coupling strength.

  4. Spectral indices measurements using miniature fission chambers at the MINERVE zero-power reactor at CEA using calibration data obtained at the BR1 reactor at SCK.CEN

    SciTech Connect (OSTI)

    De lanaute, N. Blanc; Mellier, F.; Lyoussi, A.; Domergue, C.; Di Salvo, J. [CEA, DEN, DER, SPEX, F-13108 St Paul Les Durance, (France); Borms, L.; Wagemans, J. [CEN SCK, Belgian Nucl Res Ctr, B-2400 Mol, (Belgium)

    2012-08-15

    Spectral indices measurements performed in 2004 at the CEA MINERVE facility loaded with the R-UO{sub 2} lattice, using calibration data acquired at the SCK center dot CEN BR1 facility in 2001, resulted in ambivalent conclusions. On one hand, spectral indices involving only fissile isotopes gave consistent discrepancies between calculation and experiment. On the other hand, spectral indices involving both fissile and fertile isotopes, in particular the {sup 238}U(n, f)/{sup 235}U(n, f) spectral index, showed inconsistent results depending on the type of calibration data used. For different reasons, no definitive explanation was given at that time. In 2009, the preparation of the AMMON program at the EOLE facility motivated the manufacturing of a new set of detectors. At the same time, the re-installation of the R1-UO{sub 2} lattice in MINERVE provided the opportunity to carry out again a spectral indices measurement campaign. Nevertheless, although the isotopic compositions of active deposits were better known than previously, the comparison between experimental results and calculations still lead to inconsistent discrepancies. In April 2010, a new calibration series conducted again at the BR1 facility allowed the CEA to reanalyze the spectral indices measurements performed in 2009. With these very latest calibration data, experimental values of spectral indices finally matched calculations within the uncertainty margins. This paper also sums up the work that has been achieved to explain the incoherencies observed in 2004. (authors)

  5. Collapse of the low temperature insulating state in Cr-doped V{sub 2}O{sub 3} thin films

    SciTech Connect (OSTI)

    Homm, P. Dillemans, L.; Menghini, M.; Van Bilzen, B.; Bakalov, P.; Su, C.-Y.; Lieten, R.; Houssa, M.; Locquet, J.-P.; Nasr Esfahani, D.; Covaci, L.; Peeters, F. M.; Seo, J. W.

    2015-09-14

    We have grown epitaxial Cr-doped V{sub 2}O{sub 3} thin films with Cr concentrations between 0% and 20% on (0001)-Al{sub 2}O{sub 3} by oxygen-assisted molecular beam epitaxy. For the highly doped samples (>3%), a regular and monotonous increase of the resistance with decreasing temperature is measured. Strikingly, in the low doping samples (between 1% and 3%), a collapse of the insulating state is observed with a reduction of the low temperature resistivity by up to 5 orders of magnitude. A vacuum annealing at high temperature of the films recovers the low temperature insulating state for doping levels below 3% and increases the room temperature resistivity towards the values of Cr-doped V{sub 2}O{sub 3} single crystals. It is well-know that oxygen excess stabilizes a metallic state in V{sub 2}O{sub 3} single crystals. Hence, we propose that Cr doping promotes oxygen excess in our films during deposition, leading to the collapse of the low temperature insulating state at low Cr concentrations. These results suggest that slightly Cr-doped V{sub 2}O{sub 3} films can be interesting candidates for field effect devices.

  6. AREVA NP Cr{sub 2}O{sub 3}-doped fuel development for BWRs

    SciTech Connect (OSTI)

    Delafoy, C.; Dewes, P.; Miles, T.

    2007-07-01

    The search for improvements in nuclear fuel cycle economics results in increasing demands for fuel discharged burnup and reliability, plant maneuverability and power up-rating. To achieve these objectives without any reduction of safety margins, fuel design and materials that enable enhanced performance capabilities have been developed or are under investigations. Research on fuel pellets focuses on the modification of the microstructure to increase fission product retention and pellet mechanical compliance. Currently, production of the desired large grain viscoplastic UO{sub 2} fuel microstructures has been extensively investigated by AREVA NP through the use of doping elements. This track is nowadays a worldwide working field. In this area, AREVA NP has launched the development of a new UO{sub 2} fuel pellet obtained by optimum chromium oxide doping. The purpose of this paper is first to present the current results with the AREVA NP optimized chromia doped fuel and to discuss the key advantages in terms of fuel performance for BWR applications. In particular, the development relies on ramp testing results, fuel temperature and fission gas release values acquired at high burnup and high power levels. Second, the paper focuses on the qualification process implemented by AREVA NP to assess the margins of the optimized Cr{sub 2}O{sub 3}-doped UO{sub 2} fuel towards safety criteria at high burnup and the risk of PCI failure, as well as to develop calculation tools to support design. The driving force in this qualification plan is to gain the accurate knowledge of the optimized doped fuel behavior under normal, transient and anticipated accident conditions. To support this effort, irradiation campaigns are under progress in PWR and BWR plants to cover a wide range of existing operating conditions and to anticipate future demands. Considering only the BWR part, the program has successfully run since 2005 and is designed to obtain data up to high burnup, at least 70 GWd/tU. The aim is to define the range of operational conditions for application of chromia-doped fuel in combination with LTP2 non-liner cladding as an alternative to the present standard Fe-enhanced Zr liner cladding. (authors)

  7. Solid-state synthesis, structure and properties of a novel open-framework cadmium selenite bromide: [Cd{sub 10}(SeO{sub 3}){sub 8}Br{sub 4}]·HBr·H{sub 2}O

    SciTech Connect (OSTI)

    Chen, Wen-Tong; Wang, Ming-Sheng; Wang, Guan-E; Chen, Hui-Fen; Guo, Guo-Cong

    2013-08-15

    A novel open-framework cadmium selenite bromide, [Cd{sub 10}(SeO{sub 3}){sub 8}Br{sub 4}]·HBr·H{sub 2}O (1), has been obtained by a solid-state reaction at 450 °C, and the structure has been determined by single-crystal X-ray diffraction analysis. Compound 1 crystallizes in Pbcm of the orthorhombic system: a=10.882(3), b=16.275(5), c=18.728(6) Å, V=3317(2) Å{sup 3}, R1/wR2=0.0411/0.0659. Compound 1 is characteristic of a novel 3-D open-framework structure, composing {sub ∞}{sup 2}[CdSeO{sub 3}] layers and the pillars of edge-shared CdO{sub 3}Br{sub 2} square pyramids. The lattice water molecules and the HBr molecules locate in the voids of the framework. Optical absorption spectrum of 1 reveals the presence of an optical gap of 1.65 eV. Solid-state photoluminescent study indicates that compound 1 exhibits strong violet emission. TG–DSC measurement shows that compound 1 is thermally stable up to 200 °C. - Graphical abstract: A metal selenite halide has been synthesized and features a 3-D open-framework structure, composing edge-shared CdO{sub 8} decahedra and pillars of edge-sharing pentahedra. UV–vis, TG–DSC and luminescent measurements are also reported. Highlights: • This paper reports a novel cadmium selenite bromide obtained by an intermediate-temperature solid-state reaction. • The title compound is characteristic of a novel 3-D open-framework structure, composing {sub ∞}{sup 2}[CdSeO{sub 3}] layers and the pillars of edge-shared CdO{sub 3}Br{sub 2} square pyramids. • The title compound is thermally stable up to 200 °C. • The title compound has an optical gap of 1.65 eV and exhibits strong violet emission.

  8. Negligible Magnetism in Excellent Structural Quality Cr[subscript x]Ti[subscript 1-x]O[subscript 2] Anatase: Contrast with High-T[subscript C] Ferromagnetism in Structurally Defective Cr[subscript x]Ti[subscript 1-x]O[subscript 2

    SciTech Connect (OSTI)

    Kaspar, T.C.; Heald, S.M.; Wang, C.M.; Bryan, J.D.; Droubay, T.; Shutthanandan, V.; Thevuthasan, S.; McCready, D.E.; Kellock, A.J.; Gamelin, D.R.; Chambers, S.A.

    2010-07-19

    We reexamine the mechanism of ferromagnetism in doped TiO{sub 2} anatase, using epitaxial Cr:TiO{sub 2} with excellent structural quality as a model system. In contrast to highly oriented but defective Cr:TiO{sub 2} ({approx}0.5{micro}{sub B}/Cr), these structurally superior single crystal films exhibit negligible ferromagnetism. Similar results were obtained for Co:TiO{sub 2}. We show for the first time that charge-compensating oxygen vacancies alone, as predicted by F-center mediated exchange, are not sufficient to activate ferromagnetism. Instead, the onset of ferromagnetism correlates with the presence of structural defects.

  9. Prediction and Monitoring Systems of Creep-Fracture Behavior of 9Cr-1Mo Steels for Teactor Pressure Vessels

    SciTech Connect (OSTI)

    Potirniche, Gabriel; Barlow, Fred D.; Charit, Indrajit; Rink, Karl

    2013-11-26

    A recent workshop on next-generation nuclear plant (NGNP) topics underscored the need for research studies on the creep fracture behavior of two materials under consideration for reactor pressure vessel (RPV) applications: 9Cr-1Mo and SA-5XX steels. This research project will provide a fundamental understanding of creep fracture behavior of modified 9Cr-1Mo steel welds for through modeling and experimentation and will recommend a design for an RPV structural health monitoring system. Following are the specific objectives of this research project: • Characterize metallurgical degradation in welded modified 9Cr-1Mo steel resulting from aging processes and creep service conditions. • Perform creep tests and characterize the mechanisms of creep fracture process. • Quantify how the microstructure degradation controls the creep strength of welded steel specimens. • Perform finite element (FE) simulations using polycrystal plasticity to understand how grain texture affects the creep fracture properties of welds. • Develop a microstructure-based creep fracture model to estimate RPVs service life . • Manufacture small, prototypic, cylindrical pressure vessels, subject them to degradation by aging, and measure their leak rates. • Simulate damage evolution in creep specimens by FE analyses. • Develop a model that correlates gas leak rates from welded pressure vessels with the amount of microstructural damage. • Perform large-scale FE simulations with a realistic microstructure to evaluate RPV performance at elevated temperatures and creep strength. • Develop a fracture model for the structural integrity of RPVs subjected to creep loads. • Develop a plan for a non-destructive structural health monitoring technique and damage detection device for RPVs.

  10. Simple bond-order-type interatomic potential for an intermixed Fe-Cr-C system of metallic and covalent bondings in heat-resistant ferritic steels

    SciTech Connect (OSTI)

    Kumagai, Tomohisa Nakamura, Kaoru; Yamada, Susumu; Ohnuma, Toshiharu

    2014-12-28

    It is known that M{sub 23}C{sub 6}(M?=?Cr/Fe) behavior in heat-resistant ferritic steels affects the strength of the material at high temperature. The ability to garner direct information regarding the atomic motion using classical molecular dynamics simulations is useful for investigating the M{sub 23}C{sub 6} behavior in heat-resistant ferritic steels. For such classical molecular dynamics calculations, a suitable interatomic potential is needed. To satisfy this requirement, an empirical bond-order-type interatomic potential for Fe-Cr-C systems was developed because the three main elements to simulate the M{sub 23}C{sub 6} behavior in heat-resistant ferritic steels are Fe, Cr, and C. The angular-dependent term, which applies only in non-metallic systems, was determined based on the similarity between a Finnis-Sinclair-type embedded-atom-method interatomic potential and a Tersoff-type bond-order potential. The potential parameters were determined such that the material properties of Fe-Cr-C systems were reproduced. These properties include the energy and lattice constants of 89 crystal structures; the elastic constants of four realistic precipitates; the bulk moduli of B1, B2, and B3 crystals; the surface energies of B1 and B2 crystals; and the defect-formation energies and atomic configurations of 66 Fe-Cr-C complexes. Most of these material properties were found to be reproduced by our proposed empirical bond-order potentials. The formation energies and lattice constants of randomly mixed Fe-Cr alloys calculated using the interatomic potentials were comparable to those obtained through experiments and first-principles calculations. Furthermore, the energies and structures of interfaces between Cr carbide and ?-Fe as predicted through first-principles calculations were well reproduced using these interatomic potentials.

  11. Electrical spin injection using GaCrN in a GaN based spin light emitting diode

    SciTech Connect (OSTI)

    Banerjee, D.; Ganguly, S.; Saha, D.; Adari, R.; Sankaranarayan, S.; Kumar, A.; Aldhaheri, R. W.; Hussain, M. A.; Balamesh, A. S.

    2013-12-09

    We have demonstrated electrical spin-injection from GaCrN dilute magnetic semiconductor (DMS) in a GaN-based spin light emitting diode (spin-LED). The remanent in-plane magnetization of the thin-film semiconducting ferromagnet has been used for introducing the spin polarized electrons into the non-magnetic InGaN quantum well. The output circular polarization obtained from the spin-LED closely follows the normalized in-plane magnetization curve of the DMS. A saturation circular polarization of ?2.5% is obtained at 200?K.

  12. Investigations of protons passing through the CR-39/PM-355 type of solid state nuclear track detectors

    SciTech Connect (OSTI)

    Malinowska, A.; Szyd?owski, A.; Jask?a, M.; Korman, A.; Kuk, M.; Sartowska, B.; Kuehn, T.

    2013-07-15

    Solid State Nuclear Track Detectors of the CR-39/PM-355 type were irradiated with protons with energies in the range from 0.2 to 8.5 MeV. Their intensities and energies were controlled by a Si surface barrier detector located in an accelerator scattering chamber. The ranges of protons with energies of 67 MeV were comparable to the thickness of the PM-355 track detectors. Latent tracks in the polymeric detectors were chemically etched under standard conditions to develop the tracks. Standard optical microscope and scanning electron microscopy techniques were used for surface morphology characterization.

  13. Application of USNRC NUREG/CR-6661 and draft DG-1108 to evolutionary and advanced reactor designs

    SciTech Connect (OSTI)

    Chang 'Apollo', Chen

    2006-07-01

    For the seismic design of evolutionary and advanced nuclear reactor power plants, there are definite financial advantages in the application of USNRC NUREG/CR-6661 and draft Regulatory Guide DG-1108. NUREG/CR-6661, 'Benchmark Program for the Evaluation of Methods to Analyze Non-Classically Damped Coupled Systems', was by Brookhaven National Laboratory (BNL) for the USNRC, and Draft Regulatory Guide DG-1108 is the proposed revision to the current Regulatory Guide (RG) 1.92, Revision 1, 'Combining Modal Responses and Spatial Components in Seismic Response Analysis'. The draft Regulatory Guide DG-1108 is available at http://members.cox.net/apolloconsulting, which also provides a link to the USNRC ADAMS site to search for NUREG/CR-6661 in text file or image file. The draft Regulatory Guide DG-1108 removes unnecessary conservatism in the modal combinations for closely spaced modes in seismic response spectrum analysis. Its application will be very helpful in coupled seismic analysis for structures and heavy equipment to reduce seismic responses and in piping system seismic design. In the NUREG/CR-6661 benchmark program, which investigated coupled seismic analysis of structures and equipment or piping systems with different damping values, three of the four participants applied the complex mode solution method to handle different damping values for structures, equipment, and piping systems. The fourth participant applied the classical normal mode method with equivalent weighted damping values to handle differences in structural, equipment, and piping system damping values. Coupled analysis will reduce the equipment responses when equipment, or piping system and structure are in or close to resonance. However, this reduction in responses occurs only if the realistic DG-1108 modal response combination method is applied, because closely spaced modes will be produced when structure and equipment or piping systems are in or close to resonance. Otherwise, the conservatism in the current Regulatory Guide 1.92, Revision 1, will overshadow the advantage of coupled analysis. All four participants applied the realistic modal combination method of DG-1108. Consequently, more realistic and reduced responses were obtained. (authors)

  14. Solid-solution CrCoCuFeNi high-entropy alloy thin films synthesized by sputter deposition

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    An, Zhinan; Jia, Haoling; Wu, Yueying; Rack, Philip D.; Patchen, Allan D.; Liu, Yuzi; Ren, Yang; Li, Nan; Liaw, Peter K.

    2015-05-04

    The concept of high configurational entropy requires that the high-entropy alloys (HEAs) yield single-phase solid solutions. However, phase separations are quite common in bulk HEAs. A five-element alloy, CrCoCuFeNi, was deposited via radio frequency magnetron sputtering and confirmed to be a single-phase solid solution through the high-energy synchrotron X-ray diffraction, energy-dispersive spectroscopy, wavelength-dispersive spectroscopy, and transmission electron microscopy. The formation of the solid-solution phase is presumed to be due to the high cooling rate of the sputter-deposition process.

  15. Roles of Fe2+, Fe3+, and Cr3+ Surface Sites in the Oxidation of NO on the (Fe,Cr)3O4(1 1 1) Surface Termination of an ?-(Fe,Cr)2O3(0 0 0 1) Mixed Oxide

    SciTech Connect (OSTI)

    Henderson, Michael A.

    2014-10-01

    The oxidation and photooxidation reactions of nitric oxide were explored on a mixed Fe and Cr mixed oxide surface using temperature programmed desorption (TPD). The mixed oxide surface examined initially had a corundum (0001) structure with a nominal cation composition of 75% Fe and 25% Cr, but after sputter/anneal cleaning was transformed into a magnetite-like (111) surface structure enriched with Cr (~40%). TPD studies of nitric oxide on the (Fe,Cr)3O4(111) surface revealed two main desorption states at 220 and 370 K, along with a third minor desorption state at ~310 K. Similarly, O2 TPD occurred in two main TPD states (100 and 230 K) and a minor state (155 K). The more strongly and weakly bound NO and O2 molecules were assigned to adsorption at Fe2+ and Fe3+ sites, respectively, with the minor desorption states assigned to Cr3+ sites. No thermal decomposition or surface chemistry was detected in TPD for adsorbed NO (e.g., no N2 or N2O formation), whereas ~10% of the adsorbed O2 irreversibly dissociated at Fe2+ sites. These dissociated oxygen species did not react with coadsorbed NO, but instead blocked NO adsorption at the Fe2+ sites, but had no effect on NO adsorption at Fe3+ sites. In contrast, NO reacted with preadsorbed O2 molecules to generate an adsorbed nitrate/nitrite species that decomposed in TPD to liberate NO at 425 K, leaving an O atom on the surface. Coadsorption of 15N18O with 16O2 suggests the oxidized species was a nitrate based on the detected level of oxygen scrambling. Preadsorption of O2 was required for nitrate formation as preadsorbed NO blocked both O2 adsorption and the oxidation reaction. Irradiation of adsorbed NO with 460 nm light at 40 K resulted in rapid photodesorption of NO without generation of any new surface species. Irradiation of the coadsorbed NO+O2 system did not promote additional NO oxidation, but limited the extent of thermal NO oxidation (in subsequent TPD) by photodepleting the surface of adsorbed NO. Preheating the NO+O2 adlayer to 250 K prior to 460 nm light irradiation restored the level of thermal NO oxidation, revealing both that thermal activation is required for NO oxidation on the (Fe,Cr)3O4(111) surface and that the nitrate product was insensitive to 460 nm light. The author thanks Drs. Sara Chamberlin and Scott Chambers for supplying the film used in this work. This work was supported by the US Department of Energy, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences & Biosciences. Pacific Northwest National Laboratory (PNNL) is a multiprogram national laboratory operated for DOE by Battelle. The research was performed using EMSL, a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory.

