National Library of Energy BETA

Sample records for malta pf paracel

  1. Malta: Energy Resources | Open Energy Information

    Open Energy Info (EERE)

    Tons NA 2008 EIA Natural Gas Reserves 0 Cubic Meters (cu m) 113 2010 CIA World Factbook Oil Reserves 0 Barrels (bbl) 138 2010 CIA World Factbook Energy Maps featuring Malta Malta...

  2. Malta, New York: Energy Resources | Open Energy Information

    Open Energy Info (EERE)

    Malta is a town in Saratoga County, New York.1 Registered Energy Companies in Malta, New York Saratoga Technology Energy Park STEP References US Census Bureau Incorporated...

  3. 21PF overpack problems

    SciTech Connect (OSTI)

    Kovac, F.M.

    1995-12-31

    The 21PF overpack has had severe metal corrosion and stress corrosion cracking (SCC) for many years. The US Department of Transportation (DOT) and the US Nuclear Regulatory Commission (NRC) have disallowed the use of overpacks containing high chloride foam. Corrosion and SCC of 21PF overpacks have been documented and papers have been presented at conferences about these issues. Regulatory agencies have restricted 21PF overpack use and have requested data to determine if phenolic foam overpacks not meeting original design specifications will be authorized for continued use. This paper details some of the problems experienced by users and relates actions of the DOT and NRC concerning these packages. Industry is working to correct deficiencies, but if they are not successful, the entire uranium enrichment industry will be severely impacted.

  4. Los Alamos National Laboratory Plutonium Facility (PF-4) Seismic Safety |

    Office of Environmental Management (EM)

    Department of Energy Laboratory Plutonium Facility (PF-4) Seismic Safety Los Alamos National Laboratory Plutonium Facility (PF-4) Seismic Safety Los Alamos National Laboratory Plutonium Facility (PF-4) Seismic Safety PDF icon Los Alamos National Laboratory Plutonium Facility (PF-4) Seismic Safety More Documents & Publications EIS-0236-SA-06: Draft Supplement Analysis FPD's Perspective Photos - Los Alamos National Labratory - NISA EIS-0236-SA-06: Final Supplement Analysis

  5. Thermal Stability of LiPF 6 Salt and Li-ion Battery Electrolytes Containing LiPF

    Office of Scientific and Technical Information (OSTI)

    Thermal Stability of LiPF 6 Salt and Li-ion Battery Electrolytes Containing LiPF 6 Hui Yang a, *, Guorong V. Zhuang b, * ,z and Philip N. Ross, Jr. b, * Environmental Energy Technologies Division a and Materials Sciences Division b Lawrence Berkeley National Laboratory University of California, Berkeley, CA 94720 Abstract The thermal stability of the neat LiPF 6 salt and of 1 molal solutions of LiPF 6 in prototypical Li-ion battery solvents was studied with thermogravimetric analysis (TGA) and

  6. TPX: Contractor preliminary design review. Volume 2, PF systems engineering

    SciTech Connect (OSTI)

    Calvin, H.A.

    1995-07-28

    This system development specification covers the Poloidal Field (PF) Magnet System, WBS 14 in the Princeton Plasma Physics Laboratory TPX Program to build a tokamak fusion reactor. This specification establishes the performance, design, development and test requirements of the PF Magnet System.

  7. Structural basis of HIV-1 capsid recognition by PF74 and CPSF6

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

    Bhattacharya, Akash; Alam, Steven L.; Fricke, Thomas; Zadrozny, Kaneil; Sedzicki, Jaroslaw; Taylor, Alexander B.; Demeler, Borries; Pornillos, Owen; Ganser-Pornillos, Barbie K.; Diaz-Griffero, Felipe; et al

    2014-12-17

    Upon infection of susceptible cells by HIV-1, the conical capsid formed by ~250 hexamers and 12 pentamers of the CA protein is delivered to the cytoplasm. In this study, the capsid shields the RNA genome and proteins required for reverse transcription. In addition, the surface of the capsid mediates numerous host–virus interactions, which either promote infection or enable viral restriction by innate immune responses. In the intact capsid, there is an intermolecular interface between the N-terminal domain (NTD) of one subunit and the C-terminal domain (CTD) of the adjacent subunit within the same hexameric ring. The NTD–CTD interface is criticalmore » for capsid assembly, both as an architectural element of the CA hexamer and pentamer and as a mechanistic element for generating lattice curvature. Here we report biochemical experiments showing that PF-3450074 (PF74), a drug that inhibits HIV-1 infection, as well as host proteins cleavage and polyadenylation specific factor 6 (CPSF6) and nucleoporin 153 kDa (NUP153), bind to the CA hexamer with at least 10-fold higher affinities compared with nonassembled CA or isolated CA domains. The crystal structure of PF74 in complex with the CA hexamer reveals that PF74 binds in a preformed pocket encompassing the NTD–CTD interface, suggesting that the principal inhibitory target of PF74 is the assembled capsid. Likewise, CPSF6 binds in the same pocket. Given that the NTD–CTD interface is a specific molecular signature of assembled hexamers in the capsid, binding of NUP153 at this site suggests that key features of capsid architecture remain intact upon delivery of the preintegration complex to the nucleus.« less

  8. Structural basis of HIV-1 capsid recognition by PF74 and CPSF6

    SciTech Connect (OSTI)

    Bhattacharya, Akash; Alam, Steven L.; Fricke, Thomas; Zadrozny, Kaneil; Sedzicki, Jaroslaw; Taylor, Alexander B.; Demeler, Borries; Pornillos, Owen; Ganser-Pornillos, Barbie K.; Diaz-Griffero, Felipe; Ivanov, Dmitri N.; Yeager, Mark

    2014-12-17

    Upon infection of susceptible cells by HIV-1, the conical capsid formed by ~250 hexamers and 12 pentamers of the CA protein is delivered to the cytoplasm. In this study, the capsid shields the RNA genome and proteins required for reverse transcription. In addition, the surface of the capsid mediates numerous hostvirus interactions, which either promote infection or enable viral restriction by innate immune responses. In the intact capsid, there is an intermolecular interface between the N-terminal domain (NTD) of one subunit and the C-terminal domain (CTD) of the adjacent subunit within the same hexameric ring. The NTDCTD interface is critical for capsid assembly, both as an architectural element of the CA hexamer and pentamer and as a mechanistic element for generating lattice curvature. Here we report biochemical experiments showing that PF-3450074 (PF74), a drug that inhibits HIV-1 infection, as well as host proteins cleavage and polyadenylation specific factor 6 (CPSF6) and nucleoporin 153 kDa (NUP153), bind to the CA hexamer with at least 10-fold higher affinities compared with nonassembled CA or isolated CA domains. The crystal structure of PF74 in complex with the CA hexamer reveals that PF74 binds in a preformed pocket encompassing the NTDCTD interface, suggesting that the principal inhibitory target of PF74 is the assembled capsid. Likewise, CPSF6 binds in the same pocket. Given that the NTDCTD interface is a specific molecular signature of assembled hexamers in the capsid, binding of NUP153 at this site suggests that key features of capsid architecture remain intact upon delivery of the preintegration complex to the nucleus.

  9. Independent Review of Siesmic Performance Assessments for the Plutonium Facility PF-4

    SciTech Connect (OSTI)

    Whittaker, Andrew; Goen, Lawrence Kenneth; Kennedy, Robert; McDonald, Brian; Morgan, Troy; Wyllie, Loring

    2015-11-25

    The Plutonium Facility, designated PF-4, is located in Technical Area 55 at the Los Alamos National Laboratory (LANL). The facility is a one-story rectangular structure above a complete basement; the building was constructed of cast-in-place reinforced concrete, with small interior frames of structural steel. The plan dimensions of the building are 265’×284’. The overall height of the building varies between 39’-0” at the north and south ends, and 40’-6” at the center ridge. The programmatic work performed in the building is vital to our national security and its functions and storage purposes are not replicated elsewhere in the United States Department of Energy (DOE).

  10. Ultrafast gigantic photo-response in (EDO-TTF)2PF6 initiated by 10-fs laser pulses

    SciTech Connect (OSTI)

    Schoenlein, Robert William; Itatani, Jiro; Rini, Matteo; Cavalleri, Andrea; Onda, Ken; Ishikawa, Tadahiko; Koshihara, Shin-ya; Shao, Xiangfeng; Yamochi, Hideki; Saito, Gunzi; Schoenlein, Robert W.

    2006-08-07

    We photo-exited a charge-ordered organic salt (EDO-TTF)2PF6 with sub-10-fs optical pulses. The photo-induced metallic phase appeared within 80-fs after pumping, characterized by large changes in reflectivity (DELTA R/R~0.8) followed by strong coherent phonon modulation

  11. Direct measurement of the chemical reactivity of silicon electrodes with LiPF6-based battery electrolytes

    SciTech Connect (OSTI)

    Veith, Gabriel M; Baggetto, Loic; Sacci, Robert L; Unocic, Raymond R; Tenhaeff, Wyatt E; Browning, Jim

    2014-01-01

    We report the first direct measurement of the chemistry and extent of reactivity between a lithium ion battery electrode surface (Si) and a liquid electrolyte (1.2M LiPF6-3:7 wt% ethylene carbonate:dimethyl carbonate). This layer is estimated to be 3.6 nm thick and partially originates from the consumption of the silicon surface.

  12. Coupling of TRAC-PF1/MOD2, Version 5.4.25, with NESTLE

    SciTech Connect (OSTI)

    Knepper, P.L.; Hochreiter, L.E.; Ivanov, K.N.; Feltus, M.A.

    1999-09-01

    A three-dimensional (3-D) spatial kinetics capability within a thermal-hydraulics system code provides a more correct description of the core physics during reactor transients that involve significant variations in the neutron flux distribution. Coupled codes provide the ability to forecast safety margins in a best-estimate manner. The behavior of a reactor core and the feedback to the plant dynamics can be accurately simulated. For each time step, coupled codes are capable of resolving system interaction effects on neutronics feedback and are capable of describing local neutronics effects caused by the thermal hydraulics and neutronics coupling. With the improvements in computational technology, modeling complex reactor behaviors with coupled thermal hydraulics and spatial kinetics is feasible. Previously, reactor analysis codes were limited to either a detailed thermal-hydraulics model with simplified kinetics or multidimensional neutron kinetics with a simplified thermal-hydraulics model. The authors discuss the coupling of the Transient Reactor Analysis Code (TRAC)-PF1/MOD2, Version 5.4.25, with the NESTLE code.

  13. Computational Studies of [Bmim][PF6]/n-Alcohol Interfaces with Many-Body Potentials

    SciTech Connect (OSTI)

    Chang, Tsun-Mei; Dang, Liem X.

    2014-09-04

    In this paper, we present the results from molecular-dynamics simulations of the equilibrium properties of liquid/liquid interfaces of room temperature ionic liquid [bmim][PF6] and simple alcohols (i.e., methanol, 1-butanol, and 1-hexanol) at room temperature. Polarizable potential models are employed to describe the interactions among species. Results from our simulations show stable interfaces between the ionic liquid and n-alcohols, and we found that the interfacial widths decrease from methanol to 1-butanol systems, and then increase for 1-hexanol interfaces. Angular distribution analysis reveals that the interface induces a strong orientational order of [bmim] and n-alcohol molecules near the interface, with [bmim] extending its butyl group into the alcohol phase while the alcohol has the OH group pointing into the ion liquid region, which is consistent with the recent sum-frequency-generation experiments. We found the interface to have a significant influence on the dynamics of ionic liquids and n-alcohols. The orientational autocorrelation functions illustrate that [bmim] rotate more freely near the interface than in the bulk, while the rotation of n-alcohol is hindered at the interface. Additionally, the time scale associated with the diffusion along the interfacial direction is found to be faster for [bmim] but slowed down for n-alcohols approaching the interface. We also calculate the dipole moment of n-alcohols as a function of the distance normal to the interface. We found that, even though methanol and 1-butanol have different dipole moments in bulk phase, they reach a similar value at the interface. This work was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences. Pacific Northwest National Laboratory is a multiprogram national laboratory operated for the Department of Energy by Battelle. The calculations were carried out using computer resources provided by the Office of Basic Energy Sciences.

  14. TRAC-PF1/MOD1 US/Japanese PWR conservative LOCA prediction

    SciTech Connect (OSTI)

    Gruen, G E; Fisher, J E

    1987-11-01

    This report documents the results of a 200%, double-ended, cold-leg-break, loss-of-coolant-accident (LOCA) calculation using the TRAC-PF1/MOD1 computer code. The reactor system represented a typical United States/Japanese pressurized water reactor with a 15 x 15 fuel bundle arrangement 12-ft long, four loops, and cold-leg Emergency Core Cooling (ECC) Systems. Conservation boundary and initial conditions were used. Reactor power was 102% of the 3250 MWt rated power, decay heat was set to 120% of American Nuclear Society Standard 5.1, highest core lifetime values for power peaking and fuel stored energy were used, and the LOCA occurred simultaneously with a loss of offsite power. Best estimate assumptions were used for the break flow model, fuel rod heat transfer and metal-water reaction correlations, and steady-state fuel temperature profiles. A flow blockage model, having the capability to account for the effects of cladding ballooning or rupturing, was not used. Except for these best estimate assumptions, the boundary and initial conditions were consistent with those used in licensing calculations. Maximum fuel rod temperatures were 1380 K (2020/sup 0/F) and 1040 K (1410/sup 0/F) on the hottest evaluation model rod and hottest best estimate rod, respectively. The high reported values or fuel cladding temperature were a direct consequence of the conservative boundary and initial conditions used for the calculation, primarily the 2% overpower condition, the core decay heat assumption, and the degraded ECCS. The calculation demonstrated successful core reflooding before 1478 K (2200/sup 0/F) cladding temperature was exceeded on any fuel rod. 7 refs., 47 figs., 5 tabs.

  15. Molecular dynamics study of the effect of alkyl chain length on melting points of [CnMIM][PF6] ionic liquids

    SciTech Connect (OSTI)

    Zhang, Y; Maginn, EJ

    2014-01-01

    Based on molecular dynamics simulations, the melting points T-m of a series of 1-alkyl-3-methylimidazolium hexafluorophosphate ionic liquids [CnMIM][PF6] with n = 2, 4, 10, 12, and 14 were studied using the free energy-based pseudosupercritical path (PSCP) method. The experimental trend that the Tm decreases with increasing alkyl chain length for ILs with short alkyl chains and increases for the ones with long alkyl chains was correctly captured. Further analysis revealed that the different trends are the results of the balance between fusion enthalpy and fusion entropy. For the ILs with short alkyl chains (ethyl and butyl groups), fusion entropy plays the dominant role so that [C4MIM][PF6], which has a larger fusion entropy due to its higher liquid phase entropy has the lower melting temperature. As for the ILs with long alkyl chains, due to the enhanced van der Waals interactions brought about by the long non-polar alkyl chains, enthalpy becomes the deciding factor and the melting points increase when the alkyl chain goes from C10 to C14. While the melting points for [C2MIM][PF6] and [C4MIM][PF6] were quantitatively predicted and the trends for the long chain ILs were captured correctly, the absolute melting points for [C10MIM][PF6], [C12MIM][PF6] and [C14MIM][PF6] were systematically overestimated in the simulations. Three possible reasons for the overestimation were studied but all ruled out. Further simulation or experimental studies are needed to explain the difference.

  16. Refurbishment and modification of existing protective shipping packages (for 30-inch UF{sub 6} cylinders) per USDOT specification No. USA-DOT-21PF-1A

    SciTech Connect (OSTI)

    Housholder, W.R.

    1991-12-31

    This paper addresses the refurbishment procedures for existing shipping containers for 30-inch diameter UF{sub 6} cylinders in accordance with DOT Specification 21PF-1 and the criteria used to determine rejection when such packages are unsuitable for refurbishment.

  17. TRAC-PF1/MOD1 independent assessment: Semiscale Mod-2A intermediate break test S-IB-3

    SciTech Connect (OSTI)

    Kmetyk, L N

    1986-02-01

    The TRAC-PF1/MOD1 independent assessment project at Sandia National Laboratories is part of an overall effort funded by the NRC to determine the ability of various system codes to predict the detailed thermal/hydraulic response of light water reactors during accident and off-normal conditions. The TRAC code is being assessed at SNLA against test data from various integral and separate effects test facilities. As part of this assessment matrix, an intermediate break test (S-IB-3), performed at the Semiscale Mod-2A facility, has been analyzed. Using an input model with a 3-D VESSEL component, the vessel and downcomer inventories during 3-IB-3 were generally well predicted, but the core heatup was underpredicted compared to data. An equivalent calculation with an all 1-D input model ran about twice as fast as our basecase analysis using a 3-D VESSEL in the input model, but the results of the two calculations diverged significantly for many parameters of interest, with the 3-D VESSEL model results in better agreement with data. 22 refs., 100 figs.

  18. TRAC-PF1/MOD1 analysis of a 200% cold-leg break in a US/Japanese PWR with four loops and 15 x 15 fuel

    SciTech Connect (OSTI)

    Spore, J.W.; Cappiello, M.W.

    1986-01-01

    This report presents the results of a TRAC-PF1/MOD1 calculation that simulated a 200% double-ended cold-leg-break loss-of-coolant accident in a generic US/Japanese pressurized water reactor. This is a best-estimate analysis using conservative boundary conditions and minimum safeguards. The calculation shows that the peak cladding temperature (PCT) occurs during blowdown and that the core reheat is minimal during reflood. The results also show that for an evaluation-model peak rod linear power of 15.85 kW/ft, a PCT of 1084 K is reached at 3.5 s into the blowdown transient, which is approx.394 K below the design basis limit of 1478 K. 10 figs.

  19. Structure/function studies of resorcinol-formaldehyde (R-F) and phenol-formaldehyde (P-F) copolymer ion-exchange resins

    SciTech Connect (OSTI)

    Hubler, T.L.; Franz, J.A.; Shaw, W.J.; Hogan, M.O.; Hallen, R.T.; Brown, G.N.; Linehan, J.C.

    1996-09-01

    he U.S. Department of Energy`s (DOE) Hanford Site was established to produce plutonium for the U.S. defense mission. Over the course of decades, hazardous, toxic, and radioactive chemical wastes were generated and disposed of in a variety of ways including storage in underground tanks. An estimated 180 million tons of high-level radioactive wastes are stored in 177 underground storage tanks. During production of fissile plutonium, large quantities of 90Sr and 137CS were produced. The high abundance and intermediate length half- lives of these fission products are the reason that effort is directed toward selective removal of these radionuclides from the bulk waste stream before final tank waste disposal is effected. Economically, it is desirable to remove the highly radioactive fraction of the tank waste for vitrification. Ion-exchange technology is being evaluated for removing cesium from Hanford Site waste tanks. This report summarizes data and analysis performed by Pacific Northwest National Laboratory (PNNL)for both resorcinol-formaldehyde (R-F) and phenol-formaldehyde (P-F) resins and relates their observed differences in performance and chemical stability to their structure. The experimental approach used to characterize the resins was conducted using primarily two types of data: batch distribution coefficients (Kds) and solid-state 13C NMR. Comparison of these data for a particular resin allowed correlation of resin performance to resin structure. Additional characterization techniques included solid-state 19F NMR, and elemental analyses.

  20. TRAC-PF1/MOD1: an advanced best-estimate computer program for pressurized water reactor thermal-hydraulic analysis

    SciTech Connect (OSTI)

    Liles, D.R.; Mahaffy, J.H.

    1986-07-01

    The Los Alamos National Laboratory is developing the Transient Reactor Analysis Code (TRAC) to provide advanced best-estimate predictions of postulated accidents in light-water reactors. The TRAC-PF1/MOD1 program provides this capability for pressurized water reactors and for many thermal-hydraulic test facilities. The code features either a one- or a three-dimensional treatment of the pressure vessel and its associated internals, a two-fluid nonequilibrium hydrodynamics model with a noncondensable gas field and solute tracking, flow-regime-dependent constitutive equation treatment, optional reflood tracking capability for bottom-flood and falling-film quench fronts, and consistent treatment of entire accident sequences including the generation of consistent initial conditions. The stability-enhancing two-step (SETS) numerical algorithm is used in the one-dimensional hydrodynamics and permits this portion of the fluid dynamics to violate the material Courant condition. This technique permits large time steps and, hence, reduced running time for slow transients.

  1. Lithium Ethylene Dicarbonate Identified as the Primary Product ofChemical and Electrochemical Reduction of EC in EC:EMC/1.2M LiPF6Electrolyte

    SciTech Connect (OSTI)

    Zhuang, Guorong V.; Xu, Kang; Yang, Hui; Jow, T. Richard; RossJr., Philip N.

    2005-05-11

    Lithium ethylene dicarbonate (CH2OCO2Li)2 was chemically synthesized and its Fourier Transform Infrared (FTIR) spectrum was obtained and compared with that of surface films formed on Ni after cyclic voltammetry (CV) in 1.2M lithium hexafluorophosphate(LiPF6)/ethylene carbonate (EC): ethyl methyl carbonate (EMC) (3:7, w/w) electrolyte and on metallic lithium cleaved in-situ in the same electrolyte. By comparison of IR experimental spectra with that of the synthesized compound, we established that the title compound is the predominant surface species in both instances. Detailed analysis of the IR spectrum utilizing quantum chemical (Hartree-Fock) calculations indicates that intermolecular association through O...Li...O interactions is very important in this compound. It is likely that the title compound in passivation layer has a highly associated structure, but the exact intermolecular conformation could not be established based on analysis of the IR spectrum.

  2. Pf/Zeolite Catalyst for Tritium Stripping

    SciTech Connect (OSTI)

    Hsu, R.H.

    2001-03-26

    This report described promising hydrogen (protium and tritium) stripping results obtained with a Pd/zeolite catalyst at ambient temperature. Preliminary results show 90-99+ percent tritium stripping efficiency may be obtained, with even better performance expected as bed configuration and operating conditions are optimized. These results suggest that portable units with single beds of the Pd/zeolite catalyst may be utilized as ''catalytic absorbers'' to clean up both tritium gas and tritiated water. A cart-mounted prototype stripper utilizing this catalyst has been constructed for testing. This portable stripper has potential applications in maintenance-type jobs such as tritium line breaks. This catalyst can also potentially be utilized in an emergency stripper for the Replacement Tritium Facility.

  3. Pageflex Server [document: PF4577458_00001]

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

    Protect your vision with VSP. Get the best in eyecare and eyewear with Los Alamos National Labs and VSP ® Vision Care. At VSP, we invest in the things you value most-the best care at the lowest out-of-pocket costs. Because we're the only national not-for-profit vision care company, you can trust that we'll always put your wellness first. You'll like what you see with VSP. * Value and Savings. You'll enjoy more value and the lowest out-of-pocket costs. * High Quality Vision Care. You'll get the

  4. Microsoft Word - S04617_PF.doc

    Office of Legacy Management (LM)

    Final Rulison Path Forward June 2010 Approved for public release; further dissemination unlimited LMS/RUL/S04617 Available for sale to the public from: U.S. Department of Commerce National Technical Information Service 5301 Shawnee Road Alexandria, VA 22312 Telephone: 800.553.6847 Fax: 703.605.6900 E-mail: orders@ntis.gov Online Ordering: http://www.ntis.gov/help/ordermethods.aspx Available electronically at http://www.osti.gov/bridge Available for a processing fee to U.S. Department of Energy

  5. Pageflex Server [document: PF4577458_00001

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

    You'll enjoy more value and the lowest out-of-pocket costs. * High Quality Vision Care. You'll get the best care from a VSP provider, including a WellVision Exam -the most...

  6. Microsoft Word - PF Training Final 0624051.doc

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

    8 MANAGEMENT COMMENTS 9 INSPECTOR COMMENTS 10 APPENDICES A. Scope and Methodology 12 B. Prior OIG Reports 13 C. Management Comments 14 Overview Page 1 Protective...

  7. Pageflex Server [document: PF1888317_00001

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

    when you see a VSP provider. Diabetic EyeCare Annual eye exams can help prevent diabetes related blindness. If you have type 1 or type 2 diabetes, you can get both your...

  8. High Field Magnetization measurements of uranium dioxide single crystals (P08358- E003-PF)

    SciTech Connect (OSTI)

    Gofryk, K.; Harrison, N.; Jaime, M.

    2014-12-01

    Our preliminary high field magnetic measurements of UO2 are consistent with a complex nature of the magnetic ordering in this material, compatible with the previously proposed non-collinear 3-k magnetic structure. Further extensive magnetic studies on well-oriented (<100 > and <111>) UO2 crystals are planned to address the puzzling behavior of UO2 in both antiferromagnetic and paramagnetic states at high fields.

  9. Magnetization measurements of uranium dioxide single crystals (P08358-E002-PF)

    SciTech Connect (OSTI)

    Gofryk, K.; Zapf, V.; Jaime, M.

    2014-12-01

    Our preliminary magnetic susceptibility measurements of UO2 point to complex nature of the magnetic ordering in this material, consistent with the proposed non-collinear 3-k magnetic structure. Further extensive magnetic studies are planned to address the puzzling behavior of UO2 in both antiferromagnetic and paramagnetic states.

  10. PF coil voltage optimization for start-up scenarios in air core tokamaks

    SciTech Connect (OSTI)

    Albanese, R.; Martone, R.; Ambrosino, G.; Pironti, A.

    1994-09-01

    The basic features of a procedure for the optimization of the plasma scenario in an air core tokamak are presented. The method takes into account the eddy currents in the passive conducting structures. The problem is reduced to the synthesis of time-varying magnetic field. The solution of this inverse electromagnetic problem is carried out by means of an optimization procedure based on the receding horizon approach. The paper includes an example of application to the ITER tokamak.

  11. High-Volume Manufacturing of LiPF6, A Critical Lithium-ion Battery...

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

    1 DOE Hydrogen and Fuel Cells Program, and Vehicle Technologies Program Annual Merit Review and Peer Evaluation PDF icon arravt014esoleary2011...

  12. High-Volume Manufacturing of LiPF6, A Critical Lithium-ion Battery...

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

    2 DOE Hydrogen and Fuel Cells Program and Vehicle Technologies Program Annual Merit Review and Peer Evaluation Meeting PDF icon arravt014esoleary2012...

  13. Materials Data on AgPF6 (SG:225) 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

  14. Materials Data on NaPF3 (SG:1) 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

  15. High-Volume Manufacturing of LiPF6, A Critical Lithium-ion Battery Material

    Broader source: Energy.gov [DOE]

    2011 DOE Hydrogen and Fuel Cells Program, and Vehicle Technologies Program Annual Merit Review and Peer Evaluation

  16. High-Volume Manufacturing of LiPF6, A Critical Lithium-ion Battery Material

    Broader source: Energy.gov [DOE]

    2012 DOE Hydrogen and Fuel Cells Program and Vehicle Technologies Program Annual Merit Review and Peer Evaluation Meeting

  17. Microsoft Word - S09IS004 _LLNL_PF_Authority_08262009a FINAL.doc

    Office of Environmental Management (EM)

    AAAAAAAAAAAAAAA U.S. Department of Energy Office of Inspector General Office of Inspections Inspection Report Lawrence Livermore National Laboratory Protective Force Authority DOE/IG-0820 September 2009 Department of Energy Washington, DC 20585 September 4, 2009 MEMORANDUM FOR THE SECRETARY FROM: Gregory H. Friedman Inspector General SUBJECT: INFORMATION: Inspection Report on "Lawrence Livermore National Laboratory Protective Force Authority" BACKGROUND The Department of Energy's

  18. Microsoft PowerPoint - 10_ROSE_MARTYN_UPDATED_NMMSS_2014_Foreign...

    National Nuclear Security Administration (NNSA)

    ... Cyprus, Czech Republic, Denmark, Estonia, Finland, France, Germany, Greece, Ireland, Italy, Hungary, Latvia, Lithuania, Luxembourg, Malta, The Netherlands, Poland, Portugal, ...

  19. Microsoft Word - Foreign Obligation Codes.docx

    National Nuclear Security Administration (NNSA)

    Czech Republic, Denmark, Estonia, Finland, France, Germany, Greece, Hungary, Ireland, Italy, Latvia, Lithuania, Luxembourg, Malta, the Netherlands, Poland, Portugal, Romania, ...

  20. 123 Agreements for Peaceful Cooperation | National Nuclear Security...

    National Nuclear Security Administration (NNSA)

    Czech Republic, Denmark, Estonia, Finland, France, Germany, Greece, Hungary, Ireland, Italy, Latvia, Lithuania, Luxembourg, Malta, the Netherlands, Poland, Portugal, Romania, ...

  1. DeKalb County, Illinois: Energy Resources | Open Energy Information

    Open Energy Info (EERE)

    Illinois Genoa, Illinois Hinckley, Illinois Kingston, Illinois Kirkland, Illinois Lee, Illinois Malta, Illinois Maple Park, Illinois Sandwich, Illinois Shabbona, Illinois...

  2. Saline County, Missouri: Energy Resources | Open Energy Information

    Open Energy Info (EERE)

    Malta Bend, Missouri Marshall, Missouri Miami, Missouri Mount Leonard, Missouri Nelson, Missouri Slater, Missouri Sweet Springs, Missouri Retrieved from "http:...

  3. Spin-lattice coupling in uranium dioxide probed by magnetostriction measurements at high magnetic fields (P08358-E001-PF)

    SciTech Connect (OSTI)

    Gofryk, K.; Jaime, M.

    2014-12-01

    Our preliminary magnetostriction measurements have already shown a strong interplay of lattice dynamic and magnetism in both antiferromagnetic and paramagnetic states, and give unambiguous evidence of strong spin- phonon coupling in uranium dioxide. Further studies are planned to address the puzzling behavior of UO2 in magnetic and paramagnetic states and details of the spin-phonon coupling.

  4. Post-test analysis of semiscale tests S-UT-6 and S-UT-7 using TRAC PF1

    SciTech Connect (OSTI)

    Boyack, B.E.

    1983-01-01

    A posttest study of Semiscale Tests S-UT-6 and S-UT-7 has been completed to assess TRAC-PFl predictions of pressurized water-reactor (PWR) small-break transients. The comparisons of the TRAC calculations and experimental results show that the correct qualitative influence of upper-head injection (UHI) was predicted. The major phenomenological difference predicted was the mode of core voiding. The data show a slow boiloff from the top of the core resulting in a dryout near the top of the core only. TRAC predicted a more extensive voiding with fluid forced from the bottom of the core by a pressure increase in the upper vessel plenum. The pressure increase was the primary consequence of a failure to predict a complete clearance of the seal in the intact-loop pump-suction upflow leg. Further review of the interphasic drag correlations, entrainment correlations, and critical-flow model is recommended. 20 figures.

  5. Microsoft Word - Final Nuclear Materials Management and Safeguards...

    National Nuclear Security Administration (NNSA)

    ... Greece, Hungary, Ireland, Italy, Latvia, Lithuania, Luxembourg, Malta, the Netherlands, Poland, Portugal, Romania, Slovakia, Slovenia, Spain, Sweden, and the United Kingdom. ...

  6. Saratoga Technology Energy Park STEP | Open Energy Information

    Open Energy Info (EERE)

    Technology Energy Park STEP Jump to: navigation, search Name: Saratoga Technology + Energy Park (STEP) Place: Malta, New York Product: An economic development project of the New...

  7. Saratoga County, New York: Energy Resources | Open Energy Information

    Open Energy Info (EERE)

    New York Lake Luzerne-Hadley, New York Malta, New York Mechanicville, New York Milton, New York Moreau, New York North Ballston Spa, New York Northumberland, New York...

  8. Commissioning of a Soft X-ray Beamline PF-BL-16A with a Variable-Included-Angle Varied-Line-Spacing Grating Monochromator

    SciTech Connect (OSTI)

    Amemiya, Kenta; Toyoshima, Akio; Kikuchi, Takashi; Kosuge, Takashi; Nigorikawa, Kazuyuki; Sumii, Ryohei; Ito, Kenji

    2010-06-23

    The design and commissioning of a new soft X-ray beamline, BL-16A, at the Photon Factory is presented. The beamline consists of a pre-focusing mirror, an entrance slit, a variable-included-angle varied-line-spacing plane grating monochromator, and a post-focusing system as usual, and provides circularly and linearly polarized soft X rays in the energy range 200-1500 eV with an APPLE-II type undulator. The commissioning procedure for the beamline optics is described in detail, especially the check of the focal position for the zero-th order and diffracted X rays.

  9. Inventors Behind General Electric | GE Global Research

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

    Lucas Malta Lucas Malta Program Manager Smart Systems CoE Click to email this to a friend (Opens in new window) Share on Facebook (Opens in new window) Click to share (Opens in new window) Click to share on LinkedIn (Opens in new window) Click to share on Tumblr (Opens in new window) "My role gives me the opportunity to create something from scratch every day. " -Lucas Malta Before Lucas was leading a program in the Smart Systems CoE, he was paving the way in data analytics for the

  10. MidMissouri Energy LLC | Open Energy Information

    Open Energy Info (EERE)

    search Name: MidMissouri Energy LLC Place: Malta Bend, Missouri Zip: 65339 Product: Bioethanol producer using corn as feedstock. References: MidMissouri Energy LLC1 This article...

  11. CX-011208: Categorical Exclusion Determination

    Broader source: Energy.gov [DOE]

    Danger Tree Management on Malta-Mount Elbert 230-Kilovolt Transmission Line CX(s) Applied: B1.3 Date: 09/09/2013 Location(s): Colorado Offices(s): Western Area Power Administration-Rocky Mountain Region

  12. INL Researchers Advance Detection of Brucellosis

    ScienceCinema (OSTI)

    Roberto, Frank; Newby, Deborah

    2010-01-08

    What do cattle ranchers in the greater Yellowstone region have in common with British soldiers garrisoned on the island of Malta in the late 1800s? Hint: it's a pathogen that starts with the letter B. It's Brucella Abortus.

  13. Workbook Contents

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

    to Maldives of Crude Oil and Petroleum Products (Thousand Barrels)","U.S. Exports to Mali of Crude Oil and Petroleum Products (Thousand Barrels)","U.S. Exports to Malta of Crude...

  14. Residential Exchange Program Settlement

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

    B - PF-02 Customer Percentages and Customer-Specific PF-02 Refunds Exhibit C - Renewable Energy Certificates and Carbon Attributes to IOUs Exhibit D - Illustrative Table for...

  15. 2012 Wholesale Power and Transmission Rate

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

    B - PF-02 Customer Percentages and Customer-Specific PF-02 Refunds Exhibit C - Renewable Energy Certificates and Carbon Attributes to IOUs Exhibit D - Illustrative Table for...

  16. Assignment of the luminescing states of [Au{sup 1}Rh{sup 1}({sup t}BuNC){sub 2}({mu}-dppm){sub 2}][PF{sub 6}]{sub 2}

    SciTech Connect (OSTI)

    Striplin, D.R.; Crosby, G.A.