  16. Fluid diversion and sweep improvement with chemical gels in oil recovery processes. [Four types of gels: resorcinol-formaldehyde; colloidal silica; Cr sup 3+ (chloride)-xanthan; and Cr sup 3+ (acetate)-polyacrylamide

    SciTech Connect (OSTI)

    Seright, R.S.; Martin, F.D.

    1992-09-01

    The objectives of this project were to identify the mechanisms by which gel treatments divert fluids in reservoirs and to establish where and how gel treatments are best applied. Several different types of gelants were examined, including polymer-based gelants, a monomer-based gelant, and a colloidal-silica gelant. This research was directed at gel applications in water injection wells, in production wells, and in high-pressure gas floods. The work examined how the flow properties of gels and gelling agents are influenced by permeability, lithology, and wettability. Other goals included determining the proper placement of gelants, the stability of in-place gels, and the types of gels required for the various oil recovery processes and for different scales of reservoir heterogeneity. During this three-year project, a number of theoretical analyses were performed to determine where gel treatments are expected to work best and where they are not expected to be effective. The most important, predictions from these analyses are presented. Undoubtedly, some of these predictions will be controversial. However, they do provide a starting point in establishing guidelines for the selection of field candidates for gel treatments. A logical next step is to seek field data that either confirm or contradict these predictions. The experimental work focused on four types of gels: (1) resorcinol-formaldehyde, (2) colloidal silica, (3) Cr{sup 3+}(chloride)-xanthan, and (4) Cr{sup 3+}(acetate)-polyacrylamide. All experiments were performed at 41{degrees}C.

  17. Effect of Cr substitution on the magnetic and magnetic-transport properties of Fe{sub 2}Mn{sub 1-x}Cr{sub x}Si alloys

    SciTech Connect (OSTI)

    Pal, Lakhan; Gupta, Sachin; Suresh, K. G.; Nigam, A. K.

    2014-05-07

    Fe{sub 2}Mn{sub 1-x}Cr{sub x}Si (x?=?0, 0.1, and 0.2) alloys were investigated for their magnetic and transport properties in view of the expected half metallicity. It is found that Cr substitution suppresses the antiferromagnetic phase present in parent Fe{sub 2}MnSi, which completely disappears for x?=?0.2. Curie temperature of the alloys increases from 230?K to 299?K as x is increased from 0 to 0.2. The value of the Rhodes-Wohlfarth ratio indicates that the system shows iterant magnetism. Resistivity measurements also show absence of antiferromagnetic phase for x?=?0.2. Resistivity data have been fitted by considering the electron-phonon and electron-magnon scattering contributions, which indicates the presence of half metallicity in these compounds. Temperature dependence of resistivity data shows magnetoresistance of ?3% and ?2.5% at Curie temperature with applied field of 50 kOe for x?=?0.1 and 0.2, respectively.

  18. Mutual neutralization of atomic rare-gas cations (Ne{sup +}, Ar{sup +}, Kr{sup +}, Xe{sup +}) with atomic halide anions (Cl{sup −}, Br{sup −}, I{sup −})

    SciTech Connect (OSTI)

    Shuman, Nicholas S.; Miller, Thomas M.; Viggiano, Albert A.; Johnsen, Rainer

    2014-01-28

    We report thermal rate coefficients for 12 reactions of rare gas cations (Ne{sup +}, Ar{sup +}, Kr{sup +}, Xe{sup +}) with halide anions (Cl{sup −}, Br{sup −}, I{sup −}), comprising both mutual neutralization (MN) and transfer ionization. No rate coefficients have been previously reported for these reactions; however, the development of the Variable Electron and Neutral Density Attachment Mass Spectrometry technique makes it possible to measure the difference of the rate coefficients for pairs of parallel reactions in a Flowing Afterglow-Langmuir Probe apparatus. Measurements of 18 such combinations of competing reaction pairs yield an over-determined data set from which a consistent set of rate coefficients of the 12 MN reactions can be deduced. Unlike rate coefficients of MN reactions involving at least one polyatomic ion, which vary by at most a factor of ∼3, those of the atom-atom reactions vary by at least a factor 60 depending on the species. It is found that the rate coefficients involving light rare-gas ions are larger than those for the heavier rare-gas ions, but the opposite trend is observed in the progression from Cl{sup −} to I{sup −}. The largest rate coefficient is 6.5 × 10{sup −8} cm{sup 3} s{sup −1} for Ne{sup +} with I{sup −}. Rate coefficients for Ar{sup +}, Kr{sup +}, and Xe{sup +} reacting with Br{sub 2}{sup −} are also reported.

  19. Experimental and ab initio studies of the reactive processes in gas phase i-C{sub 3}H{sub 7}Br and i-C{sub 3}H{sub 7}OH collisions with potassium ions

    SciTech Connect (OSTI)

    Lpez, E.; Lucas, J. M.; Andrs, J. de; Albert, M.; Aguilar, A., E-mail: a.aguilar@ub.edu [Departament de Qumica Fsica, Institut de Qumica Terica i Computacional (IQTCUB), Universitat de Barcelona, Mart i Franqus, 1, 08028 Barcelona (Spain); Bofill, J. M. [Departament de Qumica Orgnica, Institut de Qumica Terica i Computacional (IQTCUB), Universitat de Barcelona, Mart i Franqus, 1, 08028 Barcelona (Spain); Bassi, D. [Dipartimento di Fisica, Universit degli Studi di Trento, 38123 Povo-Trento (Italy)

    2014-10-28

    Collisions between potassium ions and neutral i-C{sub 3}H{sub 7}Br and i-C{sub 3}H{sub 7}OH, all in their electronic ground state, have been studied in the 0.1010.00 eV center of mass (CM) collision energy range, using the radiofrequency-guided ion beam technique. In K{sup +} + i-C{sub 3}H{sub 7}Br collisions KHBr{sup +} formation was observed and quantified, while the analogous KH{sub 2}O{sup +} formation in K{sup +} + i-C{sub 3}H{sub 7}OH was hardly detected. Moreover, formation of the ion-molecule adducts and their decomposition leading to C{sub 3}H{sub 7}{sup +} and either KBr or KOH, respectively, have been observed. For all these processes, absolute cross-sections were measured as a function of the CM collision energy. Ab initio structure calculations at the MP2 level have given information about the potential energy surfaces (PESs) involved. In these, different stationary points have been characterized using the reaction coordinate method, their connectivity being ensured by using the intrinsic-reaction-coordinate method. From the measured excitation function for KHBr{sup +} formation the corresponding thermal rate constant at 303 K has been calculated. The topology of the calculated PESs allows an interpretation of the main features of the reaction dynamics of both systems, and in particular evidence the important role played by the potential energy wells in controlling the reactivity for the different reaction channels.

  20. Study the effect of mechanical alloying parameters on synthesis of Cr{sub 2}NbAl{sub 2}O{sub 3} nanocomposite

    SciTech Connect (OSTI)

    Shayesteh, Payam Mirdamadi, Shamseddin; Razavi, Hossein

    2014-01-01

    Graphical abstract: - Highlights: Cr{sub 2}NbAl{sub 2}O{sub 3} nanocomposite synthesized through MA. Effect of BPR, rotating speed, milling time and PCA concentration investigated. After annealing at 1100 C crystalline phase were appeared. WilliamsonHall analysis was used in order to study the grain size of nano composite. - Abstract: In this study, Cr{sub 2}Nb20 vol.% Al{sub 2}O{sub 3} nanocomposite was prepared successfully by mechanochemical reaction between Al, Nb and Cr{sub 2}O{sub 3} powders. Amorphization of powder occurred during mechanical alloying because of high energy collisions between powders and steel balls in milling container which transfer high degree of energy to powders. Therefore, annealing was needed to form crystalline phases. The influence of different mechanical alloying parameters such as BPR, rotating speed, milling time and PCA concentration on synthesis of composite material were investigated. After mechanical alloying, the powder was encapsulated in quartz and then annealed at 1100 C for 3 h. After annealing, 3 different phases were appeared (Cr{sub 2}Nb (cubic), Cr{sub 2}Nb (hexagonal) and ?-Al{sub 2}O{sub 3}). The structural changes of powder particles during mechanical alloying were studied by X-ray diffractometry (XRD), atomic force microscopy (AFM), scanning electron microscopy (SEM) and transmission electron microscopy (TEM)

  1. Ferromagnetism of magnetically doped topological insulators in Cr{sub x}Bi{sub 2−x}Te{sub 3} thin films

    SciTech Connect (OSTI)

    Ni, Y.; Zhang, Z. Hadimani, R. L.; Tuttle, G.; Jiles, D. C.; Nlebedim, I. C.

    2015-05-07

    We investigated the effect of magnetic doping on magnetic and transport properties of Bi{sub 2}Te{sub 3} thin films. Cr{sub x}Bi{sub 2−x}Te{sub 3} thin films with x = 0.03, 0.14, and 0.29 were grown epitaxially on mica substrate with low surface roughness (∼0.4 nm). It is found that Cr is an electron acceptor in Bi{sub 2}Te{sub 3} and increases the magnetization of Cr{sub x}Bi{sub 2−x}Te{sub 3}. When x = 0.14 and 0.29, ferromagnetism appears in Cr{sub x}Bi{sub 2−x}Te{sub 3} thin films, where anomalous Hall effect and weak localization of magnetoconductance were observed. The Curie temperature, coercivity, and remnant Hall resistance of thin films increase with increasing Cr concentration. The Arrott-Noakes plot demonstrates that the critical mechanism of the ferromagnetism can be described better with 3D-Heisenberg model than with mean field model. Our work may benefit for the practical applications of magnetic topological insulators in spintronics and magnetoelectric devices.

  2. Influence of Cr and W alloying on the fiber-matrix interfacial shear strength in cast and directionally solidified sapphire NiAl composites

    SciTech Connect (OSTI)

    Asthana, R.; Tiwari, R.; Tewari, S.N.

    1995-08-01

    Sapphire-reinforced NiAl matrix composites with chromium or tungsten as alloying additions were synthesized using casting and zone directional solidification (DS) techniques and characterized by a fiber pushout test as well as by microhardness measurements. The sapphire-NiAl(Cr) specimens exhibited an interlayer of Cr rich eutectic at the fiber-matrix interface and a higher interfacial shear strength compared to unalloyed sapphire-NiAl specimens processed under identical conditions. In contrast, the sapphire-NiAl(W) specimens did not show interfacial excess of tungsten rich phases, although the interfacial shear strength was high and comparable to that of sapphire-NiAl(Cr). The postdebond sliding stress was higher in sapphire-NiAl(Cr) than in sapphire-NiAl(W) due to interface enrichment with chromium particles. The matrix microhardness progressively decreased with increasing distance from the interface in both DS NiAl and NiAl(Cr) specimens. The study highlights the potential of casting and DS techniques to improve the toughness and strength of NiAl by designing dual-phase microstructures in NiAl alloys reinforced with sapphire fibers.

  3. Magnetic Correlations in the Quasi-Two-Dimensional Semiconducting Ferromagnet CrSiTe3

    SciTech Connect (OSTI)

    Williams, Travis J.; Aczel, Adam A.; Lumsden, Mark D.; Nagler, Stephen E.; Stone, Matthew B.; Yan, Jiaqiang -Q.; Mandrus, D.

    2015-10-02

    Intrinsic, 2D ferromagnetic semiconductors are an important class of materials for overcoming dilute magnetic semiconductors’ limitations for spintronics. CrSiTe3 is a particularly interesting material of this class, since it can likely be exfoliated to single layers, for which Tc is predicted to increase dramatically. Establishing the nature of the bulk material’s magnetism is necessary for understanding the thin-film magnetic behavior and the material’s possible applications. In this work, we use elastic and inelastic neutron scattering to measure the magnetic properties of single crystalline CrSiTe3. We find a very small single ion anisotropy that favors magnetic ordering along the c-axis and that the measured spin waves fit well to a model in which the moments are only weakly coupled along that direction. Then, we find that both static and dynamic correlations persist within the ab-plane up to at least 300 K, which is strong evidence of the material's 2D characteristics that are relevant for future studies on thin film and monolayer samples.

  4. Nano-twin Mediated Plasticity in Carbon-containing FeNiCoCrMn High Entropy Alloys

    SciTech Connect (OSTI)

    Wu, Zhenggang; Bei, Hongbin; Parish, Chad M

    2015-06-14

    Equiatomic FeNiCoCrMn alloy has been reported to exhibit promising strength and ductility at cryogenic temperature and deformation mediated by nano-twining appeared to be one of the main reasons. We use the FeNiCoCrMn alloy as a base alloy to seek further improvement of its mechanical properties by alloying additional elements, i.e., interstitial carbon. Moreover, the effects of carbon on microstructures, mechanical properties and twinning activities were investigated in two different temperatures (77 and 293 K). With addition of 0.5 at% C, the high entropy alloy still remains entirely single phase face-centered cubic (FCC) crystal structure. We found that these materials can be cold rolled and recrystallized to produce a microstructure with equiaxed grains. Both strain hardening rate and strength are enhanced while high uniform elongations to fracture (~70% at 77 K and ~40% at 293 K) are still maintained. The increased strain hardening and strength could be caused by the promptness of deformation twinning in C-containing high entropy alloys.

  5. Tribological properties of CrN coatings deposited by nitro-chromizing treatment on AISI D2 steel

    SciTech Connect (OSTI)

    Durmaz, M. Abakay, E.; Sen, U.; Sen, S.; Kilinc, B.

    2015-03-30

    In this work, the wear test of uncoated and chromium nitride coated AISI D2 cold work tool steel against alumina ball realized at 0.1?m/s sliding speeds and under the loads of 2.5N, 5N and 10N. Steel samples were nitrided at 575C for 8?h in the first step of the coating process, and then chromium nitride coating was performed thermo-reactive deposition technique (TRD) in a powder mixture consisting of ferro-chromium, ammonium chloride and alumina at 1000C for 2?h. Nitro-chromized samples were characterized by X-Ray diffraction analysis (XRD), scanning electron microscopy (SEM), micro-hardness and ball on disk wear tests. The coating layer formed on the AISI D2 steel was compact and homogeneous. X-ray studies showed that the phase formed in the coated layer is Cr{sub 2}N. The depth of the layer was 8.15?m. The average hardness of the layer was 216015 HV{sub 0.025}. For uncoated and chromium nitride materials, wear rate increased with increasing load. The results of friction coefficient and wear rate of the tested materials showed that the CrN coating presents the lowest results.

  6. Exceptional damage-tolerance of a medium-entropy alloy CrCoNi at cryogenic temperatures

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Gludovatz, Bernd; Hohenwarter, Anton; Thurston, Keli V. S.; Bei, Hongbin; Wu, Zhenggang; George, Easo P.; Ritchie, Robert O.

    2016-02-02

    The high-entropy alloys are an intriguing new class of metallic materials that derive their properties not from a single dominant constituent, such as iron in steels, nor from the presence of a second phase, such as in nickel-base superalloys, but rather comprise multi-element systems that crystallize as a single phase, despite containing high concentrations (~20 at.%) of five or more elements with different crystal structures. Indeed, we have recently reported on one such single-phase high-entropy alloy, NiCoCrFeMn, which displays exceptional strength and toughness at cryogenic temperatures. Here which displays unprecedented strength-toughness properties that exceed those of all high-entropy alloys andmore » most multi-phase alloys. With roomtemperature tensile strengths of almost 1 GPa and KJIc fracture-toughness values above 200 MPa.m 1/2 (with crack-growth toughnesses exceeding 300 MPa.m 1/2), the strength, ductility and toughness of the NiCoCr alloy actually improve at cryogenic temperatures to unprecedented levels of strengths above 1.3 GPa, failure strains up to 90% and KJIc values of 275 MPa.m 1/2 (with crackgrowth toughnesses above 400 MPa.m 1/2). These properties appear to result from continuous steady strain hardening, which acts to suppress plastic instability, resulting from pronounced dislocation activity and deformation-induced nano-twinning.« less

  7. Multiferroic CuCrO? under high pressure: In situ X-ray diffraction and Raman spectroscopic studies

    SciTech Connect (OSTI)

    Garg, Alka B. Mishra, A. K.; Pandey, K. K.; Sharma, Surinder M.

    2014-10-07

    The compression behavior of delafossite compound CuCrO? has been investigated by in situ x-ray diffraction (XRD) and Raman spectroscopic measurements up to 23.2 and 34 GPa, respectively. X-ray diffraction data show the stability of ambient rhombohedral structure up to ~23 GPa. Material shows large anisotropy in axial compression with c-axis compressibility, ?{sub c} = 1.26 10?(1) GPa? and a-axis compressibility, ?{sub a} = 8.90 10?(6) GPa?. Our XRD data show an irreversible broadening of diffraction peaks. Pressure volume data when fitted to 3rd order Birch-Murnaghan equation of state give the value of bulk modulus, B? = 156.7(2.8) GPa with its pressure derivative, B?{sup } as 5.3(0.5). All the observed vibrational modes in Raman measurements show hardening with pressure. Appearance of a new mode at ~24 GPa indicates the structural phase transition in the compound. Our XRD and Raman results indicate that CuCrO{sub 2} may be transforming to an ordered rocksalt type structure under compression.

  8. Exceptional damage-tolerance of a medium-entropy alloy NiCoCr at cryogenic temperatures

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Gludovatz, Bernd; Hohenwarter, Anton; Thurston, Keli; Bei, Hongbin; Wu, Zhenggang; George, Easo

    2016-01-01

    High-entropy alloys1 3 are an intriguing new class of metallic materials that derive their properties not from a single dominant constituent, such as iron in steels, nor from the presence of a second phase, such as in nickel-base superalloys, but rather comprise multi-element systems that crystallize as a single phase4 7, despite containing high concentrations (~20 at.%) of five or more elements with different crystal structures5 7. Indeed, we have recently reported on one such single-phase high-entropy alloy, NiCoCrFeMn, which displays exceptional strength and toughness at cryogenic temperatures8. Here which displays unprecedented strength-toughness properties that exceed those of all high-entropymore »alloys and most multi-phase alloys. With roomtemperature tensile strengths of almost 1 GPa and KJIc fracture-toughness values above 200 MPa.m1/2 (with crack-growth toughnesses exceeding 300 MPa.m1/2), the strength, ductility and toughness of the NiCoCr alloy actually improve at cryogenic temperatures to unprecedented levels of strengths above 1.3 GPa, failure strains up to 90% and KJIc values of 275 MPa.m1/2 (with crackgrowth toughnesses above 400 MPa.m1/2). Such properties appear to result from continuous steady strain hardening, which acts to suppress plastic instability, resulting from pronounced dislocation activity and deformation-induced nano-twinning.« less

  9. Nano-twin Mediated Plasticity in Carbon-containing FeNiCoCrMn High Entropy Alloys

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Wu, Zhenggang; Bei, Hongbin; Parish, Chad M

    2015-06-14

    Equiatomic FeNiCoCrMn alloy has been reported to exhibit promising strength and ductility at cryogenic temperature and deformation mediated by nano-twining appeared to be one of the main reasons. We use the FeNiCoCrMn alloy as a base alloy to seek further improvement of its mechanical properties by alloying additional elements, i.e., interstitial carbon. Moreover, the effects of carbon on microstructures, mechanical properties and twinning activities were investigated in two different temperatures (77 and 293 K). With addition of 0.5 at% C, the high entropy alloy still remains entirely single phase face-centered cubic (FCC) crystal structure. We found that these materials canmore » be cold rolled and recrystallized to produce a microstructure with equiaxed grains. Both strain hardening rate and strength are enhanced while high uniform elongations to fracture (~70% at 77 K and ~40% at 293 K) are still maintained. The increased strain hardening and strength could be caused by the promptness of deformation twinning in C-containing high entropy alloys.« less

  10. HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel

    Office of Scientific and Technical Information (OSTI)

    (Conference) | SciTech Connect HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel Citation Details In-Document Search Title: HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel Crystal and interfacial structures of oxide nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y{sub 2}O{sub 3} ODS ferritic steel have been examined using high-resolution transmission electron microscopy (HRTEM) techniques. Oxide nanoparticles with a complex-oxide core and an amorphous

  11. Investigation of giant-dipole-resonance decay in the ({gamma}, n) reactions on {sup 52}Cr and {sup 51}V nuclei

    SciTech Connect (OSTI)

    Verbitsky, S. S.; Lapic, A.M. Ratner, B. S.; Rusakov, A. V.; Tikanov, M. A.; Tulupov, B. A.; Tzelebrovsky, A. N.