    1995-07-13

    Fluorescence, phosphorescence, and excitation spectra were measured on the title compound. These results were augmented with polarization ratios obtained at 77 K and detailed studies of the temperature dependence of the phosphorescence in the 77-4 K range. The phosphorescence decay rate at K was also recorded as a function of an applied magnetic field. All the results are consistent with a 4d{sub z}Rh{sup 1} {yields} 6p{sub 2}Au{sup 1} orbital promotion leading to emitting {sup 1}A, {sup 3}A{sub 1} terms in pseudo-C{sub 2v} symmetry. The {sup 3}A{sub 1} term is split by spin-orbit coupling into a forbidden A{sub 2} state lying lowest followed by a quasi-degenerate pair, [B{sub 1}(x), B{sub 2}(y)] lying approximately 16 cm{sup -1} higher that decays >500 times faster than the lowest one. 28 refs., 6 figs.

  17. DPF heater attachment mechanisms

    DOE Patents [OSTI]

    Gonze, Eugene V [Pinckney, MI; Ament, Frank [Troy, MI

    2011-04-26

    An exhaust filter system includes a particulate filter (PF) that is disposed downstream from an engine. The PF filters particulates within an exhaust from the engine. A heating element heats particulate matter in the PF. A fastener limits expansion movement of the heating element relative to the PF.

  18. Estimation of the Dynamic States of Synchronous Machines Using an Extended Particle Filter

    SciTech Connect (OSTI)

    Zhou, Ning; Meng, Da; Lu, Shuai

    2013-11-11

    In this paper, an extended particle filter (PF) is proposed to estimate the dynamic states of a synchronous machine using phasor measurement unit (PMU) data. A PF propagates the mean and covariance of states via Monte Carlo simulation, is easy to implement, and can be directly applied to a non-linear system with non-Gaussian noise. The extended PF modifies a basic PF to improve robustness. Using Monte Carlo simulations with practical noise and model uncertainty considerations, the extended PFs performance is evaluated and compared with the basic PF and an extended Kalman filter (EKF). The extended PF results showed high accuracy and robustness against measurement and model noise.

  19. The Role of Platelet Factor 4 in Radiation-Induced Thrombocytopenia

    SciTech Connect (OSTI)

    Lambert, Michele P.; Xiao Liqing; Nguyen, Yvonne; Kowalska, M. Anna; Poncz, Mortimer

    2011-08-01

    Purpose: Factors affecting the severity of radiation-induced thrombocytopenia (RIT) are not well described. We address whether platelet factor 4 (PF4; a negative paracrine for megakaryopoiesis) affects platelet recovery postradiation. Methods and Materials: Using conditioned media from irradiated bone marrow (BM) cells from transgenic mice overexpressing human (h) PF4 (hPF4+), megakaryocyte colony formation was assessed in the presence of this conditioned media and PF4 blocking agents. In a model of radiation-induced thrombocytopenia, irradiated mice with varying PF4 expression levels were treated with anti-hPF4 and/or thrombopoietin (TPO), and platelet count recovery and survival were examined. Results: Conditioned media from irradiated BM from hPF4+ mice inhibited megakaryocyte colony formation, suggesting that PF4 is a negative paracrine released in RIT. Blocking with an anti-hPF4 antibody restored colony formation of BM grown in the presence of hPF4+ irradiated media, as did antibodies that block the megakaryocyte receptor for PF4, low-density lipoprotein receptor-related protein 1 (LRP1). Irradiated PF4 knockout mice had higher nadir platelet counts than irradiated hPF4+/knockout litter mates (651 vs. 328 x 106/mcL, p = 0.02) and recovered earlier (15 days vs. 22 days, respectively, p <0.02). When irradiated hPF4+ mice were treated with anti-hPF4 antibody and/or TPO, they showed less severe thrombocytopenia than untreated mice, with improved survival and time to platelet recovery, but no additive effect was seen. Conclusions: Our studies show that in RIT, damaged megakaryocytes release PF4 locally, inhibiting platelet recovery. Blocking PF4 enhances recovery while released PF4 from megakaryocytes limits TPO efficacy, potentially because of increased release of PF4 stimulated by TPO. The clinical value of blocking this negative paracrine pathway post-RIT remains to be determined.

  20. Electrically heated particulate filter using catalyst striping

    DOE Patents [OSTI]

    Gonze, Eugene V; Paratore, Jr., Michael J; Ament, Frank

    2013-07-16

    An exhaust system that processes exhaust generated by an engine is provided. The system generally includes a particulate filter (PF) that filters particulates from the exhaust wherein an upstream end of the PF receives exhaust from the engine. A grid of electrically resistive material is applied to an exterior upstream surface of the PF and selectively heats exhaust passing through the grid to initiate combustion of particulates within the PF. A catalyst coating is applied to the PF that increases a temperature of the combustion of the particulates within the PF.

  1. Zone heated diesel particulate filter electrical connection

    DOE Patents [OSTI]

    Gonze, Eugene V. (Pinckney, MI); Paratore, Jr., Michael J. (Howell, MI)

    2010-03-30

    An electrical connection system for a particulate filter is provided. The system includes: a particulate filter (PF) disposed within an outer shell wherein the PF is segmented into a plurality of heating zones; an outer mat disposed between the particulate filter and the outer shell; an electrical connector coupled to the outer shell of the PF; and a plurality of printed circuit connections that extend along the outer surface of the PF from the electrical connector to the plurality of heating zones.

  2. Diesel particulate filter regeneration via resistive surface heating

    DOE Patents [OSTI]

    Gonze, Eugene V; Ament, Frank

    2013-10-08

    An exhaust system that processes exhaust generated by an engine is provided. The system includes: a particulate filter (PF) that filters particulates from the exhaust wherein an upstream end of the PF receives exhaust from the engine; and a grid of electrically resistive material that is applied to an exterior upstream surface of the PF and that selectively heats exhaust passing through the grid to initiate combustion of particulates within the PF.

  3. July 2012, Work Force Retention Work Group Status Overview

    Office of Environmental Management (EM)

    Work Force Retention Work Group Status Overview Accomplishments: 1. Progress on the completion of the 10 CFR 1046 modifications to address barriers to workforce retention. Written response to public comment is being drafted by HS-51. 2. Pro-Force (PF) union representative, Randy Lawson, identified this accomplishment as the single most significant step toward PF workforce retention in over 20 years. 3. Draft re-charter of PF Career Options Committee (PFCOC) to establish a PF Working Group

  4. TPX: Contractor preliminary design review. Volume 1, Presentation and design description. Final report

    SciTech Connect (OSTI)

    Hartman, D.; Naumovich,; Walstrom, P.; Clarkson, I.; Schultheiss, J.; Burger, A.

    1995-09-22

    This first volume of the five volume set begins with a CPDR overview and then details the PF magnet system, manufacturing R&D, Westinghouse R&D, the central solenoid, the PF 5 ring coil, the PF 6/7 ring coil, quality assurance, and the system design description.

  5. Electrically heated particulate filter regeneration using hydrocarbon adsorbents

    DOE Patents [OSTI]

    Gonze, Eugene V [Pinckney, MI

    2011-02-01

    An exhaust system that processes exhaust generated by an engine is provided. The system generally includes a particulate filter (PF) that filters particulates from the exhaust wherein an upstream end of the PF receives exhaust from the engine. A grid of electrically resistive material selectively heats exhaust passing through the upstream end to initiate combustion of particulates within the PF. A hydrocarbon adsorbent coating applied to the PF releases hydrocarbons into the exhaust to increase a temperature of the combustion of the particulates within the PF.

  6. Electrically heated particulate filter enhanced ignition strategy

    DOE Patents [OSTI]

    Gonze, Eugene V; Paratore, Jr., Michael J

    2012-10-23

    An exhaust system that processes exhaust generated by an engine is provided. The system generally includes a particulate filter (PF) that filters particulates from the exhaust wherein an upstream end of the PF receives exhaust from the engine. A grid of electrically resistive material is applied to an exterior upstream surface of the PF and selectively heats exhaust passing through the grid to initiate combustion of particulates within the PF. A catalyst coating applied to at least one of the PF and the grid. A control module estimates a temperature of the grid and controls the engine to produce a desired exhaust product to increase the temperature of the grid.

  7. Browse by Discipline -- E-print Network Subject Pathways: Materials Science

    Office of Scientific and Technical Information (OSTI)

    -- Energy, science, and technology for the research community -- hosted by the Office of Scientific and Technical Information, U.S. Department of Energy Q R S T U V W X Y Z Pace, Gordon J. (Gordon J. Pace) - Department of Computer Science, University of Malta Pach, János (János Pach) - Department of Mathematics, Courant Institute of Mathematical Sciences, New York University Padawitz, Peter (Peter Padawitz) - Fachbereich Informatik, Universität Dortmund Padgham, Lin (Lin Padgham) - School

  8. Shielded regeneration heating element for a particulate filter

    DOE Patents [OSTI]

    Gonze, Eugene V [Pinckney, MI; Ament, Frank [Troy, MI

    2011-01-04

    An exhaust system includes a particulate filter (PF) that is disposed downstream from an engine. The PF filters particulates within an exhaust from the engine. A heating element heats particulate matter in the PF. A catalyst substrate or a flow converter is disposed upstream from said heating element. The catalyst substrate oxidizes the exhaust prior to reception by the heating element. The flow converter converts turbulent exhaust flow to laminar exhaust flow prior to reception by the heating element.

  9. Solvate Structures and Computational/Spectroscopic Characterization of

    Office of Scientific and Technical Information (OSTI)

    LiPF6 Electrolytes (Journal Article) | SciTech Connect Solvate Structures and Computational/Spectroscopic Characterization of LiPF6 Electrolytes Citation Details In-Document Search Title: Solvate Structures and Computational/Spectroscopic Characterization of LiPF6 Electrolytes Raman spectroscopy is a powerful method for identifying ion-ion interactions, but only if the vibrational band signature for the anion coordination modes can be accurately deciphered. The present study characterizes

  10. Electrically heated particulate filter embedded heater design

    DOE Patents [OSTI]

    Gonze, Eugene V.; Chapman, Mark R.

    2014-07-01

    An exhaust system that processes exhaust generated by an engine is provided. The system generally includes a particulate filter (PF) that filters particulates from the exhaust wherein an upstream end of the PF receives exhaust from the engine and wherein an upstream surface of the particulate filter includes machined grooves. A grid of electrically resistive material is inserted into the machined grooves of the exterior upstream surface of the PF and selectively heats exhaust passing through the grid to initiate combustion of particulates within the PF.

  11. Permafrost and organic layer interactions over a climate gradient...

    Office of Scientific and Technical Information (OSTI)

    in permafrost occurrence (PF) and organic layer thickness (OLT) in more than 3000 soil pedons across a mean annual temperature (MAT) gradient. Cause and effect relationships...

  12. PJM Presentation- The Silver Bullet: Storage! (July 12, 2011)

    Broader source: Energy.gov [DOE]

    Presentation by Terry Boston, President and CEO pf PJM Interconnection before the Electricity Advisorty Committee, July 12, 2011, on storage for the smart grid.

  13. Solvate Structures and Computational/Spectroscopic Characterization...

    Office of Scientific and Technical Information (OSTI)

    Solvate Structures and ComputationalSpectroscopic Characterization of LiPF6 Electrolytes Citation Details In-Document Search Title: Solvate Structures and Computational...

  14. Submission Format for IMS2004 (Title in 18-point Times font)

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

    PCC or the DER electrical connection point. Fig. 7. PF evaluation with varying dcac power. C. Frequency-Watt Evaluation Results Grid frequency deviations can be mitigated by...

  15. Keystone Clean Air | Open Energy Information

    Open Energy Info (EERE)

    with PF meters and our optimizing equipment (patent 5440442 - an apparatus and methodology patent)on "live" loads. A reduction is thereby shown at the utility company's meter...

  16. High-Penetration PV Integration Handbook for Distribution Engineers

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

    ... of Electrical and Electronics Engineers ITIC Information Technology Industry Council LTC load tap changer PF power ... The resulting outages ultimately reduce system reliability. ...

  17. Green Skies of Brazil |GE Global Research

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

    Green Skies of Brazil Click to email this to a friend (Opens in new window) Share on Facebook (Opens in new window) Click to share (Opens in new window) Click to share on LinkedIn (Opens in new window) Click to share on Tumblr (Opens in new window) Green Skies of Brazil Lucas Malta 2014.08.28 Not every professional gets to see on a daily basis the impact of her/his work on other people's lives. If you happen to be a physician you might; however, if like me you decided to become an engineer, it

  18. World frontiers beckon oil finders

    SciTech Connect (OSTI)

    Not Available

    1991-09-01

    This paper discusses the international aspects of the petroleum industry. Most who work in the industry agree that the possibilities for huge are found largely in international regions. Something that is helping fuel that possibility is the way countries are increasingly opening their doors to US oil industry involvement. Listed in this paper is a partial list of the reported projects now underway around the world involving US companies. It is not intended to be comprehensive, but rather an indication of how work continues despite a general lull atmosphere for the oil industry. These include Albania, Bulgaria, Congo, Czechoslovakia, Dominican Republic, Ethiopia, Ireland, Malta, Madagascar, Mongolia, Mozambique, Nigeria, Panama, Paraquay, and Senegal.

  19. How Does Gravity Work to Hold a Human Down? | GE Global Research

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

    Does Gravity Work to Hold a Human Down? Click to email this to a friend (Opens in new window) Share on Facebook (Opens in new window) Click to share (Opens in new window) Click to share on LinkedIn (Opens in new window) Click to share on Tumblr (Opens in new window) How Does Gravity Work to Hold a Human Down? 2012.04.13 Chief Scientist Jim Bray discusses how velocity and gravity affect space travel. 0 Comments Comment Name Email Submit Comment You Might Also Like Lucas_Malta_airplane_V Green

  20. Failure modes and effects analysis of fusion magnet systems

    SciTech Connect (OSTI)

    Zimmermann, M; Kazimi, M S; Siu, N O; Thome, R J

    1988-12-01

    A failure modes and consequence analysis of fusion magnet system is an important contributor towards enhancing the design by improving the reliability and reducing the risk associated with the operation of magnet systems. In the first part of this study, a failure mode analysis of a superconducting magnet system is performed. Building on the functional breakdown and the fault tree analysis of the Toroidal Field (TF) coils of the Next European Torus (NET), several subsystem levels are added and an overview of potential sources of failures in a magnet system is provided. The failure analysis is extended to the Poloidal Field (PF) magnet system. Furthermore, an extensive analysis of interactions within the fusion device caused by the operation of the PF magnets is presented in the form of an Interaction Matrix. A number of these interactions may have significant consequences for the TF magnet system particularly interactions triggered by electrical failures in the PF magnet system. In the second part of this study, two basic categories of electrical failures in the PF magnet system are examined: short circuits between the terminals of external PF coils, and faults with a constant voltage applied at external PF coil terminals. An electromagnetic model of the Compact Ignition Tokamak (CIT) is used to examine the mechanical load conditions for the PF and the TF coils resulting from these fault scenarios. It is found that shorts do not pose large threats to the PF coils. Also, the type of plasma disruption has little impact on the net forces on the PF and the TF coils. 39 refs., 30 figs., 12 tabs.

  1. Enterprise Assessments Targeted Review of the Targeted Review...

    Office of Environmental Management (EM)

    ... in the TA-55 DSA. The intent of the ISIs is to periodically ensure that the design ... ISIs for the PF-4 SC confinement system include a visual inspection of visible portions of ...

  2. Microsoft Word - NOI to prepare EA - Elba GA _04-22-2013_

    Energy Savers [EERE]

    L.L.C. Docket No. PF13-3-000 Southern LNG Company, L.L.C. Elba Express Company, ... Liquefaction Company, LLC (ELC); Southern LNG Company, LLC (SLNG); and Elba Express ...

  3. October 2005 - March 2006 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 30.56% non-Slice LB + FB + SN CRAC adjustment for each month of the six-month rate period. The table below...

  4. April - September 2002 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 40.77% non-Slice LB CRAC adjustment for each month of the six-month rate period. The table below is simply a...

  5. October 2004 - March 2005 Power Rates (rates/previous)

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

    The PDF documents above provide tables of monthly Slice, PF, RL, and IP rates with the LB + FB + SN CRAC adjustments for each month of the rate period. The table below is simply...

  6. April - September 2005 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 36.93% non-Slice LB + FB + SN CRAC adjustment for each month of the six-month rate period. The table below...

  7. October 2003 - March 2004 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 43.66% non-Slice LB + FB + SN CRAC adjustment for each month of the rate period. The table below is simply a...

  8. October 2002 - March 2003 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 43.91% non-Slice LB + FB CRAC adjustment for each month of the six-month rate period. The table below is...

  9. October 2001 - March 2002 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 46% non-Slice LB CRAC adjustment for each month of the six-month rate period. The table below is simply a...

  10. April - September 2003 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 49.50% non-Slice LB + FB CRAC adjustment for each month of the six-month rate period. The table below is...

  11. April - September 2004 Power Rates (rates/previous)

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

    above provides a table of monthly Slice, PF, RL, and IP rates with a 47.00% non-Slice LB + FB + SN CRAC adjustment for each month of the six-month rate period. The table below...

  12. "Title","Creator/Author","Publication Date","OSTI Identifier...

    Office of Scientific and Technical Information (OSTI)

    Fermi Gamma-Ray Space Telescope: High-Energy Results From the First Year","Michelson, P.F.; KIPAC, Menlo Park; Atwood, W.B.; Ritz, S.; UC, Santa Cruz UC, Santa Cruz, Phys....

  13. Fermi Gamma-Ray Space Telescope: High-Energy Results From the...

    Office of Scientific and Technical Information (OSTI)

    Gamma-Ray Space Telescope: High-Energy Results From the First Year Michelson, P.F.; KIPAC, Menlo Park; Atwood, W.B.; Ritz, S.; UC, Santa Cruz UC, Santa Cruz, Phys. Dept....

  14. Effect of molecular electrical doping on polyfuran based photovoltaic cells

    SciTech Connect (OSTI)

    Yu, Shuwen; Opitz, Andreas; Salzmann, Ingo; Frisch, Johannes; Cohen, Erez; Bendikov, Michael; Koch, Norbert

    2015-05-18

    The electronic, optical, and morphological properties of molecularly p-doped polyfuran (PF) films were investigated over a wide range of doping ratio in order to explore the impact of doping in photovoltaic applications. We find evidence for integer-charge transfer between PF and the prototypical molecular p-dopant tetrafluoro-tetracyanoquinodimethane (F4TCNQ) and employed the doped polymer in bilayer organic solar cells using fullerene as acceptor. The conductivity increase in the PF films at dopant loadings ?2% significantly enhances the short-circuit current of photovoltaic devices. For higher doping ratios, however, F4TCNQ is found to precipitate at the heterojunction between the doped donor polymer and the fullerene acceptor. Ultraviolet photoelectron spectroscopy reveals that its presence acts beneficial to the energy-level alignment by doubling the open-circuit voltage of solar cells from 0.2?V to ca. 0.4?V, as compared to pristine PF.

  15. Sandia National Laboratories: News: Publications: Lab News

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

    played a key role in the early years of the affirmative action and equal employment movements as one of the first organizations to sign on to the Plans for Progress (PfP), a...

  16. Plasma focus ion beam fluence and fluxFor various gases

    SciTech Connect (OSTI)

    Lee, S. [Centre for Plasma Research, INTI International University, 71800 Nilai (Malaysia) [Centre for Plasma Research, INTI International University, 71800 Nilai (Malaysia); Institute for Plasma Focus Studies, 32 Oakpark Drive, Chadstone 3148 (Australia); Physics Department, University of Malaya (Malaysia); Saw, S. H. [Centre for Plasma Research, INTI International University, 71800 Nilai (Malaysia) [Centre for Plasma Research, INTI International University, 71800 Nilai (Malaysia); Institute for Plasma Focus Studies, 32 Oakpark Drive, Chadstone 3148 (Australia)

    2013-06-15

    A recent paper derived benchmarks for deuteron beam fluence and flux in a plasma focus (PF) [S. Lee and S. H. Saw, Phys. Plasmas 19, 112703 (2012)]. In the present work we start from first principles, derive the flux equation of the ion beam of any gas; link to the Lee Model code and hence compute the ion beam properties of the PF. The results show that, for a given PF, the fluence, flux, ion number and ion current decrease from the lightest to the heaviest gas except for trend-breaking higher values for Ar fluence and flux. The energy fluence, energy flux, power flow, and damage factors are relatively constant from H{sub 2} to N{sub 2} but increase for Ne, Ar, Kr and Xe due to radiative cooling and collapse effects. This paper provides much needed benchmark reference values and scaling trends for ion beams of a PF operated in any gas.

  17. Practical method using superposition of individual magnetic fields...

    Office of Scientific and Technical Information (OSTI)

    this method to two elliptically polarizing undulators (EPUs), called U16-2 and U02-2, at the Photon Factory storage ring (PF ring) in the High Energy Accelerator Research...

  18. Administrator's Record of Decision (ROD) on New Large Single...

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

    continued PF firm power service from a new serving utility upon the following set of conditions: First, the transfer is to a public utility. Second, the load does not change...

  19. Microsoft Word - DRAFT_NDA_VR1-2016_10212011_CLEAN.doc

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

    to certain pricing information for potential use in assisting Customer Name to make elections regarding the purchase of power from BPA at the PF Tier 2 Vintage Market Sourced...

  20. Authors: Carol Burns, Mark Chadwick, John Erickson, David Funk...

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

    Nuclear and Particle Futures (N&PF) Pillar Authors: Carol Burns, Mark Chadwick, John ... as composed of four focus areas: Applied Nuclear Science and Engineering (ANS&E), Nuclear, ...

  1. Protective Force Program Manual

    Broader source: Directives, Delegations, and Requirements [Office of Management (MA)]

    2000-06-30

    Provides detailed requirements to supplement DOE O 473.2, Protective Force Program, which establishes the requirements and responsibilities for management and operation of the Department of Energy (DOE) Protective Force (PF) Program. Does not cancel other directives.

  2. Protective Force

    Broader source: Directives, Delegations, and Requirements [Office of Management (MA)]

    2005-08-26

    Establishes requirements for management and operation of the DOE Protective Force (PF), establishes requirements for firearms operations and defines the firearms courses of fire. Cancels: DOE M 473.2-1A DOE M 473.2-2

  3. Also In This Issue

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

    PF-4. "The lack of space drives what we can do in that facility," said Mah. "We require guns, gates, guards, and other special capabilities to work with actinide materials; at a...

  4. Laboratory Equipment Donation Program - Administrative Login

    Office of Scientific and Technical Information (OSTI)

    Password: Logon Reset Forgot your username or password or need to change your e-mail address? Send e-mail to pf-lepd@osti.gov. Need to change OPMO contact (i.e., e-mail, name, ...

  5. Fermi Gamma-Ray Space Telescope: High-Energy Results From the...

    Office of Scientific and Technical Information (OSTI)

    Year Authors: Michelson, P.F. ; KIPAC, Menlo Park ; Atwood, W.B. ; Ritz, S. ; UC, Santa Cruz UC, Santa Cruz, Phys. Dept. Publication Date: 2013-06-20 OSTI Identifier:...

  6. TRAC Code Modifications Made for APT Blanket Safety Analyses

    SciTech Connect (OSTI)

    Hamm, L.L.

    1998-10-07

    This report provides documentation of the necessary source code modifications made to the TRAC-PF1/MOD2 code version 5.4.28a developed at Los Alamos National Laboratory.

  7. Sandvik sharpens in-pit crushing focus

    SciTech Connect (OSTI)

    Casteel, K.

    2009-04-15

    Major mining equipment supplier Sandvik Mining and Construction has announced a full-fledged fully mobile crushing plant, the PF300. This is shaping up to be the decade's major addition to the large scale open-cut mining toolkit. The PF300 can be connected to a face conveyor by a loading bridge as well as by belt wagon or transfer conveyor. The article describes design features. 2 figs.

  8. Zone heated inlet ignited diesel particulate filter regeneration

    DOE Patents [OSTI]

    Gonze, Eugene V [Pinckney, MI; Ament, Frank [Troy, MI

    2012-06-26

    An exhaust system that processes exhaust generated by an engine is provided. The system includes: a particulate filter (PF) that is disposed downstream of the engine and that filters particulates from the exhaust; and a grid that includes electrically resistive material that is segmented by non-conductive material into a plurality of zones and wherein the grid is applied to an exterior upstream surface of the PF.

  9. TO: Procurement Directors Heads of Contracting Activities

    Energy Savers [EERE]

    3 DATE: February 04, 2016 TO: Procurement Directors Heads of Contracting Activities FROM: Acting Chief Contract and Financial Assistance Policy Division Office of Policy Office of Acquisition Management SUBJECT: New Policy Flash Distribution Process SUMMARY: This office is automating the policy flash (PF) distribution process by using a listserv. As of February 18, 2016, the listserv will send PF notifications without attachments. PFs will no longer be sent via the email distribution list. PFs

  10. SASSI Subtraction Method Effects at Various DOE projects

    Office of Environmental Management (EM)

    Subtraction Method Effects at Various DOE projects U.S. Department of Energy Natural Phenomena Hazards Workshop October 25-26, 2011 Greg E. Mertz, Michael C. Costantino, Thomas W. Houston, Andrew S. Maham CJCAssociates 2 Outline  PF-4  CMRR  UPF  Generic Study  Lessons Learned Note: Project results represent work-in-progress and do imply regulatory acceptance CJCAssociates 3 SASSI Solution Methods for Embedded Structures CJCAssociates 4 PF-4 Two story Box-type RC Structure

  11. UNITED STATES OF AMERICA FEDERAL ENERGY REGULATORY COMMISSION

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

    Port Arthur LNG, LLC and Docket Nos. PF15-18-000 and Port Arthur Pipeline, LLC PF15-19-000 NOTICE OF INTENT TO PREPARE AN ENVIRONMENTAL IMPACT STATEMENT FOR THE PLANNED PORT ARTHUR LIQUEFACTION PROJECT AND PORT ARTHUR PIPELINE PROJECT, REQUEST FOR COMMENTS ON ENVIRONMENTAL ISSUES, AND NOTICE OF PUBLIC SCOPING MEETINGS (June 24, 2015) The staff of the Federal Energy Regulatory Commission (FERC or Commission) will prepare an environmental impact statement (EIS) that will discuss the environmental

  12. September 2012, Work Force Retention Work Group Status Overview

    Energy Savers [EERE]

    Work Force Retention Work Group Status Overview 2 Subgroups: Pro-Force and Non-Pro-Force Pro-Force Subgroup: Accomplishments: 1. Completion of 10 CFR 1046 [Protective Force Personnel Medical, Physical Readiness, Training, and Access Authorization Standards] as a final rule that includes modification efforts to address barriers to workforce retention. 2. Pro-Force (PF) union representative, Randy Lawson, identified this accomplishment as the single most significant step toward PF workforce

  13. Notice

    Energy Savers [EERE]

    FEDERAL ENERGY REGULATORY COMMISSION Louisiana LNG Energy, LLC Docket No. PF14-17-000 SUPPLEMENTAL NOTICE OF INTENT TO PREPARE AN ENVIRONMENTAL IMPACT STATEMENT FOR THE PLANNED MISSISSIPPI RIVER LNG PROJECT, AND REQUEST FOR COMMENTS ON ENVIRONMENTAL ISSUES RELATED TO PROJECT CHANGES (September 30, 2015) On October 3, 2014, the Federal Energy Regulatory Commission (FERC or Commission) issued in Docket No. PF14-17-000 a Notice of Intent to Prepare an Environmental Impact Statement for the Planned

  14. Policy Flash 2016-13 | Department of Energy

    Energy Savers [EERE]

    Policy Flash 2016-13 Policy Flash 2016-13 DATE: February 04, 2016 TO: Procurement Directors / Heads of Contracting Activities FROM: Chief Contract and Financial Assistance Policy Division Office of Policy Office of Acquisition Management SUBJECT: New Policy Flash Distribution Process SUMMARY: This office is automating the policy flash (PF) distribution process by using a listserv. As of February 18, 2016, the listserv will send PF notifications without attachments. PFs will no longer be sent via

  15. Investigation of criticality safety control infraction data at a nuclear facility

    SciTech Connect (OSTI)

    Cournoyer, Michael E.; Merhege, James F.; Costa, David A.; Art, Blair M.; Gubernatis, David C.

    2014-10-27

    Chemical and metallurgical operations involving plutonium and other nuclear materials account for most activities performed at the LANL's Plutonium Facility (PF-4). The presence of large quantities of fissile materials in numerous forms at PF-4 makes it necessary to maintain an active criticality safety program. The LANL Nuclear Criticality Safety (NCS) Program provides guidance to enable efficient operations while ensuring prevention of criticality accidents in the handling, storing, processing and transportation of fissionable material at PF-4. In order to achieve and sustain lower criticality safety control infraction (CSCI) rates, PF-4 operations are continuously improved, through the use of Lean Manufacturing and Six Sigma (LSS) business practices. Employing LSS, statistically significant variations (trends) can be identified in PF-4 CSCI reports. In this study, trends have been identified in the NCS Program using the NCS Database. An output metric has been developed that measures ADPSM Management progress toward meeting its NCS objectives and goals. Using a Pareto Chart, the primary CSCI attributes have been determined in order of those requiring the most management support. Data generated from analysis of CSCI data help identify and reduce number of corresponding attributes. In-field monitoring of CSCI's contribute to an organization's scientific and technological excellence by providing information that can be used to improve criticality safety operation safety. This increases technical knowledge and augments operational safety.

  16. Investigation of criticality safety control infraction data at a nuclear facility

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

    Cournoyer, Michael E.; Merhege, James F.; Costa, David A.; Art, Blair M.; Gubernatis, David C.

    2014-10-27

    Chemical and metallurgical operations involving plutonium and other nuclear materials account for most activities performed at the LANL's Plutonium Facility (PF-4). The presence of large quantities of fissile materials in numerous forms at PF-4 makes it necessary to maintain an active criticality safety program. The LANL Nuclear Criticality Safety (NCS) Program provides guidance to enable efficient operations while ensuring prevention of criticality accidents in the handling, storing, processing and transportation of fissionable material at PF-4. In order to achieve and sustain lower criticality safety control infraction (CSCI) rates, PF-4 operations are continuously improved, through the use of Lean Manufacturing andmore » Six Sigma (LSS) business practices. Employing LSS, statistically significant variations (trends) can be identified in PF-4 CSCI reports. In this study, trends have been identified in the NCS Program using the NCS Database. An output metric has been developed that measures ADPSM Management progress toward meeting its NCS objectives and goals. Using a Pareto Chart, the primary CSCI attributes have been determined in order of those requiring the most management support. Data generated from analysis of CSCI data help identify and reduce number of corresponding attributes. In-field monitoring of CSCI's contribute to an organization's scientific and technological excellence by providing information that can be used to improve criticality safety operation safety. This increases technical knowledge and augments operational safety.« less

  17. Temperature-dependent structural property and power factor of n type thermoelectric Bi{sub 0.90}Sb{sub 0.10} and Bi{sub 0.86}Sb{sub 0.14} alloys

    SciTech Connect (OSTI)

    Malik, K.; Das, Diptasikha; Bandyopadhyay, S.; Banerjee, Aritra; Center for Research in Nanoscience and Nanotechnology, University of Calcutta, JD-2, Sector-III, Saltlake City, Kolkata 700 098 ; Mandal, P.; Srihari, Velaga

    2013-12-09

    Thermal variation of structural property, linear thermal expansion coefficient (?), resistivity (?), thermopower (S), and power factor (PF) of polycrystalline Bi{sub 1-x}Sb{sub x} (x?=?0.10 and 0.14) samples are reported. Temperature-dependent powder diffraction experiments indicate that samples do not undergo any structural phase transition. Rietveld refinement technique has been used to perform detailed structural analysis. Temperature dependence of ? is found to be stronger for Bi{sub 0.90}Sb{sub 0.10}. Also, PF for direct band gap Bi{sub 0.90}Sb{sub 0.10} is higher as compared to that for indirect band gap Bi{sub 0.86}Sb{sub 0.14}. Role of electron-electron and electron-phonon scattering on ?, S, and PF has been discussed.

  18. Probabilistic Mechanical Reliability Prediction of Thermoelectric Legs

    SciTech Connect (OSTI)

    Jadaan, Osama M.; Wereszczak, Andrew A

    2009-05-01

    The probability of failure, Pf, for various square-arrayed thermoelectric device designs using bismuth telluride, lead telluride, or skutterudite thermoelectric materials were estimated. Only volume- or bulk-based Pf analysis was considered in this study. The effects of the choice of the thermoelectric material, the size of the leg array, the height of the thermoelectric legs, and the boundary conditions on the Pf of thermoelectric devices were investigated. Yielding of the solder contacts and mounting layer was taken into account. The modeling results showed that the use of longer legs, using skutterudites, allowing the thermoelectric device to freely deform while under a thermal gradient, and using smaller arrays promoted higher probabilities of survival.

  19. Tokamak Physics Experiment (TPX) power supply design and development

    SciTech Connect (OSTI)

    Neumeyer, C.; Bronner, G.; Lu, E.; Ramakrishnan, S.

    1995-04-01

    The Tokamak Physics Experiment (TPX) is an advanced tokamak project aimed at the production of quasi-steady state plasmas with advanced shape, heating, and particle control. TPX is to be built at the Princeton Plasma Physics Laboratory (PPPL) using many of the facilities from the Tokamak Fusion Test Reactor (TFTR). TPX will be the first tokamak to utilize superconducting (SC) magnets in both the toroidal field (TF) and poloidal field (PF) systems. This new feature requires a departure from the traditional tokamak power supply schemes. This paper describes the plan for the adaptation of the PPPL/FTR power system facilities to supply TPX. Five major areas are addressed, namely the AC power system, the TF, PF and Fast Plasma Position Control (FPPC) power supplies, and quench protection for the TF and PF systems. Special emphasis is placed on the development of new power supply and protection schemes.

  20. Removal and recovery of metal ions from process and waste streams using polymer filtration

    SciTech Connect (OSTI)

    Jarvinen, G.D.; Smith, B.F.; Robison, T.W.; Kraus, K.M.; Thompson, J.A.

    1999-06-13

    Polymer Filtration (PF) is an innovative, selective metal removal technology. Chelating, water-soluble polymers are used to selectively bind the desired metal ions and ultrafiltration is used to concentrate the polymer-metal complex producing a permeate with low levels of the targeted metal ion. When applied to the treatment of industrial metal-bearing aqueous process streams, the permeate water can often be reused within the process and the metal ions reclaimed. This technology is applicable to many types of industrial aqueous streams with widely varying chemistries. Application of PF to aqueous streams from nuclear materials processing and electroplating operations will be described.