    2009-03-15

    The cross sections for the emission of fast neutrons ({epsilon}{sub n} > 3.7 MeV) in the reactions {sup 52}Cr({gamma}, n){sup 51}Cr and {sup 51}V({gamma}, n){sup 50}V at incident-photon energies in the range between 16.0 and 25.8 MeV were studied. The neutron energy spectra were measured at the bremsstrahlung-photon endpoint energies of 18.5, 21.0, and 23.0 MeV for the {sup 52}Cr and {sup 51}V nuclei and at the bremsstrahlung-photon energy of 25.5 MeV for the {sup 51}V nucleus. Special features of giant-dipole-resonance decay that are associated with the existence of a structure in photoneutron cross sections and spectra are discussed.

  12. Reactions of methyl groups on a non-reducible metal oxide: The reaction of iodomethane on stoichiometric α-Cr2O3(0001)

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Dong, Yujung; Brooks, John D.; Chen, Tsung-Liang; Mullins, David R.; Cox, David F.

    2015-06-10

    The reaction of iodomethane on the nearly stoichiometric α-Cr2O3(0001) surface produces gas phase ethylene, methane, and surface iodine adatoms. The reaction is first initiated by the dissociation of iodomethane into surface methyl fragments, -CH3, and iodine adatoms. Methyl fragments bound at surface Cr cation sites undergo a rate-limiting dehydrogenation reaction to methylene, =CH2. The methylene intermediates formed from methyl dehydrogenation can then undergo coupling reactions to produce ethylene via two principle reaction pathways: (1) direct coupling of methylene and (2) methylene insertion into the methyl surface bond to form surface ethyl groups which undergo β-H elimination to produce ethylene. Themore » liberated hydrogen also combines with methyl groups to form methane. Iodine adatoms from the dissociation of iodomethane deactivate the surface by simple site blocking of the surface Cr3+ cations.« less

  13. Band Alignment, Built-In Potential, and the Absence of Conductivity at the LaCrO3/SrTiO3(001) Heterojunction

    SciTech Connect (OSTI)

    Chambers, Scott A.; Qiao, Liang; Droubay, Timothy C.; Kaspar, Tiffany C.; Arey, Bruce W.; Sushko, P. V.

    2011-11-07

    MBE-grown LaCrO3/SrTiO3(001) exhibits a staggered band alignment with valence and conduction band offsets of 2.45(6) and 0.8(1) eV, respectively. Core-level XPS peak broadening is consistent with no band bending in the SrTiO3 and a gradient of ~200 meV per unit cell in the LaCrO3. This gradient is adequate to trigger an electronic reconstruction, and the attendant transfer of charge from film to substrate, to alleviate the polarity mismatch. However, the interface is insulating because charge redistribution within the CrO2 layers occurs rather than electronic reconstruction to screen the field.

  14. Reactions of methyl groups on a non-reducible metal oxide: The reaction of iodomethane on stoichiometric ?-Cr2O3(0001)

    SciTech Connect (OSTI)

    Dong, Yujung; Brooks, John D.; Chen, Tsung-Liang; Mullins, David R.; Cox, David F.

    2015-06-10

    The reaction of iodomethane on the nearly stoichiometric ?-Cr2O3(0001) surface produces gas phase ethylene, methane, and surface iodine adatoms. The reaction is first initiated by the dissociation of iodomethane into surface methyl fragments, -CH3, and iodine adatoms. Methyl fragments bound at surface Cr cation sites undergo a rate-limiting dehydrogenation reaction to methylene, =CH2. The methylene intermediates formed from methyl dehydrogenation can then undergo coupling reactions to produce ethylene via two principle reaction pathways: (1) direct coupling of methylene and (2) methylene insertion into the methyl surface bond to form surface ethyl groups which undergo ?-H elimination to produce ethylene. The liberated hydrogen also combines with methyl groups to form methane. Iodine adatoms from the dissociation of iodomethane deactivate the surface by simple site blocking of the surface Cr3+ cations.

  15. Structure and magnetic interactions in the solid solution Ba{sub 3?x}Sr{sub x}Cr{sub 2}O{sub 8}

    SciTech Connect (OSTI)

    Grundmann, Henrik; Schilling, Andreas; Marjerrison, Casey A.; Dabkowska, Hanna A.; Gaulin, Bruce D.

    2013-09-01

    Highlights: We describe for the first time the preparation of single- and polycrystalline members of the solid solution Ba{sub 3?x}Sr{sub x}Cr{sub 2}O{sub 8}. We report on the structural changes in the solid solution at room temperature depending on the stoichiometry. We describe the peculiar change of the magnetic behavior in the solid solution with the stoichiometry. - Abstract: Solid solutions of the magnetic insulators Ba{sub 3}Cr{sub 2}O{sub 8} and Sr{sub 3}Cr{sub 2}O{sub 8} (Ba{sub 3?x}Sr{sub x}Cr{sub 2}O{sub 8}) have been prepared in polycrystalline form for the first time. Single crystalline material was obtained using a mirror image floating zone technique. X-ray diffraction data taken at room temperature indicate that the space group of Ba{sub 3?x}Sr{sub x}Cr{sub 2}O{sub 8} remains unchanged for all values of x, while the cell parameters depend on the chemical composition, as expected. Magnetization data, measured from 300 K down to 2 K, suggest that the interaction constant J{sub d} within the Cr{sup 5+} dimers varies in a peculiar way as a function of x, starting at J{sub d} = 25 K for x = 0, then first slightly dropping to J{sub d} = 18 K for x ? 0.75, before reaching J{sub d} = 62 K for x = 3.

  16. Ga, Ca, and 3d transition element (Cr through Zn) partitioning among spinel-lherzolite phases from the Lanzo massif, Italy: Analytical results and crystal chemistry

    SciTech Connect (OSTI)

    Wogelius, R.A.; Fraser, D.G.

    1994-06-01

    Ultramafic rocks exposed in Lanzo massif, Italy is a record of mantle geochemistry, melting, sub-solidus re-equilibration. Plagioclase(+ spinel)-lherzolite samples were analyzed by Scanning Proton Microscopy, other techniques. Previous work postulated partial melting events and a two-stage sub-solidus cooling history; this paper notes Ga enrichment on spinel-clinopyroxene grain boundaries, high Ga and transition element content of spinel, and pyroxene zonation in Ca and Al. Trace element levels in olivine and orthopyroxene are also presented. Zoning trends are interpreted as due to diffusion during cooling. Olivine-clinopyroxene Cr and Ca exchange as well as clinopyroxene and spinel zonation trends indicate that the massif experienced at least two sub-solidus cooling episodes, one at 20 kbar to 1000 C and one at 8 kbar <750C. Ga levels in cores of Lanzo high-Cr spinels are high (82-66 ppM) relative to other mantle spinels (66-40 ppM), indicating enrichment. Ga content of ultramafic spinels apparently increases with Cr content; this may be due to: increased Ga solubility stemming from crystal chemical effects and/or higher Ga activities in associated silicate melts. Thus, during melting, high-Cr residual spinel may tend to buffer solid-phase Ga level. These spinels are not only rich in Ga and Cr (max 26.37 el. wt %), but also in Fe (max 21.07 el. wt %), Mn (max 3400 ppM), and Zn (max 2430 ppM). These enrichments are again due to melt extraction and partitioning into spinel structure. Low Ni (min 1050 ppM) levels are due to unsuccessful competition of Ni with Cr for octahedral structural sites caused by crystal field. Comparisons of change in partitioning vs Cr content among several 3d transition elements for spinels from Lanzo, other localities allow us to separate crystal field effects from bulk chemical effects and to show that in typical assemblages, inversion of olivine-spinel partition coefficient for Ni from <1 to >1 should occur at 11% el. wt. Cr in spinel.

  17. Microstructure and oxidation behavior of NiCoCrAl/YSZ microlaminates produced by EB-PVD

    SciTech Connect (OSTI)

    Shi Guodong, E-mail: gdshi@dlut.edu.cn [State Key Laboratory of Structural Analysis for Industrial Equipment, Dalian University of Technology, Dalian 116024 (China); Wang Zhi; Liu Mincong [State Key Laboratory of Structural Analysis for Industrial Equipment, Dalian University of Technology, Dalian 116024 (China); Liang Jun [Center for Composite Materials, Harbin Institute of Technology, Harbin, 150001 (China); Wu Zhanjun [State Key Laboratory of Structural Analysis for Industrial Equipment, Dalian University of Technology, Dalian 116024 (China)

    2011-11-15

    Two NiCoCrAl/ZrO{sub 2}-Y{sub 2}O{sub 3} microlaminates (A and B) were fabricated by electron beam physical vapor deposition, which were different in layer number and metal-layer thickness. The layer number was 20 and 26, respectively. And the metal-layer thickness was 35 and 14 {mu}m, respectively. The microstructure and isothermal oxidation behavior were investigated. During the exposure in air at 1000 deg. C for 100 h, the t to m phase transformation occurred in the ceramic layers, and oxide scales formed at the surfaces of not only the outer metal-layers but also the internal metal-layers for the microlaminates. The oxidation rate of microlaminate B was greater than that of microlaminate A. Their overall mass gains were significantly dependent on the number and thickness of the metal-layers. The oxidation products were also influenced by metal-layer thickness. Oxide scales of the 35 {mu}m thick metal-layer microlaminate (A) consisted mainly of {alpha}-Al{sub 2}O{sub 3} and {theta}-Al{sub 2}O{sub 3}, while the oxidation products of the 14 {mu}m thick metal-layer microlaminate (B) were the mixture of {alpha}-Al{sub 2}O{sub 3}, {theta}-Al{sub 2}O{sub 3} and Cr{sub 2}O{sub 3}. It was also found that the growth of the oxide scale adjacent to the top YSZ layer was controlled by the oxygen diffusion, and that the growth of the oxide scale adjacent to the internal YSZ layer was controlled by the metal ionic diffusion. - Highlights: {yields} Effect of laminate structure on oxidation behavior of microlaminates was studied. {yields} Oxygen diffusion through YSZ layers led to the oxidation of internal metal-layers. {yields} The thinner NiCoCrAl layer was more difficult to form the stable Al{sub 2}O{sub 3} scale. {yields} Control of oxide scale growth by the oxygen diffusion in the outer metal-layers. {yields} Control of oxide scale growth by the metal ionic diffusion in internal metal-layers.

  18. The Cr-substitution concentration dependence of the structural, electric and magnetic behaviors for Aurivillius Bi{sub 5}Ti{sub 3}FeO{sub 15} multiferroic ceramics

    SciTech Connect (OSTI)

    Liu, Jia; Bai, Wei E-mail: xdtang@sist.ecnu.edu.cn; Yang, Jing; Xu, Wenfei; Zhang, Yuanyuan; Tang, Xiaodong E-mail: xdtang@sist.ecnu.edu.cn; Lin, Tie; Meng, Xiangjian; Duan, Chun-Gang; Chu, Junhao

    2013-12-21

    Aurivillius Bi{sub 5}Ti{sub 3}FeO{sub 15} (BTFO) multiferroic ceramics with different Cr-doped concentrations have been synthesized by the conventional solid state reaction method. The influences of Cr-doping concentrations on the structural, magnetic, dielectric, and ferroelectric properties of BTFO ceramics are investigated in detail. All these sintered Cr-substituted BTFO ceramics are determined to be layered perovskite Aurivillius structure by X-ray diffraction, as well as the lattice parameters a, b, and c are in good accordance with Vegard's law along with the Cr-doping concentration. The lattice distortion a/b for Aurivillius family decreases with increasing Cr-doping concentration. Moreover, Cr-doping can promote greatly the grain growth of BTFO samples confirmed from field emission scanning electron microscopy characterization. However, no obvious signs of the improvement in ferroelectric properties are found in Cr-doped BTFO ceramics, and abnormal ferroelectric polarization versus electric field (P-E) loops are observed as Cr-doping content is beyond 0.1. Similar ? (tan?) versus frequency plots to those of the BTFO sample are exhibited when Cr-doping concentration is less than 0.1. Nevertheless, obvious dielectric dispersion phenomena are shown as the Cr-doping concentration is beyond 0.1, and this dispersion behavior becomes strong with further increasing Cr-doping concentration, which are clearly indicated by the appearance of dielectric loss relaxation peaks in the measurement frequency from 10{sup 2} Hz to 10{sup 6} Hz. In addition, the corresponding frequency to relaxation peak shifts towards high frequencies with the Cr-doping concentration. Finally, the same magnetic orderings for all these Cr-doped BTFO ceramics as those of the BTFO one, i.e., superparamagnetic state dominated with antiferromagnetic interaction, are unambiguously found, signifying that the predicted Fe{sup 3+}-O-Cr{sup 3+} 180 ferromagnetic superexchange interaction based on the Goodenough-Kanamori (G-K) rule might not be achieved in BTFO ceramics through Cr substitution by the conventional solid state reaction.

  19. Effect of composition changes on the structure and properties of W-Cr-Ni-C detonation gun coatings

    SciTech Connect (OSTI)

    Stavros, A.J.

    1995-12-31

    Changes in the microstructure and wear behavior of W-Cr-Ni-C coatings as a function of the composition of the starting powder were studied. The experimental powder compositions were chosen so that the results could be analyzed statistically as a mixture problem with the extreme vertices design. All coatings were deposited by identical detonation gun operating conditions. Although the variation of powder chemistry resulted in distinctively different powder morphologies, all coatings were found to be composed of the same 4 (possibly more) complex carbides. The amount and, to some degree, morphology of a particular carbide was found to change with composition. However, neither amount nor morphology could be correlated to microhardness or wear test results. Predictive equations based on powder composition were obtained which fit the wear test results very well.

  20. Steam Oxidation of FeCrAl and SiC in the Severe Accident Test Station (SATS)

    SciTech Connect (OSTI)

    Pint, Bruce A.; Unocic, Kinga A.; Terrani, Kurt A.

    2015-08-01

    Numerous research projects are directed towards developing accident tolerant fuel (ATF) concepts that will enhance safety margins in light water reactors (LWR) during severe accident scenarios. In the U.S. program, the high temperature steam oxidation performance of ATF solutions has been evaluated in the Severe Accident Test Station (SATS) at Oak Ridge National Laboratory (ORNL) since 2012 [1-3] and this facility continues to support those efforts in the ATF community. Compared to the current UO2/Zr-based alloy fuel system, alternative cladding materials can offer slower oxidation kinetics and a smaller enthalpy of oxidation that can significantly reduce the rate of heat and hydrogen generation in the core during a coolant-limited severe accident [4-5]. Thus, steam oxidation behavior is a key aspect of the evaluation of ATF concepts. This report summarizes recent work to measure steam oxidation kinetics of FeCrAl and SiC specimens in the SATS.

  1. Microstructure investigation of 13Cr-2Mo ODS steel components obtained by high voltage electric discharge compaction technique

    SciTech Connect (OSTI)

    Bogachev, Igor; Yudin, Artem; Grigoryev, Evgeniy; Chernov, Ivan; Staltsov, Maxim; Khasanov, Oleg; Olevsky, Eugene

    2015-11-02

    Refractory oxide dispersion strengthened 13Cr-2Mo steel powder was successfully consolidated to near theoretical density using high voltage electric discharge compaction. Cylindrical samples with relative density from 90% to 97% and dimensions of 10 mm in diameter and 10–15 mm in height were obtained. Consolidation conditions such as pressure and voltage were varied in some ranges to determine the optimal compaction regime. Three different concentrations of yttria were used to identify its effect on the properties of the samples. It is shown that the utilized ultra-rapid consolidation process in combination with high transmitted energy allows obtaining high density compacts, retaining the initial structure with minimal grain growth. The experimental results indicate some heterogeneity of the structure which may occur in the external layers of the tested samples due to various thermal and electromagnetic in-processing effects. As a result, the choice of the optimal parameters of the consolidation enables obtaining samples of acceptable quality.

  2. Experimental and Numerical Analysis on the Distortion of Parts Made of 20MnCr5 by Hot Metal Forming

    SciTech Connect (OSTI)

    Rentsch, Ruediger; Brinksmeier, Ekkard [Stiftung Institut fuer Werkstofftechnik, Badgasteiner Strasse 3, 28359 Bremen (Germany)

    2011-05-04

    For high performance applications, shafts and gears made of 20MnCr5 (AISI 5120) are manufactured in large numbers every year. Inhomogeneities in the material properties, process perturbations and asymmetries in shape and operation setups provide a potential for the distortion of parts, often released by heat treatment. In this contribution experimental results on the distortion of shafts and the dishing of disk-like gear wheel blanks are presented. The numerical analysis of the hot-rolling process allowed to trace a peculiar segregation distribution at the cross-section of the bars back to the casting process, and to identify an asymmetric strain distribution which may be the main cause for shaft distortion. For the dishing of the disks a correlation to the resulting distribution of the material flow was found and, a process perturbation parameter identified which is assumed to be responsible for the observed material flow variation.

  3. Cross sections and differential spectra for reactions of 2-20 MeV neutrons on /sup nat/Cr

    SciTech Connect (OSTI)

    Blann, M.; Komoto, T.T.

    1988-01-01

    This report summarizes product yields, secondary n,p and ..cap alpha.. spectra, and ..gamma..-ray spectra calculated for incident neutrons of 2 to 20 MeV on /sup nat/Cr targets. Results are all from the code ALICE, using the version ALISO which does weighting of results for targets which are a mix of isotopes. Where natural isotopic targets are involved, yields and n,p,..cap alpha.. spectra will be reported weighted over isotopic yields. Gamma-ray spectra, however, will be reported for the most abundant isotope. We present product yields versus incident neutron energy, n,p,..cap alpha.. spectra versus incident neutron energy, and calculated ..gamma..-ray spectra.