  1. Structure and sequence analyses of Bacteroides proteins BVU_4064 and BF1687 reveal presence of two novel predominantly-beta domains, predicted to be involved in lipid and cell surface interactions

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

    Natarajan, Padmaja; Punta, Marco; Kumar, Abhinav; Yeh, Andrew P; Godzik, Adam; Aravind, L.

    2015-01-16

    N-terminal domains of BVU_4064 and BF1687 proteins from Bacteroides vulgatus and Bacteroides fragilis respectively are members of the Pfam family PF12985 (DUF3869). Proteins containing a domain from this family can be found in most Bacteroides species and, in large numbers, in all human gut microbiome samples. Both BVU_4064 and BF1687 proteins have a consensus lipobox motif implying they are anchored to the membrane, but their functions are otherwise unknown. The C-terminal half of BVU_4064 is assigned to protein family PF12986 (DUF3870); the equivalent part of BF1687 was unclassified.

  2. Environmentally Safe Control of Zebra Mussel Fouling

    SciTech Connect (OSTI)

    Daniel Molloy

    2008-02-29

    The two primary objectives of this USDOE-NETL contract were successfully achieved during the project: (1) to accelerate research on the development of the bacterium Pseudomonas fluorescens strain CL145A (Pf-CL145A) as a biocontrol agent for zebra mussels (Dreissena polymorpha) and quagga mussels (Dreissena rostriformis bugensis)--two invasive freshwater bivalve species that are infesting water pipes in power plants; and (2) to identify a private-sector company that would move forward to commercialize Pf-CL145A as a substitute for the current polluting use of biocide chemicals for control of these dreissenid mussels in power plant pipes.

  3. Notices

    Energy Savers [EERE]

    189 Federal Register / Vol. 80, No. 127 / Thursday, July 2, 2015 / Notices 1 The appendices referenced in this notice will not appear in the Federal Register. Copies of the appendices were sent to all those receiving this notice in the mail and are available at www.ferc.gov Continued Dated: June 24, 2015. Kimberly D. Bose, Secretary. [FR Doc. 2015-16308 Filed 7-1-15; 8:45 am] BILLING CODE 6717-01-P DEPARTMENT OF ENERGY Federal Energy Regulatory Commission [Docket Nos. PF15-18-000 and PF15-19-

  4. Helium isotope study of geothermal features in Chile with field and laboratory data

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

    Dobson, Patrick

    2013-02-11

    Dobson, P.F., Kennedy, B.M., Reich, M., Sanchez, P., and Morata, D. (2013) Effects of volcanism, crustal thickness, and large scale faulting on the He isotope signatures of geothermal systems in Chile. Proceedings, 38th Workshop on Geothermal Reservoir Engineering, Stanford University, Feb. 11-13, 2013

  5. Two-pulse rapid remote surface contamination measurement.

    SciTech Connect (OSTI)

    Headrick, Jeffrey M.; Kulp, Thomas J.; Bisson, Scott E.; Reichardt, Thomas A.; Farrow, Roger L.

    2010-11-01

    This project demonstrated the feasibility of a 'pump-probe' optical detection method for standoff sensing of chemicals on surfaces. Such a measurement uses two optical pulses - one to remove the analyte (or a fragment of it) from the surface and the second to sense the removed material. As a particular example, this project targeted photofragmentation laser-induced fluorescence (PF-LIF) to detect of surface deposits of low-volatility chemical warfare agents (LVAs). Feasibility was demonstrated for four agent surrogates on eight realistic surfaces. Its sensitivity was established for measurements on concrete and aluminum. Extrapolations were made to demonstrate relevance to the needs of outside users. Several aspects of the surface PF-LIF physical mechanism were investigated and compared to that of vapor-phase measurements. The use of PF-LIF as a rapid screening tool to 'cue' more specific sensors was recommended. Its sensitivity was compared to that of Raman spectroscopy, which is both a potential 'confirmer' of PF-LIF 'hits' and is also a competing screening technology.

  6. Compatibility of Lithium Salts with Solvent of the Non-Aqueous Electrolyte in LiO2 Batteries

    SciTech Connect (OSTI)

    Du, Peng; Lu, Jun; Lau, Kah Chun; Luo, Xiangyi; Bareno, Javier; Zhang, Xiaoyi; Ren, Yang; Zhang, Zhengcheng; Curtiss, Larry A.; Sun, Yang-Kook; Amine, Khalil

    2013-02-20

    The stability of lithium salts, especially in the presence of reduced oxygen species, O2 and H2O (even in a small amount), plays an important role in the cyclability and capacity of LiO2 cells. This combined experimental and computational study provides evidence that the stability of the electrolyte used in LiO2 cells strongly depends on the compatibility of lithium salts with solvent. In the case of the LiPF61NM3 electrolyte, the decomposition of LiPF6 occurs in the cell as evidenced by in situ XRD, FT-IR and XPS analysis, which triggers the decomposition of 1NM3 solvent due to formation of HF from the decomposition of LiPF6. These reactions lead to degradation of the electrolyte and cause poor cyclability of the cell. The same reactions are not observed when LiTFSI and LiCF3SO3 are used as the lithium salts in 1NM3 solvent, or LiPF6 is used in TEGDME solvent.

  7. Helium isotope study of geothermal features in Chile with field and laboratory data

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

    Dobson, Patrick

    Dobson, P.F., Kennedy, B.M., Reich, M., Sanchez, P., and Morata, D. (2013) Effects of volcanism, crustal thickness, and large scale faulting on the He isotope signatures of geothermal systems in Chile. Proceedings, 38th Workshop on Geothermal Reservoir Engineering, Stanford University, Feb. 11-13, 2013

  8. Protective Force Program

    Broader source: Directives, Delegations, and Requirements [Office of Management (MA)]

    2000-06-30

    Establishes policy, requirements, responsibilities, and authorities, for the management and operation of the Department of Energy (DOE) Protective Force (PF) Program. Extended until 7-7-06 by DOE N 251.64, dated 7-7-05 Cancels: DOE 5632.7A

  9. Protective Force Program Manual

    Broader source: Directives, Delegations, and Requirements [Office of Management (MA)]

    2001-12-20

    Provides detailed requirements to supplement DOE O 473.2, PROTECTIVE FORCE PROGRAM, which establishes the requirements and responsibilities for management and operation of the Department of Energy (DOE) Protective Force (PF) Program. Change 1 revised pages in Chapters IV and VI on 12/20/2001.

  10. Final environmental assessment: TRU waste drum staging building, Technical Area 55, Los Alamos National Laboratory

    SciTech Connect (OSTI)

    1996-02-09

    Much of the US Department of Energy`s (DOE`s) research on plutonium metallurgy and plutonium processing is performed at Los Alamos National Laboratory (LANL), in Los Alamos, New Mexico. LANL`s main facility for plutonium research is the Plutonium Facility, also referred to as Technical Area 55 (TA-55). The main laboratory building for plutonium work within the Plutonium Facility (TA-55) is the Plutonium Facility Building 4, or PF-4. This Environmental Assessment (EA) analyzes the potential environmental effects that would be expected to occur if DOE were to stage sealed containers of transuranic (TRU) and TRU mixed waste in a support building at the Plutonium Facility (TA-55) that is adjacent to PF-4. At present, the waste containers are staged in the basement of PF-4. The proposed project is to convert an existing support structure (Building 185), a prefabricated metal building on a concrete foundation, and operate it as a temporary staging facility for sealed containers of solid TRU and TRU mixed waste. The TRU and TRU mixed wastes would be contained in sealed 55-gallon drums and standard waste boxes as they await approval to be transported to TA-54. The containers would then be transported to a longer term TRU waste storage area at TA-54. The TRU wastes are generated from plutonium operations carried out in PF-4. The drum staging building would also be used to store and prepare for use new, empty TRU waste containers.

  11. Fast Curing of Composite Wood Products

    SciTech Connect (OSTI)

    Dr. Arthur J. Ragauskas

    2006-04-26

    The overall objective of this program is to develop low temperature curing technologies for UF and PF resins. This will be accomplished by: Identifying the rate limiting UF and PF curing reactions for current market resins; Developing new catalysts to accelerate curing reactions at reduced press temperatures and times. In summary, these new curing technologies will improve the strength properties of the composite wood products and minimize the detrimental effects of wood extractives on the final product while significantly reducing energy costs for wood composites. This study is related to the accelerated curing of resins for wood composites such as medium density fiberboard (MDF), particle board (PB) and oriented strandboard (OSB). The latter is frequently manufactured with a phenol-formaldehyde resin whereas ureaformaldehyde (UF) resins are usually used in for the former two grades of composite wood products. One of the reasons that hinder wider use of these resins in the manufacturing of wood composites is the slow curing speed as well as inferior bondability of UF resin. The fast curing of UP and PF resins has been identified as an attractive process development that would allow wood to be bonded at higher moisture contents and at lower press temperatures that currently employed. Several differing additives have been developed to enhance cure rates of PF resins including the use of organic esters, lactones and organic carbonates. A model compound study by Conner, Lorenz and Hirth (2002) employed 2- and 4-hydroxymethylphenol with organic esters to examine the chemical basis for the reported enhanced reactivity. Their studies suggested that the enhance curing in the presence of esters could be due to enhanced quinone methide formation or enhanced intermolecular SN2 reactions. In either case the esters do not function as true catalysts as they are consumed in the reaction and were not found to be incorporated in the polymerized resin product. An alternative approach to accelerated PF curing can be accomplished with the addition amines or amides. The later functionality undergoes base catalyzed hydrolysis yielding the corresponding carboxyl ate and free amine which rapidly reacts with the phenolic methylol groups facilitating polymerization and curing of the PF resin (Pizzi, 1997).

  12. Internal Technical Report, Safety Analysis Report 5 MW(e) Raft River Research and Development Plant

    SciTech Connect (OSTI)

    Brown, E.S.; Homer, G.B.; Shaber, C.R.; Thurow, T.L.

    1981-11-17

    The Raft River Geothermal Site is located in Southern Idaho's Raft River Valley, southwest of Malta, Idaho, in Cassia County. EG and G idaho, Inc., is the DOE's prime contractor for development of the Raft River geothermal field. Contract work has been progressing for several years towards creating a fully integrated utilization of geothermal water. Developmental progress has resulted in the drilling of seven major DOE wells. Four are producing geothermal water from reservoir temperatures measured to approximately 149 C (approximately 300 F). Closed-in well head pressures range from 69 to 102 kPa (100 to 175 psi). Two wells are scheduled for geothermal cold 60 C (140 F) water reinjection. The prime development effort is for a power plant designed to generate electricity using the heat from the geothermal hot water. The plant is designated as the ''5 MW(e) Raft River Research and Development Plant'' project. General site management assigned to EG and G has resulted in planning and development of many parts of the 5 MW program. Support and development activities have included: (1) engineering design, procurement, and construction support; (2) fluid supply and injection facilities, their study, and control; (3) development and installation of transfer piping systems for geothermal water collection and disposal by injection; and (4) heat exchanger fouling tests.

  13. Internal Technical Report, Safety Analysis Report 5 MW(e) Raft River Pilot Plant

    SciTech Connect (OSTI)

    Brown, E.S.; Homer, G.B.; Spencer, S.G.; Shaber, C.R.

    1980-05-30

    The Raft River Geothermal Site is located in Southern Idaho's Raft River Valley, southwest of Malta, Idaho, in Cassia County. EG and G idaho, Inc., is the DOE's prime contractor for development of the Raft River geothermal field. Contract work has been progressing for several years towards creating a fully integrated utilization of geothermal water. Developmental progress has resulted in the drilling of seven major DOE wells. Four are producing geothermal water from reservoir temperatures measured to approximately 149 C (approximately 300 F). Closed-in well head pressures range from 69 to 102 kPa (100 to 175 psi). Two wells are scheduled for geothermal cold 60 C (140 F) water reinjection. The prime development effort is for a power plant designed to generate electricity using the heat from the geothermal hot water. The plant is designated as the ''5 MW(e) Raft River Research and Development Plant'' project. General site management assigned to EG and G has resulted in planning and development of many parts of the 5 MW program. Support and development activities have included: (1) engineering design, procurement, and construction support; (2) fluid supply and injection facilities, their study, and control; (3) development and installation of transfer piping systems for geothermal water collection and disposal by injection; and (4) heat exchanger fouling tests.

  14. Lithium Salts for Advanced Lithium Batteries: Li-metal, Li-O2, and Li-S

    SciTech Connect (OSTI)

    Younesi, Reza; Veith, Gabriel M; Johansson, Patrik; Edstrom, Kristina; Vegge, Tejs

    2015-01-01

    Presently lithium hexafluorophosphate (LiPF6) is the dominant Li-salt used in commercial rechargeable lithium-ion batteries (LIBs) based on a graphite anode and a 3-4 V cathode material. While LiPF6 is not the ideal Li-salt for every important electrolyte property, it has a uniquely suitable combination of properties (temperature range, passivation, conductivity, etc.) rendering it the overall best Li-salt for LIBs. However, this may not necessarily be true for other types of Li-based batteries. Indeed, next generation batteries, for example lithium-metal (Li-metal), lithium-oxygen (Li-O2), and lithium sulphur (Li-S), require a re-evaluation of Li-salts due to the different electrochemical and chemical reactions and conditions within such cells. This review explores the critical role Li-salts play in ensuring in these batteries viability.

  15. Spatially resolved high-resolution x-ray spectroscopy of high-current plasma-focus discharges

    SciTech Connect (OSTI)

    ZajaPc, S.; Rzadkiewicz, J.; Scholz, M.; Paduch, M.; Zielinska, E.; Rosmej, O.; Yongtao, Zhao; Gojska, A.

    2010-10-15

    Soft x-ray emission from a Mather-type plasma-focus device (PF-1000) operated at {approx}400 kJ was measured. The high density and temperature plasma were generated by the discharge in the deuterium-argon gas mixture in the modified (high-current) plasma-focus configuration. A spherically bent mica crystal spectrograph viewing the axial output of the pinch region was used to measure the x-ray spectra. Spatially resolved spectra including the characteristic x-ray lines of highly ionized Ar and continua were recorded by means of an x-ray film. The x-ray emission of PF-1000 device was studied at different areas of the pinch.

  16. Bipolar monolithic preamplifiers for SSC silicon calorimetry

    SciTech Connect (OSTI)

    Britton, C.L. Jr.; Todd, R.A.; Bauer, M.L. ); Kennedy, E.J. . Dept. of Electrical and Computer Engineering Oak Ridge National Lab., TN ); Bugg, W.M. . Dept. of Physics)

    1990-01-01

    This paper describes preamplifiers designed specifically to address the requirements of silicon calorimetry for the Superconducting Super Collider (SSC). Eight different preamplifiers designed for detector capacitances ranging from 20 pF to 500 pF and operating temperatures from 25{degree}C to {minus}20{degree}C are discussed. The preamplifiers were fabricated with two different high-frequency processes (one with the VTC, Inc. VJ900 process, seven with the Harris Semiconductor VHF Process). The different topologies and their features are discussed in addition to the design methodologies employed. The results for noise, power consumption, speed, and radiation damage effects as well as data for post-damage annealing are presented for the VTC process preamplifier. Simulations for the VHF Process circuits are presented. This work was funded through SSC Generic Detector funding, SSC Detector Subsystem funding, and the Oak Ridge National Laboratory (ORNL) Detector Center.

  17. Cray XE6 Architecture John Shalf NERSC XE6 User Training

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

    XE6 Architecture John Shalf NERSC XE6 User Training Feb 7, 2011 2 NERSC-6 Grace "Hopper" Cray XE6 Performance 1.2 PF Peak 1.05 PF HPL (#5) Processor AMD MagnyCours 2.1 GHz 12-core 8.4 GFLOPs/core 24 cores/node 32-64 GB DDR3-1333 per node System Gemini Interconnect (3D torus) 6392 nodes 153,408 total cores I/O 2PB disk space 70GB/s peak I/O Bandwidth Potential System Architectures What is Possible Systems 2009 2015 +1/-0 2018 +1/-0 System peak 2 Peta 100-300 Peta 1 Exa Power 6 MW ~15 MW

  18. Smoothed Particle Hydrodynamics pore-scale simulations of unstable immiscible flow in porous media

    SciTech Connect (OSTI)

    Bandara, Dunusinghe Mudiyanselage Uditha C.; Tartakovsky, Alexandre M.; Oostrom, Martinus; Palmer, Bruce J.; Grate, Jay W.; Zhang, Changyong

    2013-12-01

    We have conducted a series of high-resolution numerical experiments using the Pair-Wise Force Smoothed Particle Hydrodynamics (PF-SPH) multiphase flow model. First, we derived analytical expressions relating parameters in the PF-SPH model to the surface tension and static contact angle. Next, we used the model to study viscous fingering, capillary fingering, and stable displacement of immiscible fluids in porous media for a wide range of capillary numbers and viscosity ratios. We demonstrated that the steady state saturation profiles and the boundaries of viscous fingering, capillary fingering, and stable displacement regions compare favorably with micromodel laboratory experimental results. For displacing fluid with low viscosity, we observed that the displacement pattern changes from viscous fingering to stable displacement with increasing injection rate. When a high viscosity fluid is injected, transition behavior from capillary fingering to stable displacement occurred as the flow rate was increased. These observation also agree with the results of the micromodel laboratory experiments.

  19. Three-dimensional structures of Plasmodium falciparum spermidine synthase with bound inhibitors suggest new strategies for drug design

    SciTech Connect (OSTI)

    Sprenger, Janina; Svensson, Bo; Hlander, Jenny; Carey, Jannette; Persson, Lo; Al-Karadaghi, Salam

    2015-03-01

    In this work, X-ray crystallography was used to examine ligand complexes of spermidine synthase from the malaria parasite Plasmodium falciparum (PfSpdS). The enzymes of the polyamine-biosynthesis pathway have been proposed to be promising drug targets in the treatment of malaria. Spermidine synthase (SpdS; putrescine aminopropyltransferase) catalyzes the transfer of the aminopropyl moiety from decarboxylated S-adenosylmethionine to putrescine, leading to the formation of spermidine and 5?-methylthioadenosine (MTA). In this work, X-ray crystallography was used to examine ligand complexes of SpdS from the malaria parasite Plasmodium falciparum (PfSpdS). Five crystal structures were determined of PfSpdS in complex with MTA and the substrate putrescine, with MTA and spermidine, which was obtained as a result of the enzymatic reaction taking place within the crystals, with dcAdoMet and the inhibitor 4-methylaniline, with MTA and 4-aminomethylaniline, and with a compound predicted in earlier in silico screening to bind to the active site of the enzyme, benzimidazol-(2-yl)pentan-1-amine (BIPA). In contrast to the other inhibitors tested, the complex with BIPA was obtained without any ligand bound to the dcAdoMet-binding site of the enzyme. The complexes with the aniline compounds and BIPA revealed a new mode of ligand binding to PfSpdS. The observed binding mode of the ligands, and the interplay between the two substrate-binding sites and the flexible gatekeeper loop, can be used in the design of new approaches in the search for new inhibitors of SpdS.

  20. Polymer filtration systems for dilute metal ion recovery

    SciTech Connect (OSTI)

    Smith, B.F.; Robison, T.W.; Jarvinen, G.D.

    1998-12-01

    Scientists at Los Alamos National Laboratory have developed a metal recovery system that meets the global treatment demands for all kinds of industrial and metal-processing streams. The Polymer Filtration (PF) System--a process that is easily operated and robust--offers metal-finishing businesses a convenient and inexpensive way to recover and recycle metal ions in-house, thus reducing materials costs, waste removal costs, and industrial liability. As a valuable economic and environmental asset, the PF System has been named a winner of a 1995 R and D 100 Award. These awards are presented annually by R and D Magazine to the one hundred most significant technical innovations of the year. The PF System is based on the use of water-soluble metal-binding polymers and on advanced ultrafiltration membranes. Customers for this technology will receive new soluble polymers, especially formulated for their waste stream, and the complete PF processing unit: a reaction reservoir, pumps, plumbing, controls, and the advanced ultrafiltration membranes, all in a skid mounted frame. Metal-bearing waste water is treated in the reaction reservoir, where the polymer binds with the metal ions under balanced acid/base conditions. The reservoir fluid is then pumped through the ultrafiltration system--a cartridge packed with ultrafiltration membranes shaped in hollow fibers. As the fluid travels inside the fiber, water and other small molecules--simple salts such as calcium and sodium, for example--pass through the porous membrane walls of the fibers and are discharged through the outlet as permeate. The polymer-bound metal, which is too large to pass through the pores, is both purified and concentrated inside the hollow fibers and is returned to the fluid reservoir for further waste water treatment.

  1. OFF-SITE SURVEILLANCE ACTIVITIES 0" THE SOUTHWESTERN RADIOLOGICAL HEALTH LABORATORY

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

    977 7 OFF-SITE SURVEILLANCE ACTIVITIES 0" THE SOUTHWESTERN RADIOLOGICAL HEALTH LABORATORY from January through June 1969 Environmental Surveillance Southwestern Radiological Health Laboratory ENVIRONMENTAL PROTECTION AGENCY February 1971 This surveillance performed under a Memorandum of Understanding (No. SF 54 373) for the U. S. ATOMIC ENERGY COMMISSION -- SWRHL-97r pf' SWRHL-97r OFF-SITE SURVEILLANCE ACTIVITIES OF THE SOUTHWESTERN RADIOLOGICAL HEALTH LABORATORY from January through June

  2. Project Facilitators for Federal Energy Savings Performance Contracts |

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

    Department of Energy Project Facilitators for Federal Energy Savings Performance Contracts Project Facilitators for Federal Energy Savings Performance Contracts Federal agencies developing U.S. Department of Energy (DOE) energy savings performance contract (ESPC) projects are required to work with a DOE-approved federal project facilitator (PF). PFs are experienced, unbiased advisors who guide the agency acquisition team through the ESPC process. The Federal Energy Management Program (FEMP)

  3. Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry

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

    Kent, Paul R. C.; Ganesh, Panchapakesan; Borodin, Oleg; Olguin, Marco; Allen, Joshua L.; Henderson, Wesley A.

    2015-11-17

    The composition of the lithium cation (Li+) solvation shell in mixed linear and cyclic carbonate-based electrolytes has been re-examined using Born–Oppenheimer molecular dynamics (BOMD) as a function of salt concentration and cluster calculations with ethylene carbonate:dimethyl carbonate (EC:DMC)–LiPF6 as a model system. A coordination preference for EC over DMC to a Li+ was found at low salt concentrations, while a slightly higher preference for DMC over EC was found at high salt concentrations. Analysis of the relative binding energies of the (EC)n(DMC)m–Li+ and (EC)n(DMC)m–LiPF6 solvates in the gas-phase and for an implicit solvent (as a function of the solvent dielectricmore » constant) indicated that the DMC-containing Li+ solvates were stabilized relative to (EC4)–Li+ and (EC)3–LiPF6 by immersing them in the implicit solvent. Such stabilization was more pronounced in the implicit solvents with a high dielectric constant. Results from previous Raman and IR experiments were reanalyzed and reconciled by correcting them for changes of the Raman activities, IR intensities and band shifts for the solvents which occur upon Li+ coordination. After these correction factors were applied to the results of BOMD simulations, the composition of the Li+ solvation shell from the BOMD simulations was found to agree well with the solvation numbers extracted from Raman experiments. Finally, the mechanism of the Li+ diffusion in the dilute (EC:DMC)LiPF6 mixed solvent electrolyte was studied using the BOMD simulations.« less

  4. EA-1963: Elba Liquefaction Project, Savannah, Georgia

    Office of Energy Efficiency and Renewable Energy (EERE)

    The Federal Energy Regulatory Commission (FERC) is preparing, with DOE as a cooperating agency, an EA to analyze the potential environmental impacts of a proposal to add natural gas liquefaction and export capabilities at the existing Elba Liquefied Natural Gas Terminal near Savannah, Georgia. Additional information is available at FERCs eLibrary website, elibrary.ferc.gov/idmws/docket_search.asp; search for docket number PF13-3.

  5. ASES Solar 2003 Americas Secure Energy

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

    Problems and Solutions: Training Disaster Organizations on the Use of PV Author Young, William Presented at: ASES 2003 Publication Number FSEC- PF-371-03 Copyright Copyright © Florida Solar Energy Center/University of Central Florida 1679 Clearlake Road, Cocoa, Florida 32922, USA (321) 638-1000 All rights reserved. Disclaimer The Florida Solar Energy Center/University of Central Florida nor any agency thereof, nor any of their employees, makes any warranty, express or implied, or assumes any

  6. Aguirre Offshore GasPort Project Final Environmental Impact Statement_Volume I

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

    Regulatory Commission Office of Energy Projects Washington, DC 20426 Aguirre Offshore GasPort Project Final Environmental Impact Statement Aguirre Offshore GasPort, LLC Volume I Docket Nos. CP13-193-000 and PF12-4-000 Cooperating Agencies: FERC/EIS-0253F U.S. Environmental Protection Agency U.S. Coast Guard Puerto Rico Permits Management Office Puerto Rico Environmental Quality Board Puerto Rico Planning Board Puerto Rico Department of Natural and Environmental Resources Puerto Rico Department

  7. old.new.factsheets.indd

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

    5 PF-4 LANL Plutonium-Processing Facilities National Security At the Los Alamos National Laboratory (LANL), virtually all plutonium operations occur within the Plutonium Facility at Tech- nical Area 55 (TA-55). TA-55 is the nation's most modern plu- tonium science and manufacturing facility, and it is the only fully operational, full capability plutonium facility in the nation. Thus, TA-55 supports a wide range of national security programs that involve stockpile stewardship, plutonium

  8. Authors: Carol Burns, Mark Chadwick, John Erickson, David Funk, and Robert Fulton

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

    Nuclear and Particle Futures (N&PF) Pillar Authors: Carol Burns, Mark Chadwick, John Erickson, David Funk, and Robert Fulton Contributions by: Malcolm Andrews, Mike Baker, Joe Carlson, Bruce Carlsten, Aaron Couture, Mark Crawford, Greg Dale, Ed Dendy, Brenda Dingus, Steve Elliott, Juan Fernandez, Julianna Fessenden-Rahn, Alex Friedland, Chris Fryer, Michael Graesser, Rajan Gupta, Anna Hayes, Andrew Hime, Hui Li, Andi Klein, Tom Kwan, Bob Little, Bill Louis, Christopher Mauger, Pat McGaughey,

  9. UNITED STATES OF AMERICA FEDERAL ENERGY REGULATORY COMMISSION

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

    Corporation Docket No. PF14-21-000 BP Alaska LNG, LLC Conoco Phillips Alaska LNG Company ExxonMobil Alaska LNG, LLC TransCanada Alaska Midstream, LP NOTICE OF INTENT TO PREPARE AN ENVIRONMENTAL IMPACT STATEMENT FOR THE PLANNED ALASKA LNG PROJECT AND REQUEST FOR COMMENTS ON ENVIRONMENTAL ISSUES (March 4, 2015) The staff of the Federal Energy Regulatory Commission (FERC or Commission) will prepare an environmental impact statement (EIS) that will discuss the environmental impacts of the Alaska LNG

  10. The TPX Cryostat Conceptual Design

    SciTech Connect (OSTI)

    Ravenscroft, D.; Posey, A.; Heitzenroeder, P.; Brown, T.

    1993-10-06

    The TPX (Tokamak Physics Experiment) will be the first tokamak to employ both superconducting TF (toroidal field) and PF (poloidal field) magnets. Consequently, the entire device is located within an evacuated cryostat to provide the necessary thermal barrier between the ambient temperature test cell and the magnets that are cooled by supercritical liquid helium at 5{degrees}K. This paper describes the cryostat design requirements, design concepts, and the cryostat fabrication and installation.

  11. Task Order Price Evaluation Worksheet for ESPCs | Department of Energy

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

    Task Order Price Evaluation Worksheet for ESPCs Task Order Price Evaluation Worksheet for ESPCs Document lists a series of site-specific proposal data questions to answer for a task order. Microsoft Office document icon pf-price_eval_worksheet_9.doc More Documents & Publications Task Order Price Evaluation Worksheet for SUPER ESPC Descriptions of ESPC Task Order Schedules and Placement of Pricing Information (IDIQ Attachment J-5) ESPC Task Order Financial Schedules (IDIQ Attachment J-6)

  12. Keeping ISRS Within Reason | Department of Energy

    Office of Environmental Management (EM)

    Keeping ISRS Within Reason Keeping ISRS Within Reason Keeping ISRS Within Reason Abe Lynn and Loring Wylie Degenkolb Engineers 2014 Natural Phenomena Hazards Meeting October 21-22, 2014 PDF icon Keeping ISRS Within Reason More Documents & Publications Risk-Informed Design of Seismic Isolation Systems for Nuclear Facilities Los Alamos National Laboratory Plutonium Facility (PF-4) Seismic Safety DOE-STD-1024-9

  13. In the past, disaster management used to only include support for hurricanes, floods, tornados, and earthquakes

    Office of Environmental Management (EM)

    Disasters: Photovoltaics for Special Needs Author Young, William Presented at: ISES/Solar World Congress 2005 CT4. PV Technologies, Systems, and Applications C. Stand-alone and Grid-connected PV Systems Orlando, Florida USA Publication Number FSEC-PF-384-04 Copyright Copyright © Florida Solar Energy Center/University of Central Florida 1679 Clearlake Road, Cocoa, Florida 32922, USA (321) 638-1000 All rights reserved. Disclaimer The Florida Solar Energy Center/University of Central Florida nor

  14. FORMERLY UTILIZED SITES REMEDIAL ACTION PROGRAM ELIMINATION REPORT

    Office of Legacy Management (LM)

    SENECA ARMY DEPOT ROMULUS, NEW YORK Department of Energy Office of Nuclear Energy Office of Remedial Action and kaste Technology. Division of Facility and Site Decommissioning Projects INTRODUCTION t3ACKGROUND CONTENTS . -Page Site Function Site Description Radiological History and Status ELIMINATION ANALYSIS REFERENCES 1 4 ii .___ -_-_..--. ._.".. ELIMINATION REPORT SENECA ARMY DEPOT ROMULUS, NEW YORK . INTRODUCTION The Department pf Energy (DOE), Office of Nuclear Energy, Office of

  15. Past:

    Office of Legacy Management (LM)

    z!_NEEiS1 Past: -iRAm E ---------------^--- ---- Owner contacted q yes Pf current: ------------_-------______ "a; if yea, date contacted -----0----_-- TYPE OF OPERATION ---------------__ ' 0 Research & Develapment Cl Facility Type 0 Manufactuiing 0 Bench Scale Process : Theoretical Stu$ies Sample & Analysis 0 Production Cl Disposal/Storage 0 University 0 Research Organization 0 Government Sponsored Facility Cl Other -----------------_--- TYPE OF CONTRACT ---_------------ q Prime 0

  16. Studies on the thermal breakdown of common Li-ion battery electrolyte components

    SciTech Connect (OSTI)

    Lamb, Joshua; Orendorff, Christopher J.; Roth, Emanuel Peter; Langendorf, Jill Louise

    2015-08-06

    While much attention is paid to the impact of the active materials on the catastrophic failure of lithium ion batteries, much of the severity of a battery failure is also governed by the electrolytes used, which are typically flammable themselves and can decompose during battery failure. The use of LiPF6 salt can be problematic as well, not only catalyzing electrolyte decomposition, but also providing a mechanism for HF production. This work evaluates the safety performance of the common components ethylene carbonate (EC), diethyl carbonate (DEC), dimethyl carbonate (DMC), and ethyl methyl carbonate (EMC) in the context of the gasses produced during thermal decomposition, looking at both the quantity and composition of the vapor produced. EC and DEC were found to be the largest contributors to gas production, both producing upwards of 1.5 moles of gas/mole of electrolyte. DMC was found to be relatively stable, producing very little gas regardless of the presence of LiPF6. EMC was stable on its own, but the addition of LiPF6 catalyzed decomposition of the solvent. As a result, while gas analysis did not show evidence of significant quantities of any acutely toxic materials, the gasses themselves all contained enough flammable components to potentially ignite in air.

  17. Studies on the thermal breakdown of common Li-ion battery electrolyte components

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

    Lamb, Joshua; Orendorff, Christopher J.; Roth, Emanuel Peter; Langendorf, Jill Louise

    2015-08-06

    While much attention is paid to the impact of the active materials on the catastrophic failure of lithium ion batteries, much of the severity of a battery failure is also governed by the electrolytes used, which are typically flammable themselves and can decompose during battery failure. The use of LiPF6 salt can be problematic as well, not only catalyzing electrolyte decomposition, but also providing a mechanism for HF production. This work evaluates the safety performance of the common components ethylene carbonate (EC), diethyl carbonate (DEC), dimethyl carbonate (DMC), and ethyl methyl carbonate (EMC) in the context of the gasses producedmore » during thermal decomposition, looking at both the quantity and composition of the vapor produced. EC and DEC were found to be the largest contributors to gas production, both producing upwards of 1.5 moles of gas/mole of electrolyte. DMC was found to be relatively stable, producing very little gas regardless of the presence of LiPF6. EMC was stable on its own, but the addition of LiPF6 catalyzed decomposition of the solvent. As a result, while gas analysis did not show evidence of significant quantities of any acutely toxic materials, the gasses themselves all contained enough flammable components to potentially ignite in air.« less

  18. Survival and Quality of Life After Stereotactic or 3D-Conformal Radiotherapy for Inoperable Early-Stage Lung Cancer

    SciTech Connect (OSTI)

    Widder, Joachim; Postmus, Douwe; Ubbels, Jan F.; Wiegman, Erwin M.; Langendijk, Johannes A.

    2011-11-15

    Purpose: To investigate survival and local recurrence after stereotactic ablative radiotherapy (SABR) or three-dimensional conformal radiotherapy (3D-CRT) administered for early-stage primary lung cancer and to investigate longitudinal changes of health-related quality of life (HRQOL) parameters after either treatment. Methods and Materials: Two prospective cohorts of inoperable patients with T1-2N0M0 primary lung tumors were analyzed. Patients received 70 Gy in 35 fractions with 3D-CRT or 60 Gy in three to eight fractions with SABR. Global quality of life (GQOL), physical functioning (PF), and patient-rated dyspnea were assessed using the respective dimensions of European Organization for Research and Treatment of Cancer Core Questionnaire-C30 and LC13. HRQOL was analyzed using multivariate linear mixed-effects modeling, survival and local control (LC) using the Kaplan-Meier method, Cox proportional hazards analysis, and Fine and Gray multivariate competing risk analysis as appropriate. Results: Overall survival (OS) was better after SABR compared with 3D-CRT with a HR of 2.6 (95% confidence interval [CI]: 1.5-4.8; p < 0.01). 3D-CRT conferred a subhazard ratio for LC of 5.0 (95% CI: 1.7-14.7; p < 0.01) compared with SABR. GQOL and PF were stable after SABR (p = 0.21 and p = 0.62, respectively). Dyspnea increased after SABR by 3.2 out of 100 points (95% CI: 1.0-5.3; p < 0.01), which is clinically insignificant. At 1 year, PF decreased by an excess of 8.7 out of 100 points (95% CI: 2.8-14.7; p < 0.01) after 3D-CRT compared with SABR. Conclusion: In this nonrandomized comparison of two prospective cohorts of medically inoperable patients with Stage I lung cancer, OS and LC were better after SABR. GQOL, PF, and patient-rated dyspnea were stable after SABR, whereas PF decreased after 3D-CRT approaching clinical significance already at 1 year.