  4. Magnetoelectric switching of perpendicular exchange bias in Pt/Co/?-Cr{sub 2}O{sub 3}/Pt stacked films

    SciTech Connect (OSTI)

    Toyoki, Kentaro; Shiratsuchi, Yu Kobane, Atsushi; Nakatani, Ryoichi; Mitsumata, Chiharu; Kotani, Yoshinori; Nakamura, Tetsuya

    2015-04-20

    We report the realization of magnetoelectric switching of the perpendicular exchange bias in Pt/Co/?-Cr{sub 2}O{sub 3}/Pt stacked films. The perpendicular exchange bias was switched isothermally by the simultaneous application of magnetic and electric fields. The threshold electric field required to switch the perpendicular exchange bias was found to be inversely proportional to the magnetic field, which confirmed the magnetoelectric mechanism of the process. The observed temperature dependence of the threshold electric field suggested that the energy barrier of the antiferromagnetic spin reversal was significantly lower than that assuming the coherent rotation. Pulse voltage measurements indicated that the antiferromagnetic domain propagation dominates the switching process. These results suggest an analogy of the electric-field-induced magnetization with a simple ferromagnet.

  5. Antisite Defects in Layered Multiferroic CuCr0.9In0.1P2S6

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    He, Qian; Belianinov, Alex; Dziaugys, Andrius; Maksymovych, Petro; Vysochanskii, Yulian; Kalinin, Sergei V.; Borisevich, Albina Y.

    2015-10-06

    The CuCr1-xInxP2S6 system represents a large family of metal chalcogenophosphates that are unique and promising candidates for 2D materials with functionalities such as ferroelectricity. We carried out detailed microstructural and chemical characterization of these compounds using aberration-corrected STEM, in order to understand the origin of these different ordering phenomena. Quantitative STEM-HAADF imaging and analysis identified the stacking order of an 8-layer thin flake, which leads to the identification of anti-site In3+(Cu+) doping. We believe that these findings will pave the way towards understanding the ferroic coupling phenomena in van der Waals lamellar compounds, as well as the potential applications inmore » 2-D electronics.« less

  6. Effects of varying CoCrV seed layer deposition pressure on Ru crystallinity in perpendicular magnetic recording media

    SciTech Connect (OSTI)

    Joost, W. [Heraeus Materials Technology, Chandler, Arizona 85226 (United States); School of Materials, Arizona State University, Tempe, Arizona 85287 (United States); Das, A. [Heraeus Materials Technology, Chandler, Arizona 85226 (United States); Alford, T. L. [School of Materials, Arizona State University, Tempe, Arizona 85287 (United States)

    2009-10-01

    The effects of varying deposition parameters of a CoCrV seed layer under Ru on the structural and interfacial properties of both layers were studied. While sputtering power showed little effect on film structure, sputtering pressure during deposition of the seed layer had a significant effect on the structural properties of the seed layer. In particular, the grain morphology and crystallinity of the seed layer varied considerably with deposition pressure. Deposition of Ru using a constant recipe for all samples demonstrated the effect of varying seed layer deposition pressure on the Ru layer. The strain energy of the Ru film, a measurement of contraction due to the registry with the seed layer, was greatest at moderate seed layer sputtering pressures, while the Ru(0002) peak area was greatest at low sputtering pressures. The competing contributions of interfacial energy and strain energy describe this effect, with interfacial energy dominating at low sputtering pressures.

  7. Thermally activated dislocation creep model for primary water stress corrosion cracking of NiCrFe alloys

    SciTech Connect (OSTI)

    Hall, M.M., Jr

    1995-12-31

    There is a growing awareness that awareness that environmentally assisted creep plays an important role in integranular stress corrosion cracking (IGSCC) of NiCrFe alloys in the primary coolant water environment of a pressurized water reactor (PWR). The expected creep mechanism is the thermally activated glide of dislocations. This mode of deformation is favored by the relatively low temperature of PWR operation combined with the large residual stresses that are most often identified as responsible for the SCC failure of plant components. Stress corrosion crack growth rate (CGR) equations that properly reflect the influence of this mechanism of crack tip deformation are required for accurate component life predictions. A phenomenological IGSCC-CGR model, which is based on an apriori assumption that the IGSCC-CGR is controlled by a low temperature dislocation creep mechanism, is developed in this report. Obstacles to dislocation creep include solute atoms such as carbon, which increase the lattice friction force, and forest dislocations, which can be introduced by cold prestrain. Dislocation creep also may be environmentally assisted due to hydrogen absorption at the crack tip. The IGSCC-CGR model developed here is based on an assumption that crack growth occurs by repeated fracture events occurring within an advancing crack-tip creep-fracture zone. Thermal activation parameters for stress corrosion cracking are obtained by fitting the CGR model to IGSCC-CGR data obtained on NiCrFe alloys, Alloy X-750 and Alloy 600. These IGSCC-CGR activation parameters are compared to activation parameters obtained from creep and stress relaxation tests. Recently reported CGR data, which exhibit an activation energy that depends on yield stress and the applied stress intensity factor, are used to benchmark the model. Finally, the effects of matrix carbon concentration, grain boundary carbides and absorbed hydrogen concentration are discussed within context of the model.

  8. The Impacts of Cation Stoichiometry and Substrate Surface Quality on Nucleation, Structure, Defect Formation, and Intermixing in Complex Oxide HeteroepitaxyLaCrO3 on SrTiO3(001)

    SciTech Connect (OSTI)

    Qiao, Liang; Zhang, Hongliang; Bowden, Mark E.; Varga, Tamas; Shutthanandan, V.; Colby, Robert J.; Du, Yingge; Kabius, Bernd C.; Sushko, P. V.; Biegalski, Michael D.; Chambers, Scott A.

    2013-06-20

    Our ability to design and fabricate electronic devices with reproducible properties using complex oxides is critically dependent on our ability to controllably synthesize these materials in thin-film form. Structure-property relationships are intimately tied to film and interface composition. Here we report on the effects of cation stoichiometry in LaCrO3 heteroepitaxial films prepared using molecular beam epitaxy. We show that LaCrO3 films grow pseudomorphically on SrTiO3(001) over an wide range of La-to-Cr atom ratios. However, the growth mode and structural quality are sensitive to the La-to-Cr ratio, with La-rich films being of considerably lower structural quality than Cr-rich films. Cation mixing occurs at the interface for all La-to-Cr ratios investigated, and is not quenched by deposition at ambient temperature. Indiffused La atoms occupy Sr sites in the substrate. The presence of defects in the SrTiO3 substrate is implicated in promoting La indiffusion by comparing the properties of LaCrO3/SrTiO3 with those of LaCrO3/Si, both prepared at ambient temperature. Additionally, pulsed laser deposition is shown to result in more extensive interfacial mixing than molecular beam epitaxy for deposition at ambient temperature on Si.

  9. Computational discovery of ferromagnetic semiconducting single-layer CrSnTe3

    SciTech Connect (OSTI)

    Zhuang, Houlong L.; Xie, Yu; Kent, P. R. C.; Ganesh, P.

    2015-07-06

    Despite many single-layer materials being reported in the past decade, few of them exhibit magnetism. Here we perform first-principles calculations using accurate hybrid density functional methods (HSE06) to predict that single-layer CrSnTe3 (CST) is a ferromagnetic semiconductor, with band gaps of 0.9 and 1.2 eV for the majority and minority spin channels, respectively. We determine the Curie temperature as 170 K, significantly higher than that of single-layer CrSiTe3 (90K) and CrGeTe3 (130 K). This is due to the enhanced ionicity of the Sn-Te bond, which in turn increases the superexchange coupling between the magnetic Cr atoms. We further explore the mechanical and dynamical stability and strain response of this single-layer material for possible epitaxial growth. Lastly, our study provides an intuitive approach to understand and design novel single-layer magnetic semiconductors for a wide range of spintronics and energy applications.

  10. Element- and charge-state-resolved ion energies in the cathodic arc plasma from composite AlCr cathodes in argon, nitrogen and oxygen atmospheres

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Franz, Robert; Polcik, Peter; Anders, André

    2015-06-01

    The energy distribution functions of ions in the cathodic arc plasma using composite AlCr cathodes were measured as a function of the background gas pressure in the range 0.5 to 3.5 Pa for different cathode compositions and gas atmospheres. The most abundant aluminium ions were Al+ regardless of the background gas species, whereas Cr2+ ions were dominating in Ar and N2 and Cr+ in O2 atmospheres. The energy distributions of the aluminium and chromium ions typically consisted of a high-energy fraction due to acceleration in the expanding plasma plume from the cathode spot and thermalised ions that were subjected tomore » collisions in the plasma cloud. The fraction of the latter increased with increasing background gas pressure. Atomic nitrogen and oxygen ions showed similar energy distributions as the aluminium and chromium ions, whereas the argon and molecular nitrogen and oxygen ions were formed at greater distance from the cathode spot and thus less subject to accelerating gradients. In addition to the positively charged metal and gas ions, negatively charged oxygen and oxygen-containing ions were observed in O2 atmosphere. The obtained results are intended to provide a comprehensive overview of the ion energies and charge states in the arc plasma of AlCr composite cathodes in different gas atmospheres as such plasmas are frequently used to deposit thin films and coatings.« less

  11. Band-Gap Reduction and Dopant Interaction in Epitaxial La,Cr Co-doped SrTiO3 Thin Films

    SciTech Connect (OSTI)

    Comes, Ryan B.; Sushko, Petr; Heald, Steve M.; Colby, Robert J.; Bowden, Mark E.; Chambers, Scott A.

    2014-12-03

    We show that by co-doping SrTiO3 (STO) epitaxial thin films with equal amounts of La and Cr it is possible to produce films with an optical band gap ~0.9 eV lower than that of undoped STO. Sr1-xLaxTi1-xCrxO3 thin films were deposited by molecular beam epitaxy and characterized using x-ray photoelectron spectroscopy and x-ray absorption near-edge spectroscopy to show that the Cr dopants are almost exclusively in the Cr3+ oxidation state. Extended x-ray absorption fine structure measurements and theoretical modeling suggest that it is thermodynamically preferred for La and Cr dopants to occupy nearest neighbor A- and B-sites in the lattice. Transport measurements show that the material exhibits variable-range hopping conductivity with high resistivity. These results create new opportunities for the use of doped STO films in photovoltaic and photocatalytic applications.

  12. Element- and charge-state-resolved ion energies in the cathodic arc plasma from composite AlCr cathodes in argon, nitrogen and oxygen atmospheres

    SciTech Connect (OSTI)

    Franz, Robert; Polcik, Peter; Anders, Andr

    2015-06-01

    The energy distribution functions of ions in the cathodic arc plasma using composite AlCr cathodes were measured as a function of the background gas pressure in the range 0.5 to 3.5 Pa for different cathode compositions and gas atmospheres. The most abundant aluminium ions were Al+ regardless of the background gas species, whereas Cr2+ ions were dominating in Ar and N2 and Cr+ in O2 atmospheres. The energy distributions of the aluminium and chromium ions typically consisted of a high-energy fraction due to acceleration in the expanding plasma plume from the cathode spot and thermalised ions that were subjected to collisions in the plasma cloud. The fraction of the latter increased with increasing background gas pressure. Atomic nitrogen and oxygen ions showed similar energy distributions as the aluminium and chromium ions, whereas the argon and molecular nitrogen and oxygen ions were formed at greater distance from the cathode spot and thus less subject to accelerating gradients. In addition to the positively charged metal and gas ions, negatively charged oxygen and oxygen-containing ions were observed in O2 atmosphere. The obtained results are intended to provide a comprehensive overview of the ion energies and charge states in the arc plasma of AlCr composite cathodes in different gas atmospheres as such plasmas are frequently used to deposit thin films and coatings.

  13. Magnetic properties of CuFe{sub 1−x}Cr{sub x}O{sub 2} nanoparticles surrounded by amorphous SiO{sub 2}

    SciTech Connect (OSTI)

    Mori, K.; Hachisu, M.; Yamazaki, T.; Ichiyanagi, Y.

    2015-05-07

    CuFe{sub 1−x}Cr{sub x}O{sub 2} (0 ≤ x ≤ 1.0) nanoparticles surrounded by amorphous SiO{sub 2} with an average diameter of 30–50 nm were synthesized using a wet chemical method. The annealing temperatures were controlled to yield various sizes of single-phase CuFe{sub 1−x}Cr{sub x}O{sub 2} nanoparticles. CuFeO{sub 2} bulk crystal is known to have a multiferroic delafossite structure with two Néel temperatures of 11 and 14 K; however, the transition temperature shifted higher as the Cr–ion doping level increased. In addition, the lattice constants decreased in accordance with increased Cr-ion doping, which was confirmed by X-ray diffraction measurements. The magnetization curves showed weak ferromagnetic behavior and no coercivity was observed. Hence, frustration in the triangular lattice of the delafossite structure can be released by Cr–ion doping and higher magnetization can be expected. A fine structure analysis through X-ray absorption fine structure measurements was also conducted. It was found that the structure of the Cu ion is similar to that of Cu{sub 2}O, and the c axis of the CuFe{sub 1−x}Cr{sub x}O{sub 2} should be shortened by the Cr–ion doping.

  14. Cr-free Fe-based metal oxide catalysts for high temperature water gas shift reaction of fuel processor using LPG

    SciTech Connect (OSTI)

    lee, Joon Y.; Lee, Dae-Won; Lee, Kwan Young; Wang, Yong

    2009-08-15

    The goal of this study was to identify the most suitable chromium-free iron-based catalysts for the HTS (high temperature shift) reaction of a fuel processor using LPG. Hexavalent chromium (Cr6+) in the commercial HTS catalyst has been regarded as hazardous material. We selected Ni and Co as the substitution for chromium in the Fe-based HTS catalyst and investigated the HTS activities of these Crfree catalysts at LPG reformate condition. Cr-free Fe-based catalysts which contain Ni, Zn, or Co instead of Cr were prepared by coprecipitation method and the performance of the catalysts in HTS was evaluated under gas mixture conditions (42% H2, 10% CO, 37% H2O, 8% CO2, and 3% CH4; R (reduction factor): about 1.2) similar to the gases from steam reforming of LPG (100% conversion at steam/carbon ratio = 3), which is higher than R (under 1) of typically studied LNG reformate condition. Among the prepared Cr-free Febased catalysts, the 5 wt%-Co/Fe/20 wt%-Ni and 5 wt%-Zn/Fe/20 wt%-Ni catalysts showed good catalytic activity under this reaction condition simulating LPG reformate gas.

  15. Empirical assessment of the detection efficiency of CR-39 at high proton fluence and a compact, proton detector for high-fluence applications

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Rosenberg, M. J.; Séguin, F. H.; Waugh, C. J.; Rinderknecht, H. G.; Orozco, D.; Frenje, J. A.; Johnson, M. Gatu; Sio, H.; Zylstra, A. B.; Sinenian, N.; et al

    2014-04-14

    CR-39 solid-state nuclear track detectors are widely used in physics and in many inertial confinement fusion (ICF) experiments, and under ideal conditions these detectors have 100% detection efficiency for ~0.5–8 MeV protons. When the fluence of incident particles becomes too high, the overlap of particle tracks leads to under-counting at typical processing conditions (5h etch in 6N NaOH at 80°C). Short etch times required to avoid overlap can cause under-counting as well, as tracks are not fully developed. Experiments have determined the minimum etch times for 100% detection of 1.7–4.3-MeV protons and established that for 2.4-MeV protons, relevant for detectionmore » of DD protons, the maximum fluence that can be detected using normal processing techniques is ≲3 ×106 cm-2. A CR-39-based proton detector has been developed to mitigate issues related to high particle fluences on ICF facilities. Using a pinhole and scattering foil several mm in front of the CR-39, proton fluences at the CR-39 are reduced by more than a factor of ~50, increasing the operating yield upper limit by a comparable amount.« less

  16. A ferromagnetic quantum critical point in heavy-fermion iron oxypnictide CeFe{sub 1?x}Cr{sub x}PO

    SciTech Connect (OSTI)

    Okano, T.; Matoba, M.; Kamihara, Y.; Kitao, S.; Seto, M.; Atou, T.; Itoh, M.

    2015-05-07

    We report crystallographic and magnetic properties of layered iron oxypnictide CeFe{sub 1?x}Cr{sub x}PO (x?=?0.0000.692). Interlayer distances between Ce{sub 2}O{sub 2} and (Fe{sub 1?x}Cr{sub x}){sub 2}P{sub 2} layers increase as a function of x, suggesting suppression of Kondo coupling among hybridized conducting orbitals and localized Ce 4f orbitals. CeFe{sub 1?x}Cr{sub x}PO (x?=?0.1000.384) exhibits finite ferromagnetic transition temperatures (T{sub curie}) obtained by Arrott plots, although {sup 57}Fe Mssbauer spectra reveal paramagnetic Fe sublattice at T???4.2?K. These results indicate that the ferromagnetic phase transitions of samples are mainly due to Ce sublattice. For the samples with x???0.500, no ferromagnetic order is observed down to 2?K. These results verify that ferromagnetic quantum critical points of CeFe{sub 1?x}Cr{sub x}PO appear at 0.045???x???0.100 and 0.384???x???0.500.

  17. Anisotropy reversal of the upper critical field at low temperatures and spin-locked superconductivity in K2Cr3As3

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Balakirev, F. F.; Kong, T.; Jaime, M.; McDonald, R. D.; Mielke, C. H.; Gurevich, A.; Canfield, P. C.; Bud'ko, S. L.

    2015-06-23

    We report measurements of the anisotropic upper critical field Hc2(T) for K2Cr3As3 single crystals up to 60 T and T>0.6K. Our results show that the upper critical field parallel to the Cr chains, H∥c2(T), exhibits a paramagnetically limited behavior, whereas the shape of the H⊥c2(T) curve (perpendicular to the Cr chains) has no evidence of paramagnetic effects. As a result, the curves H⊥c2(T) and H∥c2(T) cross at T≈4K, so that the anisotropy parameter γH(T)=H⊥c2/H∥c2(T)increases from γH(Tc)≈0.35 near Tc to γH(0)≈1.7 at 0.6 K. This behavior of H∥c2(T) is inconsistent with triplet superconductivity but suggests a form of singlet superconductivity withmore » the electron spins locked onto the direction of Cr chains.« less

  18. Empirical assessment of the detection efficiency of CR-39 at high proton fluence and a compact, proton detector for high-fluence applications

    SciTech Connect (OSTI)

    Rosenberg, M. J. Séguin, F. H.; Waugh, C. J.; Rinderknecht, H. G.; Orozco, D.; Frenje, J. A.; Johnson, M. Gatu; Sio, H.; Zylstra, A. B.; Sinenian, N.; Li, C. K.; Petrasso, R. D.; Glebov, V. Yu.; Stoeckl, C.; Hohenberger, M.; Sangster, T. C.; LePape, S.; Mackinnon, A. J.; Bionta, R. M.; Landen, O. L.; and others

    2014-04-15

    CR-39 solid-state nuclear track detectors are widely used in physics and in many inertial confinement fusion (ICF) experiments, and under ideal conditions these detectors have 100% detection efficiency for ∼0.5–8 MeV protons. When the fluence of incident particles becomes too high, overlap of particle tracks leads to under-counting at typical processing conditions (5 h etch in 6N NaOH at 80 °C). Short etch times required to avoid overlap can cause under-counting as well, as tracks are not fully developed. Experiments have determined the minimum etch times for 100% detection of 1.7–4.3-MeV protons and established that for 2.4-MeV protons, relevant for detection of DD protons, the maximum fluence that can be detected using normal processing techniques is ≲3 × 10{sup 6} cm{sup −2}. A CR-39-based proton detector has been developed to mitigate issues related to high particle fluences on ICF facilities. Using a pinhole and scattering foil several mm in front of the CR-39, proton fluences at the CR-39 are reduced by more than a factor of ∼50, increasing the operating yield upper limit by a comparable amount.