  19. Effects of lithium salt concentration on graphited carbon microbead anodes in the piperidinium-based hybrid electrolytes

    SciTech Connect (OSTI)

    Gao, Kun; Li, Shu-Dan

    2015-01-15

    Graphical abstract: Lithium aggregates usually cause a significant decrease in Li{sup +} mobility and transfer efficiency. Therefore, as important as the problem of SEI, the content of lithium salt and the interaction between Li{sup +} and ILs anions should be taken into consideration in the optimization of ILs-based electrolytes for Li-ion batteries. - Highlights: Lithium aggregates in piperidinium-based electrolytes are evidenced by IR and NMR. High LiPF{sub 6} content could decrease Li{sup +} mobility due to ionic aggregates. Lithium salt concentration is an important factor affecting graphite performances. - Abstract: The variations in LiPF{sub 6} concentration lead to the very different electrochemical performances of carbon microbeads anodes in the piperidinium-based hybrid electrolytes. The two peaks behaviors of lithium plating observed in cyclic voltammetry tests, and some detailed changes in infrared spectra and nuclear magnetic resonance indicates that the formation of ionic aggregates related to lithium ions. Therefore, the excessive lithium salts in the piperidinium-based hybrid electrolytes, usually cause a significant decrease in Li{sup +} mobility and transfer efficiency. The main behaviors are that, when LiPF{sub 6} concentrations increased from 0.2 to 1.2 mol kg{sup ?1}, the apparent migration energies (E{sub a}) increase largely from 8.83 to 21.16 kJ mol{sup ?1}, while the lithium transference numbers (t{sub Li{sup +}}) drop markedly from 0.538 to 0.292.

  20. Dendrite-Free Li Deposition Using Trace-Amounts of Water as an Electrolyte Additive

    SciTech Connect (OSTI)

    Qian, Jiangfeng; Xu, Wu; Bhattacharya, Priyanka; Engelhard, Mark H.; Henderson, Wesley A.; Zhang, Yaohui; Zhang, Jiguang

    2015-07-01

    Residual water presents in nonaqueous electrolytes has been widely regarded as a detrimental factor for lithium (Li) batteries. This is because water is highly reactive with the commonly used LiPF6 salt and leads to the formation of HF that corrodes battery materials. In this work, we demonstrate that a controlled trace-amount of water (25-100 ppm) can be an effective electrolyte additive for achieving dendrite-free Li metal deposition in LiPF6-based electrolytes and avoid its detrimental effect at the same time. Detailed analyses reveal that the trace amount of HF formed by the decomposition reaction of LiPF6 with water will be electrochemically reduced during initial Li deposition process to form a uniform and dense LiF-rich SEI layer on the surface of the substrate. This LiF-rich SEI layer leads to a uniform distribution of the electric field on the substrate surface and enables uniform and dendrite-free Li deposition. Meanwhile the detrimental effect of HF is diminished due to the consumption of HF in the LiF formation process. Microscopic analysis reveals that the as-deposited dendrite-free Li films exhibit a self-aligned and highly-compacted Li nanorods structure which is consistent with their charming blue color or known as structure color. These findings clearly demonstrate a novel approach to control the nucleation and grow process of Li metal films using well-controlled trace-amount of water. They also shine the light on the effect of water on other electrodeposition processes.

  1. Use of the Charlson Combined Comorbidity Index To Predict Postradiotherapy Quality of Life for Prostate Cancer Patients

    SciTech Connect (OSTI)

    Wahlgren, Thomas; Levitt, Seymour; Kowalski, Jan; Nilsson, Sten; Brandberg, Yvonne

    2011-11-15

    Purpose: To determine the impact of pretreatment comorbidity on late health-related quality of life (HRQoL) scores after patients have undergone combined radiotherapy for prostate cancer, including high-dose rate brachytherapy boost and hormonal deprivation therapy. Methods and Materials: Results from the European Organization for Research and Treatment of Cancer QLQ-C30 questionnaire survey of 158 patients 5 years or more after completion of therapy were used from consecutively accrued subjects treated with curative radiotherapy at our institution, with no signs of disease at the time of questionnaire completion. HRQoL scores were compared with the Charlson combined comorbidity index (CCI), using analysis of covariance and multivariate regression models together with pretreatment factors including tumor stage, tumor grade, pretreatment prostate-specific antigen level, neoadjuvant hormonal treatment, diabetes status, cardiovascular status, and age and Charlson score as separate variables or the composite CCI. Results: An inverse correlation between the two HRQoL domains, long-term global health (QL) and physical function (PF) scores, and the CCI score was observed, indicating an impact of comorbidity in these function areas. Selected pretreatment factors poorly explained the variation in functional HRQoL in the multivariate models; however, a statistically significant impact was found for the CCI (with QL and PF scores) and the presence of diabetes (with QL and emotional function). Cognitive function and social function were not statistically significantly predicted by any of the pretreatment factors. Conclusions: The CCI proved to be valid in this context, but it seems useful mainly in predicting long-term QL and PF scores. Of the other variables investigated, diabetes had more impact than cardiovascular morbidity on HRQoL outcomes in prostate cancer.

  2. The importance of ion size and electrode curvature on electrical double layers in ionic liquids

    SciTech Connect (OSTI)

    Feng, G.; Qiao, R.; Huang, J; Dai, S.; Sumpter, B. G.; Meunier, V.

    2011-01-01

    Room-temperature ionic liquids (ILs) are an emerging class of electrolytes for supercapacitors. We investigate the effects of ion size and electrode curvature on the electrical double layers (EDLs) in two ILs 1-butyl-3-methylimidazolium chloride [BMIM][Cl] and 1-butyl-3-methylimidazolium hexafluorophosphate [BMIM][PF{sub 6}], using a combination of molecular dynamics (MD) and quantum density functional theory (DFT) simulations. The sizes of the counter-ion and co-ion affect the ion distribution and orientational structure of EDLs. The EDL capacitances near both planar and cylindrical electrodes were found to follow the order: [BMIM][Cl] (near the positive electrode) > [BMIM][PF{sub 6}] (near the positive electrode) ? [BMIM][Cl] (near the negative electrode) ? [BMIM][PF{sub 6}] (near the negative electrode). The EDL capacitance was also found to increase as the electrode curvature increases. These capacitance data can be fit to the Helmholtz model and the recently proposed exohedral electrical double-cylinder capacitor (xEDCC) model when the EDL thickness is properly parameterized, even though key features of the EDLs in ILs are not accounted for in these models. To remedy the shortcomings of existing models, we propose a Multiple Ion Layers with Overscreening (MILO) model for the EDLs in ILs that takes into account two critical features of such EDLs, i.e., alternating layering of counter-ions and co-ions and charge overscreening. The capacitance computed from the MILO model agrees well with the MD prediction. Although some input parameters of the MILO model must be obtained from MD simulations, the MILO model may provide a new framework for understanding many important aspects of EDLs in ILs (e.g., the variation of EDL capacitance with the electrode potential) that are difficult to interpret using classical EDL models and experiments.

  3. The Importance of Ion Size and Electrode Curvature on Electrical Double Layers in Ionic Liquids

    SciTech Connect (OSTI)

    Feng, Guang; Qiao, Rui; Huang, Jingsong; Dai, Sheng; Sumpter, Bobby G; Meunier, Vincent

    2010-01-01

    Room-temperature ionic liquids (ILs) are an emerging class of electrolytes for supercapacitors. We investigate the effects of ion size and electrode curvature on the electrical double layers (EDLs) in two ILs 1-butyl-3-methylimidazolium chloride [BMIM][Cl] and 1-butyl-3-methylimidazolium hexafluorophosphate [BMIM][PF(6)], using a combination of molecular dynamics (MD) and quantum density functional theory (DFT) simulations. The sizes of the counter-ion and co-ion affect the ion distribution and orientational structure of EDLs. The EDL capacitances near both planar and cylindrical electrodes were found to follow the order: [BMIM][Cl] (near the positive electrode) > [BMIM][PF(6)] (near the positive electrode) {approx} [BMIM][Cl] (near the negative electrode) {approx} [BMIM][PF(6)] (near the negative electrode). The EDL capacitance was also found to increase as the electrode curvature increases. These capacitance data can be fit to the Helmholtz model and the recently proposed exohedral electrical double-cylinder capacitor (xEDCC) model when the EDL thickness is properly parameterized, even though key features of the EDLs in ILs are not accounted for in these models. To remedy the shortcomings of existing models, we propose a 'Multiple Ion Layers with Overscreening' (MILO) model for the EDLs in ILs that takes into account two critical features of such EDLs, i.e., alternating layering of counter-ions and co-ions and charge overscreening. The capacitance computed from the MILO model agrees well with the MD prediction. Although some input parameters of the MILO model must be obtained from MD simulations, the MILO model may provide a new framework for understanding many important aspects of EDLs in ILs (e.g., the variation of EDL capacitance with the electrode potential) that are difficult to interpret using classical EDL models and experiments.

  4. Modelling of the internal dynamics and density in a tens of joules plasma focus device

    SciTech Connect (OSTI)

    Marquez, Ariel; Gonzalez, Jose; Tarifeno-Saldivia, Ariel; Pavez, Cristian; Soto, Leopoldo; Clausse, Alejandro

    2012-01-15

    Using MHD theory, coupled differential equations were generated using a lumped parameter model to describe the internal behaviour of the pinch compression phase in plasma focus discharges. In order to provide these equations with appropriate initial conditions, the modelling of previous phases was included by describing the plasma sheath as planar shockwaves. The equations were solved numerically, and the results were contrasted against experimental measurements performed on the device PF-50J. The model is able to predict satisfactorily the timing and the radial electron density profile at the maximum compression.

  5. COTNAINSETREFERENCE NO OF DOCUMENT BEING CONTINUED ~AGE OF

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

    NO OF DOCUMENT BEING CONTINUED ~AGE OF CONINUTIO SHE PF, , '-C c NAME OF OFFEROR OR CONTRACTOR WASHAINGTON. 1 IVEP, PPOTFCIO SDO2LUYI, roLT ITEM NO SUPPLIES/SERVICES QUANTITY UNIT UNIT PRICE AMOUNT App-rl Usel fU))J ( P~~PA 14 CIYBI Pr-' T 1, Contract N umber I)E-AC27-08RVI 4800 Continuation Page, Modification 106 Pagye 3 of 4 Attachment DE-AC27-O8RVI 4800, MODIFICATION 106 Replacement Pages Section B, Page B-3, (2 pages total including this cover page) Tank Operations Contract Section B

  6. Lithium Dendrite Formation

    SciTech Connect (OSTI)

    2015-03-06

    Scientists at the Department of Energy’s Oak Ridge National Laboratory have captured the first real-time nanoscale images of lithium dendrite structures known to degrade lithium-ion batteries. The ORNL team’s electron microscopy could help researchers address long-standing issues related to battery performance and safety. Video shows annular dark-field scanning transmission electron microscopy imaging (ADF STEM) of lithium dendrite nucleation and growth from a glassy carbon working electrode and within a 1.2M LiPF6 EC:DM battery electrolyte.

  7. Dendrite-Free Li Deposition Using Trace-Amounts of Water as an Electrolyte

    Office of Scientific and Technical Information (OSTI)

    Additive (Journal Article) | SciTech Connect Dendrite-Free Li Deposition Using Trace-Amounts of Water as an Electrolyte Additive Citation Details In-Document Search Title: Dendrite-Free Li Deposition Using Trace-Amounts of Water as an Electrolyte Additive Residual water presents in nonaqueous electrolytes has been widely regarded as a detrimental factor for lithium (Li) batteries. This is because water is highly reactive with the commonly used LiPF6 salt and leads to the formation of HF that

  8. Spectroscopy of {sup 52,53}Sc

    SciTech Connect (OSTI)

    Bhattacharyya, S.; Rejmund, M.; Navin, A.; Gelin, M.; Mittig, W.; Mukherjee, G.; Rejmund, F.; Roussel-Chomaz, P.; Poves, A.; Theisen, Ch.

    2009-01-15

    Excited states of neutron-rich odd-A and odd-odd Sc isotopes, populated in deep inelastic multinucleon transfer reactions, induced by a {sup 238}U beam on a thin {sup 48}Ca target, have been identified. A strong feeding of both yrast and nonyrast states in such a reaction is illustrated using a combination of a large efficiency spectrometer and a {gamma} detector array. The structure of the populated states is interpreted in terms of the role of the valence proton and neutrons and compared to shell model calculations in the full pf shell.

  9. Fermi Gamma-Ray Space Telescope: High-Energy Results From the First Year

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

    (Journal Article) | SciTech Connect Fermi Gamma-Ray Space Telescope: High-Energy Results From the First Year Citation Details In-Document Search Title: Fermi Gamma-Ray Space Telescope: High-Energy Results From the First Year Authors: Michelson, P.F. ; /KIPAC, Menlo Park ; Atwood, W.B. ; Ritz, S. ; /UC, Santa Cruz /UC, Santa Cruz, Phys. Dept. Publication Date: 2013-06-20 OSTI Identifier: 1084278 Report Number(s): SLAC-PUB-15630 arXiv:1011.0213 DOE Contract Number: AC02-76SF00515 Resource

  10. NERSC

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

    ! June 16, 2014 Databases and Data analytic frameworks at NERSC --- 1 --- Representa,on Storage Data Pre---processing Analysis Visualiza,on Sources Sharing a nd Collabora,on I have Terabytes of data, I need an easy, fast, interactive way to filter, aggregate, ... --- 3 --- Yushu Y ao NERSC Data Analytic Services --- 4 --- Big a nd D iverse C ompu2ng F acility 6000+ U sers, 7 00+ P rojects 3+ P etaFlops ( 20+pf m ore c oming) 50+ P B S torage Produc,on Data Services Science Engagement

  11. Fluid Interface Reactions, Structures and Transport

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

    Publication List For The Fluid Interface Reactions, Structures and Transport (FIRST) Energy Frontier Research Center * = Solely Supported by the FIRST Center ** = Not Solely Supported by the FIRST Center *Achtyl, J.L.; Unocic, R.R.; Xu, L.; Yu, C.; Raju, M.; Zhang, W.; Sacci, R.L.; Vlassiouk, I.V.; Fulvio P.F.; Ganesh, P.; Wesolowski, D.J.; Dai, S.; van Duin, A.C.T.; Neurock, M.; Geiger, F.M. Aqueous Proton Transfer across Single Layer Graphene. Nat. Comm. 2015, 6, 6539, [10.1038/ncomms7539]. *

  12. Looking northeast over the ITER construction site

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

    Looking northeast over the ITER construction site. A power shovel removes the first of some 230,000 cubic meters from the Tokamak Pit. Operations and Safety on the ITER Platform are being carefully coordinated by the Engage Consortium and the French company APAVE. Bulldozers and scrapers are busy leveling the 14,000 square-meter area that will host the huge PF Coils Assembly Building. Welcome to the first U.S. ITER newsletter. We have prepared this publication as part of our effort to better

  13. IDO-19300bfigs.pdf

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

    Fig. 58 )... ~ ~ ~ ~ G ~ ~ ~ ~ ~ ~ ~ ~ ~~ .,,;:0) ~ ~ " ~ --J)... ~~ ~~ ~ ~ I() ~ l4:: I 4 fi } ~ ~ ,- c "' Pf/()TO-ANALYSIS OF VESSEL INTERIOR. i8ERRJNrE:QFROM tJSNPIC REPORT N-PZII P.6) 59. 4 MINIATURE CAMERA PHOTOGRAPH THROUGH PORT No.8 Fig. 61 ~ .0 - I - - " .I~ , . ~ ~ / Q fr) WATER PROBE ENTRY REFERENCE DIMENSIONS Fig.63 CORE SHP.OUD ~ ~ (() .~ t( ." O}'PICJAL USE ON1.f .50RVEYE./) - J/IN. /0. /96'/ RAOIATION SURVEYOF SL -I MILITARY TRAINING BUILOING Fig.69 5VA v£YED

  14. UNITED STATES OF AMERICA FEDERAL ENERGY REGULATORY COMMISSION

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

    Gulf LNG Liquefaction Company, LLC Docket No. PF13-4-000 Gulf LNG Energy, LLC Gulf LNG Pipelines, LLC NOTICE OF EXTENSION OF TIME (August 27, 2014) On July 31, 2014, the Commission issued a "Notice of Intent to Prepare an Environmental Impact Statement for the Planned Gulf LNG Liquefaction Project, Request for Comments on Environmental Issues, and Notice of Public Scoping Meeting" (NOI). The NOI identified September 1, 2014 as the close of the scoping period. It has come to our