  19. Empirical assessment of the detection efficiency of CR-39 at high proton fluence and a compact, proton detector for high-fluence applications

    SciTech Connect (OSTI)

    Rosenberg, M. J.; Seguin, F. H.; Waugh, C. J.; Rinderknecht, H. G.; Orozco, D.; Frenje, J. A.; Gatu Johnson, M.; Sio, H.; Zylstra, A. B.; Sinenian, N.; Li, C. K.; Petrasso, R. D.; Glebov, V. Yu.; Stoeckl, C.; Hohenberger, M.; Sangster, T. C.; LePape, S.; Mackinnon, A. J.; Bionta, R. M.; Landen, O. L.; Zacharias, R. A.; Kim, Y.; Herrmann, H. W.; Kilkenny, J. D.

    2014-04-01

    CR-39 solid-state nuclear track detectors are widely used in physics and in many inertial confinement fusion (ICF) experiments, and under ideal conditions these detectors have 100% detection efficiency for ~0.58 MeV protons. When the fluence of incident particles becomes too high, overlap of particle tracks leads to under-counting at typical processing conditions (5 h etch in 6N NaOH at 80 C). Short etch times required to avoid overlap can cause under-counting as well, as tracks are not fully developed. Experiments have determined the minimum etch times for 100% detection of 1.74.3-MeV protons and established that for 2.4-MeV protons, relevant for detection of DD protons, the maximum fluence that can be detected using normal processing techniques is ?3 106 cm-2. A CR-39-based proton detector has been developed to mitigate issues related to high particle fluences on ICF facilities. Using a pinhole and scattering foil several mm in front of the CR-39, proton fluences at the CR-39 are reduced by more than a factor of ~50, increasing the operating yield upper limit by a comparable amount.

  20. Effect of Water Vapor on the 1100oC Oxidation Behavior of Plasma-Sprayed TBCs with HVOF NiCoCrAlX Bond Coatings

    SciTech Connect (OSTI)

    Haynes, James A; Unocic, Kinga A; Pint, Bruce A

    2013-01-01

    With the goal of investigating the reported detrimental effect of water vapor on thermal barrier coating (TBC) performance, furnace cycle experiments were conducted in dry O2 and air with 10 and 50% water vapor at 1100 C. The TBC systems evaluated were air plasma-sprayed (APS), yttria-stabilized zirconia (YSZ) top coatings with high velocity oxy fuel (HVOF)-deposited NiCoCrAlY or NiCoCrAlYHfSi bond coating. Average TBC lifetime was reduced by ~30% in air with 10% water vapor compared to cycling in dry O2, using 1h cycle durations. Superalloy substrates with Y and La additions also were investigated but showed no statistical change in the average TBC lifetime compared to the base CMSX4 superalloy. In all cases, the bond coating with Hf and Si additions increased YSZ lifetime by 20% or more. Experiments that increased water vapor to 50% showed no further decrease in TBC lifetime. Increasing the cycle frequency to 100h resulted in a large increase in TBC lifetime, especially for the NiCoCrAlYHfSi bond coatings. Co-doping the NiCoCrAl bond coat with Y and Hf was beneficial to TBC lifetime, but did not mitigate the detrimental impact of water vapor.

  1. Magnetic and low temperature phonon studies of CoCr{sub 2}O{sub 4} powders doped with Fe(III) and Ni(II) ions

    SciTech Connect (OSTI)

    Ptak, M. Mączka, M.; Pikul, A.; Tomaszewski, P.E.; Hanuza, J.

    2014-04-01

    Extensive temperature-dependent phonon studies and low-temperature magnetic measurements of CoCr{sub 2−x}Fe{sub x}O{sub 4} (for x=0.5, 1 and 2) and Co{sub 0.9}Ni{sub 0.1}Cr{sub 2}O{sub 4} polycrystalline powders are presented. The main aim of these studies was to obtain information on phonon and structural properties of these compounds as well as strength of spin–phonon coupling in the magnetically ordered phases. IR and Raman spectra show that doping of CoCr{sub 2}O{sub 4} with Fe(III) ions leads to broadening of bands and appearance of new bands due to the formation of inverted spinel structure. In contrast to this behavior, doping with 10 mol% of Ni(II) ions leads to weak increase of band width only. Magnetization measured as a function of temperature and external magnetic field showed that magnetic properties of Co{sub 0.9}Ni{sub 0.1}Cr{sub 2}O{sub 4} sample are similar to those reported for pure CoCr{sub 2}O{sub 4}, i.e., partial substitution of Ni(II) for Co(II) leads to slight shift of the ferrimagnetic phase transition at T{sub C} and spiral spin order transition at T{sub S} towards lower values. The change of crystallization preference induced by incorporation of increasing concentration of Fe(III) ions in the spinel lattice causes significant increase of T{sub C} and decrease of T{sub S}. The latter transition disappears completely for higher concentrations of Fe(III). The performed temperature-dependent IR studies revealed interesting anomalous behavior of phonons below T{sub C} for CoCr{sub 1.5}Fe{sub 0.5}O{sub 4} and Co{sub 0.9}Ni{sub 0.1}Cr{sub 2}O{sub 4}, which was attributed to spin–phonon coupling. - Graphical abstract: Visualization of normal spinel-type AB{sub 2}O{sub 4} structure, where blue octahedrons denote BO{sub 6} and red tetrahedrons AO{sub 4} units as well as IR and Raman spectra of Co{sub 0.9}Ni{sub 0.1}Cr{sub 2}O{sub 4} powder. - Highlights: • T{sub C} (T{sub S}) increases (decreases) with increasing Fe(III) concentration. • Ni(II) ions doping up to 10 mol% does not change remarkably T{sub C} and T{sub S}. • Doping with Fe(III) ions causes increase of spinel inversion parameter. • Spin–phonon interactions in Co{sub 0.9}Ni{sub 0.1}Cr{sub 2}O{sub 4} and CoCr{sub 1.5}Fe{sub 0.5}O{sub 4} were evidenced.

  2. Use of InSpector{sup TM} 1 1000 Instrument with LaBr{sub 3} for Nuclear Criticality Safety (NCS) Applications at the Westinghouse Hematite Decommissioning Project (HDP) - 13132

    SciTech Connect (OSTI)

    Pritchard, Megan; Guido, Joe

    2013-07-01

    The Westinghouse Hematite Decommissioning Project (HDP) is a former nuclear fuel cycle facility that is currently undergoing decommissioning. One aspect of the decommissioning scope is remediation of buried nuclear waste in unlined burial pits. The current Nuclear Criticality Safety program relies on application of criticality controls based on radiological setpoints from a 2 x 2 Sodium Iodide (NaI) detector. Because of the nature of the material buried (Low Enriched Uranium (LEU), depleted uranium, thorium, and radium) and the stringent threshold for application of criticality controls based on waste management (0.1 g {sup 235}U/L), a better method for {sup 235}U identification and quantification has been developed. This paper outlines the early stages of a quick, in-field nuclear material assay and {sup 235}U mass estimation process currently being deployed at HDP. Nuclear material initially classified such that NCS controls are necessary can be demonstrated not to require such controls and dispositioned as desired by project operations. Using Monte Carlo techniques and a high resolution Lanthanum Bromide (LaBr) detector with portable Multi-Channel Analyzer (MCA), a bounding {sup 235}U mass is assigned to basic geometries of nuclear material as it is excavated. The deployment of these methods and techniques has saved large amounts of time and money in the nuclear material remediation process. (authors)

  3. Compositional analysis and depth profiling of thin film CrO{sub 2} by heavy ion ERDA and standard RBS: a comparison

    SciTech Connect (OSTI)

    Khamlich, S.; Msimanga, M.; Pineda-Vargas, C.A.; Nuru, Z.Y.; McCrindle, R.; Maaza, M.

    2012-08-15

    Chromium dioxide (CrO{sub 2}) thin film has generated considerable interest in applied research due to the wide variety of its technological applications. It has been extensively investigated in recent years, attracting the attention of researchers working on spintronic heterostructures and in the magnetic recording industry. However, its synthesis is usually a difficult task due to its metastable nature and various synthesis techniques are being investigated. In this work a polycrystalline thin film of CrO{sub 2} was prepared by electron beam vaporization of Cr{sub 2}O{sub 3} onto a Si substrate. The polycrystalline structure was confirmed through XRD analysis. The stoichiometry and elemental depth distribution of the deposited film were measured by ion beam nuclear analytical techniques heavy ion elastic recoil detection analysis (ERDA) and Rutherford backscattering spectrometry (RBS), which both have relative advantage over non-nuclear spectrometries in that they can readily provide quantitative information about the concentration and distribution of different atomic species in a layer. Moreover, the analysis carried out highlights the importance of complementary usage of the two techniques to obtain a more complete description of elemental content and depth distribution in thin films. - Graphical abstract: Heavy ion elastic recoil detection analysis (ERDA) and Rutherford backscattering spectrometry (RBS) both have relative advantage over non-nuclear spectrometries in that they can readily provide quantitative information about the concentration and distribution of different atomic species in a layer. Highlights: Black-Right-Pointing-Pointer Thin films of CrO{sub 2} have been grown by e-beam evaporation of Cr{sub 2}O{sub 3} target in vacuum. Black-Right-Pointing-Pointer The composition was determined by heavy ion-ERDA and RBS. Black-Right-Pointing-Pointer HI-ERDA and RBS provided information on the light and heavy elements, respectively.

  4. Role of structural factors in formation of chiral magnetic soliton lattice in Cr{sub 1/3}NbS?

    SciTech Connect (OSTI)

    Volkova, L. M.; Marinin, D. V.

    2014-10-07

    The sign and strength of magnetic interactions not only between nearest neighbors, but also for longer-range neighbors in the Cr{sub 1/3}NbS? intercalation compound have been calculated on the basis of structural data. It has been found that left-handed spin helices in Cr{sub 1/3}NbS? are formed from strength-dominant at low temperatures antiferromagnetic (AFM) interactions between triangular planes of Cr? ions through the plane of just one of two crystallographically equivalent diagonals of side faces of embedded into each other trigonal prisms building up the crystal lattice of magnetic Cr? ions. These helices are oriented along the c axis and packed into two-dimensional triangular lattices in planes perpendicular to these helices directions and lay one upon each other with a displacement. The competition of the above AFM helices with weaker inter-helix AFM interactions could promote the emergence of a long-period helical spin structure. One can assume that in this case, the role of Dzyaloshinskii-Moriya interaction consists of final ordering and stabilization of chiral spin helices into a chiral magnetic soliton lattice. The possibility of emergence of solitons in M{sub 1/3}NbX{sub 2} and M{sub 1/3}TaX? (M = Cr, V, Ti, Rh, Ni, Co, Fe, and Mn; X = S and Se) intercalate compounds has been examined. Two important factors caused by the crystal structure (predominant chiral magnetic helices and their competition with weaker inter-helix interactions not destructing the system quasi-one-dimensional character) can be used for the crystal chemistry search of solitons.

  5. Large Scale DD Simulation Results for Crystal Plasticity Parameters in Fe-Cr And Fe-Ni Systems

    SciTech Connect (OSTI)

    Zbib, Hussein M.; Li, Dongsheng; Sun, Xin; Khaleel, Mohammad A.

    2012-04-30

    The development of viable nuclear energy source depends on ensuring structural materials integrity. Structural materials in nuclear reactors will operate in harsh radiation conditions coupled with high level hydrogen and helium production, as well as formation of high density of point defects and defect clusters, and thus will experience severe degradation of mechanical properties. Therefore, the main objective of this work is to develop a capability that predicts aging behavior and in-service lifetime of nuclear reactor components and, thus provide an instrumental tool for tailoring materials design and development for application in future nuclear reactor technologies. Towards this end goal, the long term effort is to develop a physically based multiscale modeling hierarchy, validated and verified, to address outstanding questions regarding the effects of irradiation on materials microstructure and mechanical properties during extended service in the fission and fusion environments. The focus of the current investigation is on modern steels for use in nuclear reactors including high strength ferritic-martensitic steels (Fe-Cr-Ni alloys). The effort is to develop a predicative capability for the influence of irradiation on mechanical behavior. Irradiation hardening is related to structural information crossing different length scales, such as composition, dislocation, and crystal orientation distribution. To predict effective hardening, the influence factors along different length scales should be considered. Therefore, a hierarchical upscaling methodology is implemented in this work in which relevant information is passed between models at three scales, namely, from molecular dynamics to dislocation dynamics to dislocation-based crystal plasticity. The molecular dynamics (MD) was used to predict the dislocation mobility in body centered cubic (bcc) Fe and its Ni and Cr alloys. The results are then passed on to dislocation dynamics to predict the critical resolved shear stress (CRSS) from the evolution of local dislocation and defects. In this report the focus is on the results obtained from large scale dislocation dynamics simulations. The effect of defect density, materials structure was investigated, and evolution laws are obtained. These results will form the bases for the development of evolution and hardening laws for a dislocation-based crystal plasticity framework. The hierarchical upscaling method being developed in this project can provide a guidance tool to evaluate performance of structural materials for next-generation nuclear reactors. Combined with other tools developed in the Nuclear Energy Advanced Modeling and Simulation (NEAMS) program, the models developed will have more impact in improving the reliability of current reactors and affordability of new reactors.

  6. Microsoft Word - S05212_2008 Post-Closure InspRpt.doc

    Office of Legacy Management (LM)

    ... B.R. Anderson Pond Lower Little Cr. 1 Lower Little Cr. 2 James Lowe Pond Nobles Pond Howard Smith Pond Figure 7. Tritium Decay Trend and Off-Site Surface Water Sample ...

  7. Evaluation of ferritic alloy Fe-2-1/4Cr-1Mo after neutron irradiation - microstructure development

    SciTech Connect (OSTI)

    Gelles, D.S.

    1984-05-01

    Microstructural examinations are reported for nine specimen conditions of 2-1/4Cr-1Mo steel which had been irradiated by fast neutrons over the temperature range 390 to 510/sup 0/C. Two heats of material were involved, each with a different preirradiation heat treatment, one irradiated to a peak fluence of 5.1 x 10/sup 22/ n/cm/sup 2/ (E > 0.1 MeV) or 24 dpa and the other to 2.4 x 10/sup 23/ n/cm/sup 2/ (E > 0.1 MeV) or 116 dpa. Void swelling is found following irradiation at 400/sup 0/C in both conditions and to 480/sup 0/C in the higher fluence conditions. Concurrently dislocation structure and precipitation formed. Peak void swelling, void density, dislocation density and precipitate number density developed at the lowest temperature, approx. 400/sup 0/C, whereas mean void size, and mean precipitate size increased with increasing irradiation temperature. The examination results are used to provide interpretation of in-reactor creep, density change and post irradiation tensile behavior.

  8. Application of the NUREG/CR-6850 EPRI/NRC Fire PRA Methodology to a DOE Facility

    SciTech Connect (OSTI)

    Tom Elicson; Bentley Harwood; Richard Yorg; Heather Lucek; Jim Bouchard; Ray Jukkola; Duan Phan

    2011-03-01

    The application NUREG/CR-6850 EPRI/NRC fire PRA methodology to DOE facility presented several challenges. This paper documents the process and discusses several insights gained during development of the fire PRA. A brief review of the tasks performed is provided with particular focus on the following: • Tasks 5 and 14: Fire-induced risk model and fire risk quantification. A key lesson learned was to begin model development and quantification as early as possible in the project using screening values and simplified modeling if necessary. • Tasks 3 and 9: Fire PRA cable selection and detailed circuit failure analysis. In retrospect, it would have been beneficial to perform the model development and quantification in 2 phases with detailed circuit analysis applied during phase 2. This would have allowed for development of a robust model and quantification earlier in the project and would have provided insights into where to focus the detailed circuit analysis efforts. • Tasks 8 and 11: Scoping fire modeling and detailed fire modeling. More focus should be placed on detailed fire modeling and less focus on scoping fire modeling. This was the approach taken for the fire PRA. • Task 14: Fire risk quantification. Typically, multiple safe shutdown (SSD) components fail during a given fire scenario. Therefore dependent failure analysis is critical to obtaining a meaningful fire risk quantification. Dependent failure analysis for the fire PRA presented several challenges which will be discussed in the full paper.

  9. Computer program for the sensitivity calculation of a CR-39 detector in a diffusion chamber for radon measurements

    SciTech Connect (OSTI)

    Nikezic, D. Stajic, J. M.; Yu, K. N.

    2014-02-15

    Computer software for calculation of the sensitivity of a CR-39 detector closed in a diffusion chamber to radon is described in this work. The software consists of two programs, both written in the standard Fortran 90 programming language. The physical background and a numerical example are given. Presented software is intended for numerous researches in radon measurement community. Previously published computer programs TRACK-TEST.F90 and TRACK-VISION.F90 [D. Nikezic and K. N. Yu, Comput. Phys. Commun. 174, 160 (2006); D. Nikezic and K. N. Yu, Comput. Phys. Commun. 178, 591 (2008)] are used here as subroutines to calculate the track parameters and to determine whether the track is visible or not, based on the incident angle, impact energy, etching conditions, gray level, and visibility criterion. The results obtained by the software, using five different V functions, were compared with the experimental data found in the literature. Application of two functions in this software reproduced experimental data very well, while other three gave lower sensitivity than experiment.

  10. Temperature-dependent phase-specific deformation mechanisms in a directionally solidified NiAl-Cr(Mo) lamellar composite

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Yu, Dunji; An, Ke; Chen, Xu; Bei, Hongbin

    2015-10-09

    Phase-specific thermal expansion and mechanical deformation behaviors of a directionally solidified NiAl–Cr(Mo) lamellar in situ composite were investigated by using real-time in situ neutron diffraction during compression at elevated temperatures up to 800 °C. Tensile and compressive thermal residual stresses were found to exist in the NiAl phase and Crss (solid solution) phase, respectively. Then, based on the evolution of lattice spacings and phase stresses, the phase-specific deformation behavior was analyzed qualitatively and quantitatively. Moreover, estimates of phase stresses were derived by Hooke's law on the basis of a simple method for the determination of stress-free lattice spacing in inmore » situ composites. During compressive loading, the NiAl phase yields earlier than the Crss phase. The Crss phase carries much higher stress than the NiAl phase, and displays consistent strain hardening at all temperatures. The NiAl phase exhibits strain hardening at relatively low temperatures and softening at high temperatures. During unloading, the NiAl phase yields in tension whereas the Crss phase unloads elastically. Additionally, post-test microstructural observations show phase-through cracks at room temperature, micro cracks along phase interfaces at 600 °C and intact lamellae kinks at 800 °C, which is due to the increasing deformability of both phases as temperature rises.« less

  11. Early stages of spinodal decomposition in Fe–Cr resolved by in-situ small-angle neutron scattering

    SciTech Connect (OSTI)

    Hörnqvist, M. Thuvander, M.; Steuwer, A.; King, S.; Odqvist, J.; Hedström, P.

    2015-02-09

    In-situ, time-resolved small-angle neutron scattering (SANS) investigations of the early stages of the spinodal decomposition process in Fe–35Cr were performed at 773 and 798 K. The kinetics of the decomposition, both in terms of characteristic distance and peak intensity, followed a power-law behaviour from the start of the heat treatment (a′{sup  }= 0.10–0.11 and a″ = 0.67–0.86). Furthermore, the method allows tracking of the high–Q slope, which is a sensitive measure of the early stages of decomposition. Ex-situ SANS and atom probe tomography were used to verify the results from the in-situ investigations. Finally, the in-situ measurement of the evolution of the characteristic distance at 773 K was compared with the predictions from the Cahn-Hilliard-Cook model, which showed good agreement with the experimental data (a′{sup  }= 0.12–0.20 depending on the assumed mobility)

  12. Spectral properties of a novel laser crystal Y3(In,Ga)2Ga3O12:Cr(3+)--translation

    SciTech Connect (OSTI)

    Li, Y.; Tang, H.; Hang, Y.; Chen, S.

    1991-11-19

    Spectral properties of a novel phonon terminated laser crystal Yttrium(3)(Indium, Gallium)(2)Gallium(3)Oxygen(12): Chromium(3+) grown by the flux method are reported for the first time. The results show that the spectral properties of this novel crystal are compatible with those of Gadolinium(3)(Selenium, Gallium)(3)Gallium(3)Oxygen(12): Chromium(3+) and is a potential ambient temperature tunable laser crystal. Gadolinium(3)(Scandium, Gallium)(2)Gallium(3)Oxygen(12): Chromium(3+) (shortened to GSGG:CR3+) is a type of phonon-terminated laser crystal with excellent capabilities. It has a relatively weak crystal field and relatively strong electron-phonon coupling. At room temperatures a strong terminal phonon emission spectrum with a half width of about 100 nm can be observed. At the same time, experimentally at room temperatures, a wide band continuous tunable laser emission has been observed. Since it has been reported, a great deal of attention has been paid to it. However, since Scandium is rare and expensive its applications are limited.

  13. Microstructure investigation of 13Cr-2Mo ODS steel components obtained by high voltage electric discharge compaction technique

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Bogachev, Igor; Yudin, Artem; Grigoryev, Evgeniy; Chernov, Ivan; Staltsov, Maxim; Khasanov, Oleg; Olevsky, Eugene

    2015-11-02

    Refractory oxide dispersion strengthened 13Cr-2Mo steel powder was successfully consolidated to near theoretical density using high voltage electric discharge compaction. Cylindrical samples with relative density from 90% to 97% and dimensions of 10 mm in diameter and 10–15 mm in height were obtained. Consolidation conditions such as pressure and voltage were varied in some ranges to determine the optimal compaction regime. Three different concentrations of yttria were used to identify its effect on the properties of the samples. It is shown that the utilized ultra-rapid consolidation process in combination with high transmitted energy allows obtaining high density compacts, retaining themore » initial structure with minimal grain growth. The experimental results indicate some heterogeneity of the structure which may occur in the external layers of the tested samples due to various thermal and electromagnetic in-processing effects. As a result, the choice of the optimal parameters of the consolidation enables obtaining samples of acceptable quality.« less

  14. APS TBC performance on directionally-solidified superalloy substrates with HVOF NiCoCrAlYHfSi bond coatings

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Lance, Michael J.; Unocic, Kinga A.; Haynes, James A.; Pint, Bruce A.

    2015-09-04

    Directionally-solidified (DS) superalloy components with advanced thermal barrier coatings (TBC) to lower the metal operating temperature have the potential to replace more expensive single crystal superalloys for large land-based turbines. In order to assess relative TBC performance, furnace cyclic testing was used with superalloys 1483, X4 and Hf-rich DS 247 substrates and high velocity oxygen fuel (HVOF)-NiCoCrAlYHfSi bond coatings at 1100 °C with 1-h cycles in air with 10% H2O. With these coating and test conditions, there was no statistically-significant effect of substrate alloy on the average lifetime of the air plasma sprayed (APS) yttria-stabilized zirconia (YSZ) top coatings onmore » small coupons. Using photo-stimulated luminescence piezospectroscopy maps at regular cycling intervals, the residual compressive stress in the α-Al2O3 scale underneath the YSZ top coating and on a bare bond coating was similar for all three substrates and delaminations occurred at roughly the same rate and frequency. As a result, x-ray fluorescence (XRF) measurements collected from the bare bond coating surface revealed higher Ti interdiffusion occurring with the 1483 substrate, which contained the highest Ti content.« less

  15. Synthesis, structural and magnetic studies of the CuCr{sub 1-x}Rh{sub x}O{sub 2} delafossite solid solution with 0 {<=} x {<=} 0.2

    SciTech Connect (OSTI)

    Amami, M.; Jlaiel, F.; Strobel, P.; Ben Salah, A.

    2011-10-15

    Highlights: {yields} Rh non-magnetic replacement of the Cr in the magnetic frustrated delafossite CuCrO{sub 2}. {yields} Delafossite solid solution is maintained up to 0.2 in this system. {yields} Strain generated by Rh substitution is strongly anisotropic. {yields} M{sup 3+}-O bond strength is affected. {yields} High temperature paramagnetic behavior and weak ferromagnetism at low temperature. -- Abstract: The CuCr{sub 1-x}Rh{sub x}O{sub 2} series is investigated by X-ray diffraction, magnetization measurements and Raman spectroscopy on ceramic samples. It is found that a delafossite solid solution is maintained up to x = 0.2 in CuCr{sub 1-x}Rh{sub x}O{sub 2}. The small observed variation in cell parameters is consistent with the small difference between the ionic radii of Cr{sup 3+} and Rh{sup 3+}. A significant broadening of X-ray reflections is observed and when analyzed using the Williamson-Hall relationship showed that the strain generated by Rh substitution is strongly anisotropic, affecting mainly (Cr,Rh)-O bonds in the ab plane. Room temperature Raman spectra displayed three main Raman active modes. All modes shift to lower frequency and undergo significant changes in intensity with increasing Rh content, showing the effect of Rh atoms on the M{sup 3+}-O bond strength. The magnetic behavior of CuCr{sub 1-x}Rh{sub x}O{sub 2} samples was investigated as a function of temperature and applied field. At high temperature paramagnetic behavior, and at low temperature, evidence for weak ferromagnetism, reinforced by a hysteresis loop at 4 K is observed. The magnetic behavior of CuCr{sub 1-x}Rh{sub x}O{sub 2} is attributed to the disorder of Cr and Rh in octahedral sites resulting in short-range Cr-O-Cr and Cr-O-Rh interactions, which give rise to short-range weak ferromagnetism.

  16. Effect of large additions of Cd, Pb, Cr, Zn, to cement raw meal on the composition and the properties of the clinker and the cement

    SciTech Connect (OSTI)

    Murat, M.; Sorrentino, F.

    1996-03-01

    The utilization of hydraulic binders to solidify and to stabilize industrial wastes and municipal garbage is presently recognized as one of the solutions to the problem of environment protection. Te addition of important quantities of Cd, Pb, Cr, Zn to raw meals of Portland and calcium aluminate cement modifies the mineralogical composition and the properties of the final cement. Portland cement can absorb a large amount of Cd and Zn. This absorption leads to an increase of setting time and a decrease of strengths of the cement. It also can trap chromium with a short setting time and high strengths. Calcium aluminate cements easily trap Cd and Cr with a delayed setting and good strength but also Pb with normal setting time and strengths. Large quantities of zinc oxide have a deleterious effect on calcium aluminate strengths.

  17. Anomalous phonon behavior in the high-temperature shape-memory alloy Ti{sub 50}Pd{sub 50-x}Cr{sub x}

    SciTech Connect (OSTI)

    Shapiro, S. M.; Xu Guangyong; Winn, B. L.; Schlagel, D. L.; Lograsso, T.; Erwin, R.

    2007-08-01

    Ti{sub 50}Pd{sub 50-x}Cr{sub x} is a high-temperature shape-memory alloy with a martensitic transformation temperature strongly dependent on the Cr composition. Prior to the transformation, a premartensitic phase is present with an incommensurate modulated cubic lattice with wave vector of q{sub 0}=(0.22,0.22,0). The temperature dependence of the diffuse scattering in the cubic phase is measured as a function temperature for x=6.5, 8.5, and 10 at. %. The lattice dynamics has been studied and reveals anomalous temperature and q dependences of the [110]-TA{sub 2} transverse phonon branch. The phonon linewidth is broad over the entire Brillouin zone and increases with decreasing temperature, contrary to the behavior expected for anharmonicity. No anomaly is observed at q{sub 0}. The results are compared with first principles calculation of the phonon structure.

  18. Electrical switching effect of a single-unit-cell CrO{sub 2} layer on rutile TiO{sub 2} surface

    SciTech Connect (OSTI)

    Li, Si-Da; Liu, Bang-Gui

    2014-03-24

    Rutile CrO{sub 2} is the most important half-metallic material with nearly 100% spin polarization at the Fermi level, and rutile TiO{sub 2} is a wide-gap semiconductor with many applications. Here, we show through first-principles investigation that a single-unit-cell CrO{sub 2} layer on rutile TiO{sub 2} (001) surface is ferromagnetic and semiconductive with a gap of 0.54 eV, and its electronic state transits abruptly to a typical metallic state when an electrical field is applied. Consequently, this makes an interesting electrical switching effect which may be useful in designing spintronic devices.

  19. Level crossings and zero-field splitting in the {Cr8}-cubane spin-cluster studied using inelastic neutron scattering and magnetization

    SciTech Connect (OSTI)

    Vaknin, D.; Garlea, Vasile O; Demmel, F.; Mamontov, Eugene; Nojiri, H; Martin, Catalin; Chiorescu, Irinel; Qiu, Y.; Luban, M.; Kogerler, P.; Fielden, J.; Engelhardt, L; Rainey, C

    2010-01-01

    Inelastic neutron scattering (INS) in variable magnetic field and high-field magnetization measurements in the millikelvin temperature range were performed to gain insight into the low-energy magnetic excitation spectrum and the field-induced level crossings in the molecular spin cluster {Cr8}-cubane. These complementary techniques provide consistent estimates of the lowest level-crossing field. The overall features of the experimental data are explained using an isotropic Heisenberg model, based on three distinct exchange interactions linking the eight CrIII paramagnetic centers (spins s = 3/2), that is supplemented with a relatively large molecular magnetic anisotropy term for the lowest S = 1 multiplet. It is noted that the existence of the anisotropy is clearly evident from the magnetic field dependence of the excitations in the INS measurements, while the magnetization measurements are not sensitive to its effects.

  20. Mobility of Source Zone Heavy Metals and Radionuclides: The Mixed Roles of Fermentative Activity on Fate and Transport of U and Cr

    Office of Scientific and Technical Information (OSTI)

    Mobility of Source Zone Heavy Metals and Radionuclides: The Mixed Roles of Fermentative Activity on Fate and Transport of U and Cr William Apel (INL), Brent Peyton (MSU), Robin Gerlach (MSU), Brady Lee (INL) 1. Research Objectives: Predicting the potential migration of metals and radionuclides from waste pits and trenches will require understanding the effects of carbon and electron flow through these environments. Important aspects of this flow include the physiological activity of cellulolytic

  1. Impact of Lattice Mismatch and Stoichiometry on the Structure and Bandgap of (Fe,Cr)2O3 Epitaxial Thin Films

    SciTech Connect (OSTI)

    Kaspar, Tiffany C.; Chamberlin, Sara E.; Bowden, Mark E.; Colby, Robert J.; Shutthanandan, V.; Manandhar, Sandeep; Wang, Yong; Sushko, Petr; Chambers, Scott A.

    2014-03-13

    The structural properties of high-quality epitaxial (Fe1-xCrx)2O3 thin films are investigated across the composition range. Epitaxial films are deposited on a-Al2O3(0001) substrates by oxygen-plasma-assisted molecular beam epitaxy. Corundum (Fe1-xCrx)2O3 supercells relaxed by density functional theory confirm that the non-linear behavior of the bulk lattice parameters originates in the magnetic structure of the alloy films. High-resolution x-ray diffraction reveals the degree of epitaxial strain relaxation in the films, with Cr-rich films remaining partially strained to the Al2O3 substrate. For intermediate compositions, a lattice expansion and non-Poisson-like tetragonal distortion are found. Scanning transmission electron microscopy and electron energy loss spectroscopy reveal a columnar grain structure in the films, with uniform mixing of cations on the nanometer scale. Oxygen non-stoichiometry is quantified by non-Rutherford resonant elastic scattering measurements utilizing 3.04 MeV He+. Intermediate-composition films are found to be slightly over-stoichiometric, resulting in the observed lattice expansion. Cr-rich films, in contrast, appear to be slightly oxygen deficient. A model is proposed to explain these results based on the energetics of oxygen defect formation and rate of oxygen diffusion in the corundum lattice. Compressive biaxial strain is found to reduce the bandgap of epitaxial Cr2O3 relative to the bulk value. The relationships which are elucidated between epitaxial film structure and optical properties can be applied to bandgap optimization in the (Fe,Cr)2O3 system.

  2. Applicability of Loss of Offsite Power (LOSP) Events in NUREG/CR-6890 for Entergy Nuclear South (ENS) Plants LOSP Calculations

    SciTech Connect (OSTI)

    Li, Yunlong; Yilmaz, Fatma; Bedell, Loys

    2006-07-01

    Significant differences have been identified in loss of offsite power (LOSP or LOOP) event description, category, duration, and applicability between the LOSP events used in NUREG/CR-6890 and ENS'LOSP packages, which were based on EPRI LOSP reports with plant-specific applicability analysis. Thus it is appropriate to reconcile the LOSP data listed in the subject NUREG and EPRI reports. A cross comparison showed that 62 LOSP events in NUREG/CR-6890 were not included in the EPRI reports while 4 events in EPRI reports were missing in the NUREG. Among the 62 events missing in EPRI reports, the majority were applicable to shutdown conditions, which could be classified as category IV events in EPRI reports if included. Detailed reviews of LERs concluded that some events did not result in total loss of offsite power. Some LOSP events were caused by subsequent component failures after a turbine/plant trip, which have been modeled specifically in most ENS plant PRA models. Moreover, ENS has modeled (or is going to model) the partial loss of offsite power events with partial LOSP initiating events. While the direct use of NUREG/CR-6890 results in SPAR models may be appropriate, its direct use in ENS' plant PRA models may not be appropriate because of modeling details in ENS' plant-specific PRA models. Therefore, this paper lists all the differences between the data in NUREG/CR-6890 and EPRI reports and evaluates the applicability of the LOSP events to ENS plant-specific PRA models. The refined LOSP data will characterize the LOSP risk in a more realistic fashion. (authors)

  3. The permeation behavior of deuterium through 1Cr18Ni9Ti stainless steel with TiN+TiC-TiN multiple films

    SciTech Connect (OSTI)

    Xiong, Y.; Song, J.; Luo, D.; Lei, Q.; Chen, C.

    2015-03-15

    The prevention of tritium losses via permeation through structure components is an important issue in fusion technology. The production of thin layers on materials with low diffusivity and/or low surface recombination constants (so-called permeation barriers) seems to be the most practical method to reduce or hinder the permeation of tritium through materials. TiN+TiC+TiN multiple films are deposited on the surface of 1Cr18Ni9Ti stainless steel by ion-beam assisted deposition technology. The characteristics of films are tested by XPS ASEM and XRD, which shows that the film are compact and uniform with a thickness of about 15 μm, and have a good adherence with the substrate below 773 K. The diffraction peaks in the XRD patterns for TiC and TiN are broadened, implying that the multiple films are deposited on the surface of 1Cr18Ni9Ti stainless steel. Meanwhile, the C-H bonded CH{sub 4}-appears in the infrared spectra of multiple films, suggesting that the CH{sub 4}- is in a static state, so hydrogen atom cannot migrate from the site bonded with carbon to a neighboring site. The measured deuterium permeability in 1Cr18Ni9Ti stainless steel coated with multiple films is 2-3 orders of magnitude lower than that of pure 1Cr18Ni9Ti stainless steel substrate from 473 K to 773 K. However, this barrier is partly destroyed above 773 K.

  4. Methylene migration and coupling on a non-reducible metal oxide: The reaction of dichloromethane on stoichiometric α-Cr2O3(0001)

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Dong, Yujung; Brooks, John D.; Chen, Tsung-Liang; Mullins, David R.; Cox, David F.

    2014-09-17

    The reaction of CH2Cl2 over the nearly-stoichiometric α-Cr2O3(0001) surface produces gas phase ethylene, methane and surface chlorine adatoms. The reaction is initiated by the decomposition of CH2Cl2 into surface methylene and chlorine. Photoemission indicates that surface cations are the preferred binding sites for both methylene and chlorine adatoms. Two reaction channels are observed for methylene coupling to ethylene in temperature-programmed desorption (TPD). A desorption-limited, low-temperature route is attributed to two methylenes bound at a single site. The majority of ethylene is produced by a reaction-limited process involving surface migration (diffusion) of methylene as the rate-limiting step. DFT calculations indicate themore » surface diffusion mechanism is mediated by surface oxygen anions. The source of hydrogen for methane formation is adsorbed background water. Chlorine adatoms produced by the dissociation of CH2Cl2 deactivate the surface by simple site-blocking of surface Cr3+ sites. Finally, a comparison of experiment and theory shows that DFT provides a better description of the surface chemistry of the carbene intermediate than DFT+U using reported parameters for a best representation of the bulk electronic properties of α-Cr2O3.« less

  5. Multiple temperature-induced magnetization reversals in SmCr{sub 1−x}Fe{sub x}O{sub 3} system

    SciTech Connect (OSTI)

    Yin, L.H.; Liu, Y.; Tan, S.G.; Zhao, B.C.; Dai, J.M.; Song, W.H.; Sun, Y.P.

    2013-10-15

    Graphical abstract: - Highlights: • Multiple temperature-induced magnetization reversals were observed in x = 0.1. • Coexistence of normal and inverse magnetocaloric effects was observed. • A reasonable model was proposed to explain the magnetization reversals. - Abstract: The structural and magnetic properties of the SmCr{sub 1−x}Fe{sub x}O{sub 3} (0 ≤ x ≤ 0.5) system have been investigated. Multiple temperature-induced magnetization reversals were observed in x = 0.1. The high-temperature magnetization reversal is due to the special spin structure, in which the net canted moment of the Cr-rich regions and the net moment of the Fe–Cr ordered regions orient in opposite direction; while the low temperature one can be ascribed to the spin reorientation. The sample with x = 0.5 exhibits the highest compensation temperature. Coexistence of normal and inverse magnetocaloric effects was observed in all doped samples. Potential applications in magnetic refrigeration based constant temperature bath near room temperature (∼286 K) have been demonstrated.

  6. Methylene megration and coupling on a non-reducible metal oxide: the reaction of dichloromethane on stoichiometric -Cr2O3(0001)

    SciTech Connect (OSTI)

    Dong, Yujung; Brooks, John; Chen, Tsung-Liang; Mullins, David R; Cox, David F.

    2015-01-01

    The reaction of CH2Cl2 over the nearly-stoichiometric -Cr2O3(0001) surface produces gas phase ethylene, methane and surface chlorine adatoms. The reaction is initiated by the decomposition of CH2Cl2 into surface methylene and chlorine. Photoemission indicates that surface cations are the preferred binding sites for both methylene and chlorine adatoms. Two reaction channels are observed for methylene coupling to ethylene in temperature-programmed desorption (TPD). A desorption-limited, low-temperature route is attributed to two methylenes bound at a single site. The majority of ethylene is produced by a reaction-limited process involving surface migration (diffusion) of methylene as the rate-limiting step. DFT calculations indicate the surface diffusion mechanism is mediated by surface oxygen anions. The source of hydrogen for methane formation is adsorbed background water. Chlorine adatoms produced by the dissociation of CH2Cl2 deactivate the surface by simple site-blocking of surface Cr3+ sites. A comparison of experiment and theory shows that DFT provides a better description of the surface chemistry of the carbene intermediate than DFT+U using reported parameters for a best representation of the bulk electronic properties of -Cr2O3.

  7. Methylene megration and coupling on a non-reducible metal oxide: the reaction of dichloromethane on stoichiometric -Cr2O3(0001)

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Dong, Yujung; Brooks, John; Chen, Tsung-Liang; Mullins, David R; Cox, David F.

    2015-01-01

    The reaction of CH2Cl2 over the nearly-stoichiometric -Cr2O3(0001) surface produces gas phase ethylene, methane and surface chlorine adatoms. The reaction is initiated by the decomposition of CH2Cl2 into surface methylene and chlorine. Photoemission indicates that surface cations are the preferred binding sites for both methylene and chlorine adatoms. Two reaction channels are observed for methylene coupling to ethylene in temperature-programmed desorption (TPD). A desorption-limited, low-temperature route is attributed to two methylenes bound at a single site. The majority of ethylene is produced by a reaction-limited process involving surface migration (diffusion) of methylene as the rate-limiting step. DFT calculations indicate themore » surface diffusion mechanism is mediated by surface oxygen anions. The source of hydrogen for methane formation is adsorbed background water. Chlorine adatoms produced by the dissociation of CH2Cl2 deactivate the surface by simple site-blocking of surface Cr3+ sites. A comparison of experiment and theory shows that DFT provides a better description of the surface chemistry of the carbene intermediate than DFT+U using reported parameters for a best representation of the bulk electronic properties of -Cr2O3.« less

  8. First Annual Progress Report on Radiation Tolerance of Controlled Fusion Welds in High Temperature Oxidation Resistant FeCrAl Alloys

    SciTech Connect (OSTI)

    Field, Kevin G.; Gussev, Maxim N.; Hu, Xunxiang; Yamamoto, Yukinori; Howard, Richard H.

    2015-12-01

    The present report summarizes and discusses the first year efforts towards developing a modern, nuclear grade FeCrAl alloy designed to have enhanced radiation tolerance and weldability under the Department of Energy (DOE) Nuclear Energy Enabling Technologies (NEET) program. Significant efforts have been made within the first year of this project including the fabrication of seven candidate FeCrAl alloys with well controlled chemistry and microstructure, the microstructural characterization of these alloys using standardized and advanced techniques, mechanical properties testing and evaluation of base alloys, the completion of welding trials and production of weldments for subsequent testing, the design of novel tensile specimen geometry to increase the number of samples that can be irradiated in a single capsule and also shorten the time of their assessment after irradiation, the development of testing procedures for controlled hydrogen ingress studies, and a detailed mechanical and microstructural assessment of weldments prior to irradiation or hydrogen charging. These efforts and research results have shown promise for the FeCrAl alloy class as a new nuclear grade alloy class.

  9. Blending Cr2O3 into a NiO-Ni electrocatalyst for sustained water splitting

    SciTech Connect (OSTI)

    Gong, Ming; Zhou, Wu; Kenney, Michael James; Kapusta, Rich; Cowley, Sam; Wu, Yingpeng; Lu, Bingan; Lin, Meng -Chang; Wang, Di -Yan; Yang, Jiang; Hwang, Bing -Joe; Dai, Hongjie

    2015-08-24

    The rising H2 economy demands active and durable electrocatalysts based on low-cost, earth-abundant materials for water electrolysis/photolysis. Here we report nanoscale Ni metal cores over-coated by a Cr2O3-blended NiO layer synthesized on metallic foam substrates. The Ni@NiO/Cr2O3 triphase material exhibits superior activity and stability similar to Pt for the hydrogen-evolution reaction in basic solutions. The chemically stable Cr2O3 is crucial for preventing oxidation of the Ni core, maintaining abundant NiO/Ni interfaces as catalytically active sites in the heterostructure and thus imparting high stability to the hydrogen-evolution catalyst. The highly active and stable electrocatalyst enables an alkaline electrolyzer operating at 20 mA cm2 at a voltage lower than 1.5 V, lasting longer than 3 weeks without decay. Thus, the non-precious metal catalysts afford a high efficiency of about 15 % for light-driven water splitting using GaAs solar cells.

  10. Sintered Cr/Pt and Ni/Au ohmic contacts to B12P2

    SciTech Connect (OSTI)

    Frye, Clint D.; Kucheyev, Sergei O.; Edgar, James H.; Voss, Lars F.; Conway, Adam M.; Shao, Qinghui; Nikolic, Rebecca J.

    2015-04-09

    With this study, icosahedral boron phosphide (B12P2) is a wide-bandgap semiconductor possessing interesting properties such as high hardness, chemical inertness, and the reported ability to self-heal from irradiation by high energy electrons. Here, the authors developed Cr/Pt and Ni/Au ohmic contacts to epitaxially grown B12P2 for materials characterization and electronic device development. Cr/Pt contacts became ohmic after annealing at 700 °C for 30 s with a specific contact resistance of 2×10–4 Ω cm2, as measured by the linear transfer length method. Ni/Au contacts were ohmic prior to any annealing, and their minimum specific contact resistance was ~l–4 × 10–4 Ω cm2 after annealing over the temperature range of 500–800 °C. Rutherford backscattering spectrometry revealed a strong reaction and intermixing between Cr/Pt and B12P2 at 700 °C and a reaction layer between Ni and B12P2 thinner than ~25 nm at 500 °C.

  11. Reactions of Ethyl Groups on a Model Chromia Surface: Ethyl Chloride on Stoichiometric Alpha-Cr2O3(1012)

    SciTech Connect (OSTI)

    Brooks, J.; Ma, Q; Cox, D

    2009-01-01

    The reaction of CH3CH2Cl over the nearly-stoichiometric ?-Cr2O3 (1 0 View the MathML source 2) surface yields gas phase CH2double bond; length as m-dashCH2, CH3CH3, H2 and surface chlorine adatoms. The decomposition reaction is initiated via C-Cl bond cleavage to give a surface ethyl (CH3CH2-) intermediate. A rate-limiting ?-hydride elimination from the surface ethyl species produces gas phase CH2double bond; length as m-dashCH2 and surface hydrogen atoms. Two parallel competing reactions form CH3CH3, via ?-hydride addition to remaining surface ethyl species (reductive elimination), and H2, via the combination of two surface hydrogen atoms. The chlorine freed from the dissociation of CH3CH2Cl binds at the five-coordinate surface Cr3+ sites on the stoichiometric surface and inhibits the surface chemistry via simple site blocking. No surface carbon deposition is observed from the thermal reaction of ethyl chloride, suggesting that ethyl intermediates are not primary coke forming intermediates in the dehydrogenation of ethane over (1 0 View the MathML source 2) facets of ?-Cr2O3.

  12. Magnetic ordering in TbMn{sub 0.5}Cr{sub 0.5}O{sub 3} studied by neutron diffraction and first-principles calculations

    SciTech Connect (OSTI)

    Staruch, M.; Sharma, V.; Ramprasad, R.; Cruz, C. dela; Jain, M.

    2014-07-21

    The structure and magnetic ordering of bulk TbMn{sub 0.5}Cr{sub 0.5}O{sub 3} was revealed through bulk magnetization and neutron diffraction measurements, and first-principles calculations, respectively. G-type antiferromagnetic ordering of Mn{sup 3+} and Cr{sup 3+} moments was observed in the neutron diffraction data below Nel temperature T{sub N}???84?K. In addition, below ?40?K, short-range magnetic ordering was identified correlating to a ferromagnetic component due to the canting of the moments along the c-axis. The spin configuration is consistent with the first-principles calculations. The magnetic structure revealed in the present TbMn{sub 0.5}Cr{sub 0.5}O{sub 3} sample is distinct from that observed for both end members TbMnO{sub 3} and TbCrO{sub 3}.

  13. 11554_cover_CR

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    NERSC 2005 Annual Report National Energy Research Scientific Computing Center 05 NERSC 2005 Annual Report National Energy Research Scientific Computing Center Lawrence Berkeley National Laboratory / 1 Cyclotron Road / Berkeley CA / 94720 LBNL-60296 The Year in Perspective 2 Research News 4 The Heat Is On 5 Burning Questions 9 Combustion Up Close 11 Hailstones in Hell 13 A Perfect Liquid 15 Whispers from Underground 18 Breaking Up Is Hard to Calculate 20 Talent Scouting 23 Surface Charge 25

  14. NUREG/CR-6399

    Office of Scientific and Technical Information (OSTI)

    ... Nuclear Div., Oak Ridge Natl. Lab., Oak Ridge, Tenn., Fabrication History of the Third and ... Lab., Oak Ridge, Tenn., Assessment of Radiation Effects Relating to Reactor Pressure ...

  15. NUREG/CR-6399

    Office of Scientific and Technical Information (OSTI)

    ... Notes: 1. Specimen Specifications: 1-8 see drawing T-CVNO33090 9-24 see drawing CVN033090 2. Engrave specimen IDS. Do not steel stamp. Specimen IDS: 2C01- 2C24 speclmen I D Trojan ...

  16. UCRL-CR--10

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    f^ UCRL-52863 Conduction heat transfer solutions James H. VanSant u March 1980 .:'** *:*.*! i s UHUMITEE CONTENTS Preface v Nomenclature vii Introduction . 1 Steady-State Solutions 1. Plane Surface - Steady State 1.1 Solids Bounded by Plane Surfaces 1-1 1.2 Solids Bounded by Plane Surfaces -With Internal Heating 1-27 2. Cylindrical Surface - Steady State 2.1 Solids Bounded by Cylindrical Surfaces - N o Internal Heating 2-1 2.2 Solids Bounded by Cylindrical Surfaces -With Internal Heating 2-33 3.

  17. UCRL-CR-104544

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    04544 DE90 015910 THE TRANSPORT PROPERTIES OF ACTIVATED CARBON FIBERS Received by ^:TI SEP 1 2 1990 S.L. di V i t t o r i o M.S. Dresselhaus M. Endo J-P. I s s i L. Piraux July 1990 DISCXAIMER This report was prepared as an account of work sponsored by an agency of the United States Government. Neither the United States Government nor any agency thereof, nor any of their employees, makes any warranty, express or implied, or assumes any legal liability or responsi- bility for the accuracy,

  18. Unconventional magnetism in ThCr2Si2-type phosphides, La1 xNdxCo2P2

    SciTech Connect (OSTI)

    Thompson, Corey; Kovnir, Kirill; Garlea, Vasile O; Choi, E.; Zhou, Haidong; Shatruk, Michael

    2014-01-01

    Quaternary phases La1 xNdxCo2P2 (x = 0, 0.12, 0.25, 0.37, 0.50, 0.63, 0.75, 0.88, 1.0) have been synthesized from Sn flux to investigate the origins of drastic differences in properties between ferromagnetic LaCo2P2 and antiferromagnetic NdCo2P2. Powder and single-crystal X-ray diffraction indicate that all La1 xNdxCo2P2 samples are isostructural and crystallize in the ThCr2Si2 structure type. The unit cell parameters and volume change non-linearly with the Nd content (x), with the x < 0.50 10 samples being closer to LaCo2P2 and the ones with x > 0.50 being closer to NdCo2P2. These structural differences are also reflected in the magnetic behavior. The samples with lower Nd content are characterized by ferromagnetic ordering in the Co sublattice with the TC increasing from 132 K for x = 0 to 262 K for x = 0.50, while the samples with higher Nd content exhibit suppressed magnetization in the Co sublattice and canted antiferromagnetic ordering with TC ~ 270 K. Refinement of neutron powder 15 diffraction patterns for x = 0.50 and 0.75 reveals a gradual ordering of the Nd 4f moments under the influence of Co 3d moments below 100 K. At low temperatures and zero field, these samples exhibit antiferromagnetic ordering of both Nd and Co magnetic moments, but under applied field they demonstrate the stabilization of a ferrimagnetic state with antiparallel alignment of the 4f and 3d moments, as indicated by isothermal magnetization measurements. The re-entrant ferrimagnetic transition 20 is also observed in samples with x > 0.50 if the temperature is lowered below 5 K. The occurrence of this low-temperature magnetic transition was confirmed by alternating-current susceptibility measurements.

  19. Effect of Zr on microstructures and mechanical properties of an Al-Mg-Si-Cu-Cr alloy prepared by low frequency electromagnetic casting

    SciTech Connect (OSTI)

    Meng, Yi, E-mail: yimonmy@sina.com; Cui, Jianzhong; Zhao, Zhihao; He, Lizi

    2014-06-01

    The Al-1.6Mg-1.2Si-1.1Cu-0.15Cr (all in wt. %) alloys with and without Zr addition prepared by low frequency electromagnetic casting process were investigated by using the optical microscope, scanning electron microscope and transmission electron microscope equipped with energy dispersive analytical X-ray. The effects of Al{sub 3}Zr phases on the microstructures and mechanical properties during solidification, homogenization, hot extrusion and solid solution were studied. The results show that Al{sub 3}Zr phases reduce the grain size by ? 29% and promote the formation of an equiaxed grain structure during solidification. Numerous spherical Al{sub 3}Zr dispersoids with 3560 nm in diameters precipitate during homogenization, and these fine dispersoids change little during subsequent hot extrusion and solid solution. Adding 0.15 wt. % Zr results in no recrystallization after hot extrusion and partial recrystallization after solid solution, while the recrystallized grain size is 400550 ?m in extrusion direction in the Zr-free alloy. In addition, adding 0.15 wt. % Zr can obviously promote Q? phase precipitation, while the ?? phases are predominant in the alloy without Zr. Adding 0.15 wt. % Zr, the ultimate tensile strength of the T6 treated alloy increases by 45 MPa, while the elongation remains about 16.7%. - Highlights: Minor Zr can refine as-cast grains of the LFEC Al-Mg-Si-Cu-Cr alloy. L1{sub 2} Al{sub 3}Zr phases with 3560 nm in diameter precipitate during homogenization. L1{sub 2} and DO{sub 22} Al{sub 3}Zr phases result in partial recrystallization after solid solution. Minor Zr can promote the precipitation of Q? phases. Mechanical properties of Al-Mg-Si-Cu-Cr-Zr alloy are higher than those of AA7005.

  20. The impacts of cation stoichiometry and substrate surface quality on nucleation, structure, defect formation, and intermixing in complex oxide heteroepitaxy LaCrO3 on SrTiO3(001)

    SciTech Connect (OSTI)

    Qiao, Liang; Zhang, K. H. L; Bowden, Mark E; Varga, Tamas; Shutthanandan, Vaithiyalingam; Colby, Robert; Du, Yingge; Kabius, Bernd; Sushko, Peter V; Biegalski, Michael D; Chambers, S. A.

    2013-01-01

    Our ability to design and fabricate electronic devices with reproducible properties using complex oxides is critically dependent on our ability to controllably synthesize these materials in thin-film form. Structure-property relationships are intimately tied to film and interface composition Here we report on the effect of cation stoichiometry on structural quality and defect formation in LaCrO3 heteroepitaxial films prepared using molecular beam epitaxy. We calculate from first principles the regions of stability of various candidate defects as a function of Cr and O chemical potential, along with the predicted effects of these defects on structural parameters. We show that epitaxial LaCrO3 films readily nucleate and remain coherently strained on SrTiO3(001) over a wide range of La-to-Cr atom ratios, but that La-rich films are of considerably lower structural quality than stoichiometric and Cr-rich films. Cation imbalances are accompanied by anti-site defect formation, as deduced by comparing experimental trends in the c lattice parameter with those from first-principles calculations. Cation mixing occurs at the interface for all La-to-Cr ratios investigated, and is not quenched by deposition on SrTiO3(001) at ambient temperature. Indiffused La atoms occupy Sr sites, most likely facilitated by Sr vacancy formation in STO resulting from high-temperature oxygen annealing required to prepare the substrate. Intermixing is effectively quenched by using molecular beam epitaxy to deposit LaCrO3 at ambient temperature on defect free Si(001). However, analogous pulsed laser deposition on Si is accompanied by cation mixing.

  1. Epitaxial growth of (1 1 1)-oriented spinel CoCr{sub 2}O{sub 4}/Al{sub 2}O{sub 3} heterostructures

    SciTech Connect (OSTI)

    Liu, Xiaoran Choudhury, D.; Cao, Yanwei; Middey, S.; Kareev, M.; Meyers, D.; Chakhalian, J.; Kim, J.-W.; Ryan, P.

    2015-02-16

    High quality (1 1 1)-oriented CoCr{sub 2}O{sub 4}/Al{sub 2}O{sub 3} heterostructures were synthesized on the sapphire (0 0 0 1) single crystal substrates by pulsed laser deposition. The structural properties are demonstrated by in-situ reflection high energy electron diffraction, atomic force microscopy, X-ray reflectivity, and X-ray diffraction. X-ray photoemission spectroscopy confirms that the films possess the proper chemical stoichiometry. This work offers a pathway to fabricating spinel type artificial quasi-two-dimensional frustrated lattices by means of geometrical engineering.

  2. Structural and spectroscopic characterization of the macrocyclic complex: [Tb(CrO{sub 4})(H{sub 2}O)(C{sub 22}H{sub 26}N{sub 6})] {center_dot}0.5(Cr{sub 2}O{sub 7}){center_dot}(H{sub 2}O)

    SciTech Connect (OSTI)

    Ayala, J.D.; Bombieri, G.; Benetollo, F.

    1995-06-01

    The title complex was obtained by anion metathesis form [Tb(CH{sub 3}COO){sub 2}(C{sub 22}H{sub 26}N{sub 6})] (CH{sub 3}COO){center_dot}4H{sub 2}O and K{sub 2}CrO{sub 4} in aqueous solution. The compound crystallizes in the triclinic space group P1 with a = 8.384(2), b = 10.425(2) c = 15.752(2){angstrom}, {alpha} = 98.82(2), {beta} = 93.52(2), {gamma} = 97.22(2){degrees}, and Z = 2. The structure is ionic and consists of a (+1) complex cation balanced in a 2:1 ratio by a disordered dichromate ion. The 9-coordinate Tb(III) is linked to the six nitrogen atoms of the macrocyclic ligand L = C{sub 22}H{sub 26}N{sub 6}, as well as to a water molecule and a bidentate chelating chromate situated on opposite sides of the macrocycle. The infrared spectrum shows, in addition to the pattern of the macrocyclic ligand, the absorptions arising form the stretching modes of the bidentate chelating CrO{sub 4}{sup 2{minus}} ligand and of the Cr{sub 2}O{sub 7}{sup 2{minus}} counterion.

  3. BR UFF BIG PINEY WILD ROSE BLU E GAP BR UFF UNIT WAMSUT TER

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    Gasoline and Diesel Fuel Update (EIA)

    (1) and Robert King (2) (1) Z, Inc., (2) Energy Information Administration BIG PINEY TIP ... BLU E FOREST SWAN DEER HILL FOGART Y CREEK GREEN RIVER BEND DRY PINEY SWAN S HOGSBACK AREA ...

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    BOE Reserve Class No 2001 reserves 0.1 - 10 MBOE 10.1 - 100 MBOE 100.1 - 1,000 MBOE 1,000.1 - 10,000 MBOE 10,000.1 - 100,000 MBOE > 100,000 MBOE Basin Outline ID The mapped oil and gas field boundary outlines were created by the Reserves and Production Division, Office of Oil and Gas, Energy Information Administration pursuant to studies required by Section 604 of the Energy Policy and Conservation Act Amendments of 2000 (P.L. 106-469). The boundaries are not informed by subsurface structural

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    U.S. Energy Information Administration (EIA) Indexed Site

    Gas Reserve Class No 2001 gas reserves 0.1 - 10 MMCF 10.1 - 100 MMCF 100.1 - 1,000 MMCF 1,000.1 - 10,000 MMCF 10,000.1 - 100,000 MMCF > 100,000 MMCF Basin Outline ID The mapped oil and gas field boundary outlines were created by the Reserves and Production Division, Office of Oil and Gas, Energy Information Administration pursuant to studies required by Section 604 of the Energy Policy and Conservation Act Amendments of 2000 (P.L. 106-469). The boundaries are not informed by subsurface

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    Liquids Reserve Class No 2001 liquids reserves 0.1 - 10 Mbbl 10.1 - 100 Mbbl 100.1 - 1,000 Mbbl 1,000.1 - 10,000 Mbbl 10,000.1 - 100,000 Mbbl Basin Outline ID The mapped oil and gas field boundary outlines were created by the Reserves and Production Division, Office of Oil and Gas, Energy Information Administration pursuant to studies required by Section 604 of the Energy Policy and Conservation Act Amendments of 2000 (P.L. 106-469). The boundaries are not informed by subsurface structural

  9. Structural and magnetic properties of La{sub 1−x}Ce{sub x}Fe{sub 1−x}Cr{sub x}O{sub 3} orthoferrite prepared by co-precipitation method

    SciTech Connect (OSTI)

    Azab, A.A.; Helmy, N.; Albaaj, Sukrat

    2015-06-15

    Graphical abstract: TEM micrographs of La{sub 1−x}Ce{sub x}Fe{sub 1−x}Cr{sub x}O{sub 3} for x = 0.0. - Highlights: • The composition of La{sub 1−x}Ce{sub x}Fe{sub 1−x} Cr{sub x}O{sub 3} was prepared by co-precipitation method. • X-ray diffraction showed orthorhombic structure with space group Pnma. • With increasing Ce and Cr content, a decrease of the unit cell volume. • Enhancement in the coercivity (H{sub c}) with increasing Ce and Cr content. • Reduction of M{sub s} and M{sub r} up to x = 0.15 and increases with further increases of x. - Abstract: Nanocrystalline orthoferrites with the composition of La{sub 1−x}Ce{sub x}Fe{sub 1−x} Cr{sub x}O{sub 3} where (x = 0, 0.1, 0.15 and 0.2) were prepared by co-precipitation method. The structural and magnetic properties of the La{sub 1−x}Ce{sub x}Fe{sub 1−x}Cr{sub x}O{sub 3} system have been investigated. X-ray diffraction showed the formation of orthorhombic structure with space group Pnma for different compositions. With increasing Ce and Cr content, lattice parameters a and c were found to decrease while b increases, resulting in a decrease of the unit cell volume. The crystallite size was calculated from XRD data and compared with that obtained from TEM micrographs. Vibrating sample magnetometer measurements reveal an enhancement in the coercivity (H{sub c}) with increasing Ce and Cr content and reduction of saturation magnetization (M{sub s}) and remnant magnetization (M{sub r}) up to x = 0.15 and increases with further increases of x. The magnetic susceptibility measurements vs. temperature showed canted-antiferromagnetic (AFM) in which the Neel temperature is increasing with Ce and Cr content.

  10. Structurally-driven metal-insulator transition in Ca{sub 2}Ru{sub 1-x}Cr{sub x}O{sub 4} (0{<=}x<0.14): A single crystal X-ray diffraction study

    SciTech Connect (OSTI)

    Qi, T.F.; Ge, M.; Korneta, O.B.; Parkin, S.; De Long, L.E.; Cao, G.

    2011-04-15

    Correlation between structure and transport properties are investigated in high-quality single-crystals of Ca{sub 2}Ru{sub 1-x}Cr{sub x}O{sub 4} with 0Cr doping and with decreasing temperature. A strong suppression of structural distortions with increasing Cr substitution was identified. No clear T{sub MI} can be observed when x>13.5% and the system behaves as an insulator. Such a large, sharp metal-insulator transition and tuneable transition temperature may have potential applications in electronic devices. -- Graphical abstract: The metal-insulator transition temperature (T{sub MI}) was drastically reduced by Cr doping, and is closely related to the distortion of structure. Display Omitted Research highlights: {yields} The metal-insulator transition temperature (T{sub MI}) was drastically reduced by doping Cr into Ca{sub 2}RuO{sub 4} single crystal. {yields} Detailed single crystal structural analysis provided important insight into this structurally-driven metal-insulator transition. {yields} Negative Volume Thermal Expansion (NVTE) was observed with increasing temperature.

  11. The bonding, charge distribution, spin ordering, optical, and elastic properties of four MAX phases Cr{sub 2}AX (A = Al or Ge, X = C or N): From density functional theory study

    SciTech Connect (OSTI)

    Li, Neng; Mo, Yuxiang; Ching, Wai-Yim

    2013-11-14

    In this work, we assess a full spectrum of properties (chemical bonding, charge distribution, spin ordering, optical, and elastic properties) of Cr{sub 2}AC (A = Al, Ge) and their hypothetical nitride counterparts Cr{sub 2}AN (A = Al, Ge) based on density functional theory calculations. The calculated total energy values indicate that a variety of spin ordering of these four compounds depending on interlayer-interactions between M-A and M-X within the sublattice, which is supported by bonding analysis. MAX phase materials are discovered to possess exotic magnetic properties which indicates that these materials could serve as promising candidates for novel layered magnetic materials for various electronic and spintronic applications. Further analysis of optical properties for two polarization vectors of Cr{sub 2}AX shows that the reflectivity is high in the visible-ultraviolet region up to ∼15 eV suggesting Cr{sub 2}AX as a promising candidate for use as a coating material. The elastic coefficients (C{sub ij}) and bulk mechanical properties [bulk modulus (K), shear modulus (G), Young's modulus (E), Poisson's ratio (η), and Pugh ratio (G/K)] of these four Cr{sub 2}AX compounds are also calculated and analyzed, which pave the way to predict or design new MAX phases that are less brittle or tougher by having a lower G/K value or higher η.

  12. Neutron diffraction study of the crystal structure and structural phase transition of La{sub 0.7}Ca{sub 0.3-x}Sr{sub x}CrO{sub 3} (0<=x<=0.3)

    SciTech Connect (OSTI)

    Omoto, Kazuki; Norberg, Stefan T.; Hull, Steve; Aoto, Akimitsu; Hashimoto, Takuya

    2010-02-15

    The crystal structure of the La{sub 0.7}Ca{sub 0.3-x}Sr{sub x}CrO{sub 3} series, including the compositional and temperature dependence of the structural parameters, has been studied by variable temperature neutron diffraction measurements. The extent of the distortions from the ideal cubic perovskite structure has been evaluated quantitatively using the average bond lengths and the mean volumes of the [CrO{sub 6}] octahedron and [(La/Ca/Sr)O{sub 12}] polyhedron, and has been shown to decrease with increase of Sr content or temperature. At the structural phase transition from the orthorhombic (Pnma) structure to the rhombohedral (R3-barc) one, the volume of the [CrO{sub 6}] octahedron decreases whereas that of the [(La/Ca/Sr)O{sub 12}] polyhedron shows little difference, resulting in an overall decrease in the level of distortion. The change in the degree of distortion at the phase transition decreases with increase of Sr content, in agreement with the smaller variation of the enthalpy and volume for the specimens with higher Sr content. - Graphical abstract: Temperature dependence of parameter, PHI, representing the extent of distortion from the ideal cubic perovskite structure, for La{sub 0.7}Ca{sub 0.3}CrO{sub 3} (diamonds) and La{sub 0.7}Ca{sub 0.15}Sr{sub 0.15}CrO{sub 3} (circles) calculated from neutron diffraction patterns.

  13. Evaluation of 2.25Cr-1Mo Alloy for Containment of LiCl/KCl Eutectic during the Pyrometallurgical Processing of Used Nuclear Fuel

    SciTech Connect (OSTI)

    B.R. Westphal; S.X. Li; G.L. Fredrickson; D. Vaden; T.A. Johnson; J.C. Wass

    2011-03-01

    Recovery of uranium from the Mk-IV and Mk-V electrorefiner vessels containing a LiCl/KCl eutectic salt has been on-going for 14 and 12 years, respectively, during the pyrometallurgical processing of used nuclear fuel. Although austenitic stainless steels are typically utilized for LiCl/KCl salt systems, the presence of cadmium in the Mk-IV electrorefiner dictates an alternate material. A 2.25Cr-1Mo alloy (ASME SA-387) was chosen due to the absence of nickel in the alloy which has a considerable solubility in cadmium. Using the transition metal impurities (iron, chromium, nickel, molybdenum, and manganese) in the electrorefined uranium products, an algorithm was developed to derive values for the contribution of the transition metals from the various input sources. Weight loss and corrosion rate data for the Mk-V electrorefiner vessel were then generated based on the transition metal impurities in the uranium products. To date, the corrosion rate of the 2.25Cr-1Mo alloy in LiCl/KCl eutectic is outstanding assuming uniform (i.e. non-localized) conditions.

  14. The effect of annealing on the transformation and the microstructure of Mn{sub 1?x}Cr{sub x}CoGe alloys

    SciTech Connect (OSTI)

    Torrens-Serra, J., E-mail: j.torrens@uib.es [Departament de Fsica, Universitat de les Illes Balears, Cra. Valldemossa km 7.5, E-07122 Palma de Mallorca (Spain); Biffi, C.A. [Consiglio Nazionale delle Ricerche CNRIENI, C.so P.Sposi 29, 23900 Lecco (Italy); Santamarta, R. [Departament de Fsica, Universitat de les Illes Balears, Cra. Valldemossa km 7.5, E-07122 Palma de Mallorca (Spain); Recarte, V.; Prez-Landazbal, J.I. [Departamento de Fsica, Universidad Pblica de Navarra, Campus de Arrosada, E-31006 Pamplona (Spain); Tuissi, A. [Consiglio Nazionale delle Ricerche CNRIENI, C.so P.Sposi 29, 23900 Lecco (Italy); Cesari, E. [Departament de Fsica, Universitat de les Illes Balears, Cra. Valldemossa km 7.5, E-07122 Palma de Mallorca (Spain)

    2014-07-01

    In this work the effect of different thermal treatments on the transformation behavior of Mn{sub 1?x}Cr{sub x}CoGe alloys, with x = 0.15 and 0.20 has been analyzed. The changes in the transformation temperatures have been studied by differential scanning calorimetry (DSC). The results show that the structural transition temperature depends on the previous annealing. However, under the same heat treatment no significant change is observed on the transformation temperatures when replacing Mn by Cr. The microstructural evolution has been monitored using in-situ X-ray diffraction and transmission electron microscopy. The effect of an applied magnetic field on the transformation has been explored by SQUID magnetometry. Two different magnetic transitions are found: a first order paramagnetic (PM) to ferromagnetic (FM) corresponding to the transformation observed by calorimetry and a re-entrant spin glass to ferromagnetic transition. - Highlights: The annealing conditions determine the magnetostructural transition. A laminar microstructure along preferential planes observed by TEM A RSG to ferromagnetic transition at low temperatures is detected.

  15. Evaluating the Relationship between Slabbing of Cr2O3/MgO Refractories Used in Steelmaking and Spalling of High Chrome Oxide Refractories Used in Gasification

    SciTech Connect (OSTI)

    Bennett, J.P.; Thomas, H.; Kwong, K.-S.

    2006-10-01

    Because of its excellent corrosion resistance and high temperature properties, chrome oxide refractories have been used in a number of severe service environments, including steelmaking and gasification. Refractory failure of Cr2O3/MgO or MgO/Cr2O3 refractories in steelmaking can involve a phenomena called slabbing, peeling, or chemical spalling. A similar failure mechanism exists in the high chrome oxide materials used in gasification. Gasifiers contain the reaction between a carbon feedstock, water, and oxygen under reducing conditions; producing H2 and CO used in chemicals or as fuel for power plants. A slagging gasifier typically operates between 1250- 1575C, and with pressures between 300-1000 psi. Gasification refractory failure is by chemical dissolution and/or by spalling. Spalling is caused by slag penetration of the porous refractory surface and by expansion differences between the penetrated/non-penetrated areas, and is exacerbated by thermal cycling. Similarities between slabbing of steelmaking refractories and spalling of gasification refractories will be discussed.

  16. Spin-Orbit Coupling Induced Anisotropy in the Magnetotransport of the Chiral Helimagnet Cr1=3NbS2

    SciTech Connect (OSTI)

    Mandrus, D.; Parker, David S; Ghimire, Nirmal J; Bornstein, Alexander; Chapman, Benjamin; Lee, Minyhea

    2015-01-01

    Understanding the role of spin-orbit coupling (SOC) has been crucial for controlling magnetic anisotropy in magnetic multilayer films. It has been shown that electronic structure can be altered via interface SOC by varying the superlattice structure, resulting in spontaneous magnetization perpendicular or parallel to the plane. In lieu of magnetic thin films, we study the similarly anisotropic helimagnet Cr1/3NbS2 where the spin-polarization direction, controlled by the applied magnetic field, can modify the electronic structure. As a result, the direction of spin polarization can modulate the density of states and in turn affect the in-plane electrical conductivity. In Cr1/3NbS2, we found an enhancement of in-plane conductivity when the spin polarization is out-of-plane as compared to in-plane spin polarization. This is consistent with the increase in density of states near the Fermi energy at the same spin configuration, found from first-principles calculations. We also observe unusual field dependence of the Hall signal in the same temperature range. This is unlikely to originate from the noncollinear spin texture but rather further indicates strong dependence of electronic structure on spin orientation relative to the plane.

  17. Kondo effect in the paramagnetic phase of CrFe alloy with the spin-density-wave suppressed by pressure or V doping

    SciTech Connect (OSTI)

    Galkin, V.Y.; de Camargo, P.C.; Budko, S.L.; Saitovitch, E.B.; Fawcett, E.

    1997-04-01

    The pressure dependence of the resistivity {rho}(T) of (Cr+2.7 at.{percent}Fe){sub 98}V{sub 2} is measured, following a previous study of the temperature dependence of {rho}(T) in the spin-density-wave (SDW) alloy system, (Cr+2.7 at.{percent} Fe){sub 1{minus}x}(V,Mn){sub x}. The minimum in {rho}(T) in the V-doped alloys seen at T{approx_gt}T{sub N} for x{gt}1 at.{percent} is found to move to lower temperatures under pressure p in the alloy containing 2 at.{percent} V, decreasing in magnitude, and eventually, as the Neel temperature T{sub N} goes to zero at p{approx}10 kbar, becoming a very shallow minimum followed by a maximum and a rapid decrease as T{r_arrow}4.2 K. This latter behavior in the paramagnetic phase is believed to be due to the Kondo effect, while the pressure dependent minimum in {rho}(T) in the SDW phase is a manifestation of impurity resonance scattering. {copyright} {ital 1997 American Institute of Physics.}

  18. A method for in situ absolute DD yield calibration of neutron time-of-flight detectors on OMEGA using CR-39-based proton detectors

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Waugh, C. J.; Rosenberg, M. J.; Zylstra, A. B.; Frenje, J. A.; Seguin, F. H.; Petrasso, R. D.; Glebov, V. Yu.; Sangster, T. C.; Stoeckl, C.

    2015-05-27

    Neutron time of flight (nTOF) detectors are used routinely to measure the absolute DD neutron yield at OMEGA. To check the DD yield calibration of these detectors, originally calibrated using indium activation systems, which in turn were cross-calibrated to NOVA nTOF detectors in the early 1990s, a direct in situ calibration method using CR-39 range filter proton detectors has been successfully developed. By measuring DD neutron and proton yields from a series of exploding pusher implosions at OMEGA, a yield calibration coefficient of 1.09 0.02 (relative to the previous coefficient) was determined for the 3m nTOF detector. In addition,morecomparison of these and other shots indicates that significant reduction in charged particle flux anisotropies is achieved when bang time occurs significantly (on the order of 500 ps) after the trailing edge of the laser pulse. This is an important observation as the main source of the yield calibration error is due to particle anisotropies caused by field effects. The results indicate that the CR-39-nTOF in situ calibration method can serve as a valuable technique for calibrating and reducing the uncertainty in the DD absolute yield calibration of nTOF detector systems on OMEGA, the National Ignition Facility, and laser megajoule.less

  19. Characterization of solid state nuclear track detectors of the polyallyl-diglycol-carbonate (CR-39/PM-355) type for light charged particle spectroscopy

    SciTech Connect (OSTI)

    Malinowska, A. Jask?a, M.; Korman, A.; Kuk, M.; Szyd?owski, A.

    2014-12-15

    This paper presents a method which uses the characteristics of the etch pits induced in a polyallyl-diglycol-carbonate (PADC) detector of the CR-39/PM-355 type to estimate particle energy. This method is based on the data provided by a semiautomatic system that selects tracks according to two parameters, crater diameters, and mean gray level values. In this paper we used the results of the calibration measurements that were obtained in our laboratory in the period 20002014. Combining the information on the two parameters it is possible to determine unambiguously the incident projectile energy values. The paper presents the results of an attempt to estimate the energy resolution of the method when analyzing the tracks produced in the CR-39/PM-355 detector by energetic ions such as alpha particles, protons, and deuterons. We discuss the energy resolution of the measurement of light charged particle energy which is based on the parameters (crater diameter and mean gray level value) of tracks induced in solid state nuclear track detectors of the PADC type.

  20. A Successful Synthesis of the CoCrFeNiAl{sub 0.3} Single-Crystal, High-Entropy Alloy by Bridgman Solidification

    SciTech Connect (OSTI)

    Ma, S. G.; Zhang, S. F.; Gao, M. C.; Liaw, P. K.; Zhang, Y.

    2013-12-01

    For the first time, a face-centered-cubic, single-crystal CoCrFeNiAl{sub 0.3} (designated as Al0.3), high-entropy alloy (HEA) was successfully synthesized by the Bridgman solidification (BS) method, at an extremely low withdrawal velocity through a constant temperature gradient, for which it underwent two BS steps. Specially, at the first BS step, the alloy sample underwent several morphological transitions accompanying the crystal growth from the melt. This microstructure evolves from as-cast dendrites, to equiaxed grains, and then to columnar crystals, and last to the single crystal. In particular, at the equiaxed-grain region, some visible annealing twins were observed, which indicates a low stacking fault energy of the Al0.3 alloy. Although a body-centered- cubic CoCrFeNiAl (Al1) HEA was also prepared under the same conditions, only a single columnar-crystal structure with instinctively preferential crystallographic orientations was obtained by the same procedure. A similar morphological transition from dendrites to equiaxed grains occurred at the equiaxed-grain region in Al1 alloy, but the annealing twins were not observed probably because a higher Al addition leads to a higher stacking fault energy for this alloy.