  15. No I .+,o L

    Office of Legacy Management (LM)

    pf- ,'46-G 1 No I .+,o L ---+-~"~----* ARMY SERVICE FORCES UNITED STATES ENGINEER OFFICE if?GFERGaD L~'Z EID.u CGA 3ll MANHATTAN DISTRJCT D0uMm-l CHlMOO AllU orncz P. 0. BOX 6140 A CHICAGO 80. tLLlNOlS 17 October 1945 Subject: The l24th F'ield Artillery Anmy Building, Chicago, Illinois '1 \ To: The District Zugiaeer, U. S. Engineer Office, b&n&tan District, Oak Eidge, Tennessee . "-2 -\, - Attention: Contract Section Q? ( sip ( Uhder date of 15 September 1943, The University,of

  16. ORIGINAL UNITED STATES ENVIRONMENTAL PROTECTION AGENCY REGION

    Energy Savers [EERE]

    ORIGINAL UNITED STATES ENVIRONMENTAL PROTECTION AGENCY REGION III 1050 Arch Street Philadelphia, Pennsylvania 10103-2029 November 15, 2012 I 'D.J cri rn n n~ nrv I Kimberly D. Bose, Secretary Federal Energy Regulatory Commission 888 First Street NE, Room 1A Washington, DC 20426 ~s- ~l RE: EPA Region 3 Seeping Comments in Response to FERC's Netic&iklnfent ton= Prepare an Environmental Assessment (EA) for the Planned Cove Po@P " g Liquefaction Project; FERC Docket Ne. PF12-16-000

  17. TO: FILE FRml: J&-q Ma

    Office of Legacy Management (LM)

    nEnaRAt4Dun TO: FILE FRml: J&-q Ma __--------- SUBJECT:' g I**;&4 AfI~s-dd-rs , /y/u,,r(,, ALTERNATE AIA& ___-_-__--_____-____------------------- NAnE:--------_________--__ CITY: M.'Iw.r\CcrQ STATE: -em-- -- wes) fiv;s ____ --------- ti 1 w!!!!2%2. Past: _______----__------~~~~~ Current:____-_-___------- Owner cnntacted Pf yes Q no; if yes, date contacted--- /1,7-w~~~I ,I TYPE OF OPERATION (4MJ J?i- 5796 zb7~:r~ __-- ____ -----_--- q Research & Development cl Faci 1 i ty Type 0

  18. MEMORANDUM

    Office of Legacy Management (LM)

    c4 TO: FILE -___ mm4: L!!4Goti-QktiEZ SUBJECT: ,.. I ",;;' ,: d*s. (3-ew m----e-' ------ ---bLo _____________ ----STATE: -?!S& G o+J CITY: Rcno RcSe=udi OWNER(S) ; if yes, date contacted ,, ~I+*4 ## AJPUA - ?OJ -534 I 1 , TYPE OF OPERATION ----------------- Pf Research 81 Development 0 Facility Type .. 0 Production scale testinq Cl Pilot Scale 0 Bench Scale Process i Theoretical Studies Sample SC Analysis * Manuf acturinq 0 University 0 Research Organization 0 Government Sponsored

  19. Title

    National Nuclear Security Administration (NNSA)

    Noteworthy Mammal Distribution Records for the Nevada Test Site (RE: "Great Basin Naturalist" 50(1)) This report adds three new mammal species to the original 46 species that occur on the NTS. Technical Reference Document Author Medica, P.A. 100990 Document Date ERC Index number 1/1/90 05.09.034 Document Type Box Number Report 1684-1 Recipients EG&G/EM ADMIN RECORD # HP LIBRARY PF EG&G/EM Environmental Sciences Department Crral HaMll Nutiir.lllNl "><MI. I'M), pp. S

  20. Use of bark-derived pyrolysis oils ass a phenol substitute in structural panel adhesives

    SciTech Connect (OSTI)

    Louisiana Pacific Corp

    2004-03-01

    The main objective of this program was to pilot the world's first commercial-scale production of an acceptable phenol formaldehyde (PF) resin containing natural resin (NR) ingredients, for use as an adhesive in Oriented-Strand Board (OSB) and plywood panel products. Natural Resin products, specifically MNRP are not lignin ''fillers''. They are chemically active, natural phenolics that effectively displace significant amounts of phenol in PF resins, and which are extracted from bark-derived and wood-derived bio-oils. Other objectives included the enhancement of the economics of NR (MNRP) production by optimizing the production of certain Rapid Thermal Processing (RTP{trademark}) byproducts, particularly char and activated carbon. The options were to activate the char for use in waste-water and/or stack gas purification. The preliminary results indicate that RTP{trademark} carbon may ultimately serve as a feedstock for activated carbon synthesis, as a fuel to be used within the wood product mill, or a fuel for an electrical power generating facility. Incorporation of the char as an industrial heat source for use in mill operations was L-P's initial intention for the carbon, and was also of interest to Weyerhaeuser as they stepped into in the project.

  1. Investigation of injury/illness data at a nuclear facility. Part II

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

    Cournoyer, Michael E.; Garcia, Vincent E.; Sandoval, Arnold N.; George, Gerald L.; Gubernatis, David C.; Schreiber, Stephen B.

    2015-07-01

    At Los Alamos National Laboratory (LANL), there are several nuclear facilities, accelerator facilities, radiological facilities, explosives sites, moderate- and high-hazard non-nuclear facilities, biosciences laboratory, etc. The Plutonium Science and Manufacturing Directorate (ADPSM) provides special nuclear material research, process development, technology demonstration, and manufacturing capabilities. ADPSM manages the LANL Plutonium Facility. Within the Radiological Control Area at TA-55 (PF-4), chemical and metallurgical operations with plutonium and other hazardous materials are performed. LANL Health and Safety Programs investigate injury and illness data. In this study, statistically significant trends have been identified and compared for LANL, ADPSM, and PF-4 injury/illness cases. A previouslymore » described output metric is used to measures LANL management progress towards meeting its operational safety objectives and goals. Timelines are used to determine trends in Injury/Illness types. Pareto Charts are used to prioritize causal factors. The data generated from analysis of Injury/Illness data have helped identify and reduce the number of corresponding causal factors.« less

  2. Investigation of injury/illness data at a nuclear facility. Part II

    SciTech Connect (OSTI)

    Cournoyer, Michael E.; Garcia, Vincent E.; Sandoval, Arnold N.; George, Gerald L.; Gubernatis, David C.; Schreiber, Stephen B.

    2015-07-01

    At Los Alamos National Laboratory (LANL), there are several nuclear facilities, accelerator facilities, radiological facilities, explosives sites, moderate- and high-hazard non-nuclear facilities, biosciences laboratory, etc. The Plutonium Science and Manufacturing Directorate (ADPSM) provides special nuclear material research, process development, technology demonstration, and manufacturing capabilities. ADPSM manages the LANL Plutonium Facility. Within the Radiological Control Area at TA-55 (PF-4), chemical and metallurgical operations with plutonium and other hazardous materials are performed. LANL Health and Safety Programs investigate injury and illness data. In this study, statistically significant trends have been identified and compared for LANL, ADPSM, and PF-4 injury/illness cases. A previously described output metric is used to measures LANL management progress towards meeting its operational safety objectives and goals. Timelines are used to determine trends in Injury/Illness types. Pareto Charts are used to prioritize causal factors. The data generated from analysis of Injury/Illness data have helped identify and reduce the number of corresponding causal factors.

  3. Tool and Fixture Design

    SciTech Connect (OSTI)

    Graham, Mark W.

    2015-07-28

    In a manufacturing process, a need is identified and a product is created to fill this need. While design and engineering of the final product is important, the tools and fixtures that aid in the creation of the final product are just as important, if not more so. Power supplies assembled at the TA-55 PF-5 have been designed by an excellent engineering team. The task in PF-5 now is to ensure that all steps of the assembly and manufacturing process can be completed safely, reliably, and in a quality repeatable manner. One of these process steps involves soldering fine wires to an electrical connector. During the process development phase, the method of soldering included placing the power supply in a vice in order to manipulate it into a position conducive to soldering. This method is unacceptable from a reliability, repeatability, and ergonomic standpoint. To combat these issues, a fixture was designed to replace the current method. To do so, a twelve step engineering design process was used to create the fixture that would provide a solution to a multitude of problems, and increase the safety and efficiency of production.

  4. Anomalous resistivity effect on multiple ion beam emission and hard x-ray generation in a Mather type plasma focus device

    SciTech Connect (OSTI)

    Behbahani, R. A.; Aghamir, F. M.

    2011-10-15

    Multi ion beam and hard x-ray emissions were detected in a high inductance (more than 100 nH) Mather type plasma focus (PF) device at different filling gas pressures and charging voltages. The signal analysis was performed through the current trace, as it is the fundamental signal from which all of the phenomena in a PF device can be extracted. Two different fitting processes were carried out according to Lee's computational (snow-plow) model. In the first process, only plasma dynamics and classical (Spitzer) resistances were considered as energy consumer parameters for plasma. This led to an unsuccessful fitting and did not answer the energy transfer mechanism into plasma. A second fitting process was considered through the addition of anomalous resistance, which provided the best fit. Anomalous resistance was the source of long decrease in current trace, and multi dips and multi peaks of high voltage probe. Multi-peak features were interpreted considering the second fitting process along with the mechanisms for ion beam production and hard x-ray emission. To show the important role of the anomalous resistance, the duration of the current drop was discussed.

  5. Synthesis and Characterization of Lithium Bis(fluoromalonato)borate (LiBFMB) for Lithium Ion Battery Applications

    SciTech Connect (OSTI)

    Liao, Chen; Han, Kee Sung; Baggetto, Loic; Hillesheim, Daniel A; Custelcean, Radu; Lee, Dr. Eun-Sung; Guo, Bingkun; Bi, Zhonghe; Jiang, Deen; Veith, Gabriel M; Hagaman, Edward {Ed} W; Brown, Gilbert M; Bridges, Craig A; Paranthaman, Mariappan Parans; Manthiram, Arumugam; Dai, Sheng; Sun, Xiao-Guang

    2014-01-01

    A new orthochelated salt, lithium bis(monofluoromalonato)borate (LiBFMB), has been synthesized and purified for the first time for application in lithium ion batteries. The presence of fluorine in the borate anion of LiBFMB increases its oxidation potential and also facilitates ion dissociation, as reflected by the ratio of ionic conductivity measured by electrochemical impedance spectroscopy ( exp) and that by ion diffusivity coefficients obtained using pulsed field gradient nuclear magnetic resonance (PFG-NMR) technique ( NMR). Half-cell tests using 5.0 V lithium nickel manganese oxide (LiNi0.5Mn1.5O4) as a cathode and EC/DMC/DEC as a solvent reveals that the impedance of the LiBFMB cell is much larger than those of LiPF6 and LiBOB based cells, which results in lower capacity and poor cycling performance of the former. XPS spectra of the cycled cathode electrode suggest that because of the stability of the LiBFMB salt, the solid electrolyte interphase (SEI) formed on the cathode surface is significantly different from those of LiPF6 and LiBOB based electrolytes, resulting in more solvent decomposition and thicker SEI layer. Initial results also indicate that using high dielectric constant solvent PC alters the surface chemistry, reduces the interfacial impedance, and enhances the performance of LiBFMB based 5.0V cell.

  6. gamma-ray spectroscopy of neutron-rich {sup 40}S

    SciTech Connect (OSTI)

    Wang, Z. M.; Chapman, R.; Liang, X.; Burns, M.; Hodsdon, A.; Keyes, K.; Kumar, V.; Papenberg, A.; Smith, J. F.; Spohr, K. M.; Haas, F.; Caurier, E.; Curien, D.; Nowacki, F.; Azaiez, F.; Ibrahim, F.; Verney, D.; Behera, B. R.; Corradi, L.; Fioretto, E.

    2010-05-15

    Yrast states up to (6{sup +}) in the neutron-rich {sup 40}S nucleus have been studied using binary grazing reactions produced by the interaction of a 215 MeV beam of {sup 36}S ions with a thin {sup 208}Pb target. The novel experimental setup that combines the large acceptance magnetic spectrometer, PRISMA, and the high-efficiency gamma-ray detection array, CLARA, was used. A new gamma-ray transition at an energy of 1572 keV was observed and tentatively assigned to the (6{sup +})->(4{sup +}) transition. A comparison of experimental observations and the results of large-scale 0(Planck constant/2pi)omega sd-pf shell-model calculations indicates that one- and two-proton excitations from the 2s{sub 1/2} to the 1d{sub 3/2} orbitals play an important role in reproducing the {sup 40}S yrast level structure and the published B(E2;0{sub g.s.}{sup +}->2{sub 1}{sup +}) value. The structure of the yrast states of the even-A isotopes of sulfur is interpreted in terms of the configurations of valence protons and neutrons within the context of large-scale 0(Planck constant/2pi)omega sd-pf shell-model calculations.

  7. Current sheath formation dynamics and structure for different insulator lengths of plasma focus device

    SciTech Connect (OSTI)

    Seng, Y. S.; Lee, P.; Rawat, R. S.

    2014-11-15

    The breakdown phase of the UNU-ICTP plasma focus (PF) device was successfully simulated using the electromagnetic particle in cell method. A clear uplift of the current sheath (CS) layer was observed near the insulator surface, accompanied with an exponential increase in the plasma density. Both phenomena were found to coincide with the surge in the electric current, which is indicative of voltage breakdown. Simulations performed on the device with different insulator lengths showed an increase in the fast ionization wave velocity with length. The voltage breakdown time was found to scale linearly with the insulator length. Different spatial profiles of the CS electron density, and the associated degree of uniformity, were found to vary with different insulator lengths. The ordering, according to the degree of uniformity, among insulator lengths of 19, 22, and 26?mm agreed with that in terms of soft X-ray radiation yield observed from experiments. This suggests a direct correlation between CS density homogeneity near breakdown and the radiation yield performance. These studies were performed with a linearly increasing voltage time profile as input to the PF device.

  8. Significant enhancement in thermoelectric properties of polycrystalline Pr-doped SrTiO{sub 3??} ceramics originating from nonuniform distribution of Pr dopants

    SciTech Connect (OSTI)

    Dehkordi, Arash Mehdizadeh; Bhattacharya, Sriparna; He, Jian; Alshareef, Husam N.; Tritt, Terry M.

    2014-05-12

    Recently, we have reported a significant enhancement (>70% at 500?C) in the thermoelectric power factor (PF) of bulk polycrystalline Pr-doped SrTiO{sub 3} ceramics employing a novel synthesis strategy which led to the highest ever reported values of PF among doped polycrystalline SrTiO{sub 3}. It was found that the formation of Pr-rich grain boundary regions gives rise to an enhancement in carrier mobility. In this Letter, we investigate the electronic and thermal transport in Sr{sub 1?x}Pr{sub x}TiO{sub 3} ceramics in order to determine the optimum doping concentration and to evaluate the overall thermoelectric performance. Simultaneous enhancement in the thermoelectric power factor and reduction in thermal conductivity in these samples resulted in more than 30% improvement in the dimensionless thermoelectric figure of merit (ZT) for the whole temperature range over all previously reported maximum values. Maximum ZT value of 0.35 was obtained at 500?C.

  9. Combined propellant for pulse MHD generator

    SciTech Connect (OSTI)

    Dogadayev, R.V.; Dyogtev, Yu.G.; Gomozov, V.A.; Klyachko, L.A.

    1994-12-31

    The results of the experimental researches and calculations of the pulse MHD generator equilibrium plasma which is the products of the solid pyrotechnical (metal) fuel (PF) combustion in the air (combined propellant - CP) are presented. The optimum fuel composition and the excess air factor have been determined. The magnesium- and aluminium-based PF experimental samples have been calculated, manufactured and tested. The conception has been suggested, the model plasma generator has been designed and manufactured. The dependencies of pressure, temperature, heat losses, electrical conductivity and electron mobility and their pulsations in the small-scale MHD generator channel (m{approx}1.5 kg/s, M{approx}3, p{approx}0.07MPa, T{approx}2800K) upon different factors have been determined experimentally. Under these conditions the electrical conductivity reached 25 S/m. The solid MgO particles spectrum in the supersonic flow has been determined. The MHD conversion with the use of the CP has been demonstrated. The maximum electrical power of the {open_quotes}Pamir-0-KT{close_quotes} small-scale MHD generator was 68 kW with the magnetic field 1.9 T.

  10. Transport of triplet excitons along continuous 100 nm polyfluorene chains

    SciTech Connect (OSTI)

    Xi, Liang; Bird, Matthew; Mauro, Gina; Asaoka, Sadayuki; Cook, Andrew R.; Chen, Hung -Cheng; Miller, John R.

    2014-12-03

    Triplet excitons created in poly-2,7-(9,9-dihexyl)fluorene (pF) chains with end trap groups in solution are efficiently transported to and captured by the end groups. The triplets explore the entire lengths of the chains, even for ~100 nm long chains enabling determination of the completeness of end capping. The results show that the chains continuous: they may contain transient barriers or traps, such as those from fluctuations of dihedral angles, but are free of major defects that stop motion of the triplets. Quantitative determinations are aided by the addition of a strong electron donor, TMPD, which removes absorption bands of the end-trapped triplets. For chains having at least one end trap, triplet capture is quantitative on the 1 s timescale imposed by the use of the donor. Fractions of chains having no end traps were 0.15 for pF samples with anthraquinone (AQ) end traps and 0.063 with naphthylimide (NI) end traps. These determinations agreed with measurements by NMR for short (<40 polymer repeat units (PRU)) chains, where NMR determinations are accurate. The results find no evidence for traps or barriers to transport of triplets, and places limits on the possible presence of defects as impenetrable barriers to less than one per 300 PRU. The present results present a paradigm different from the current consensus, derived from observations of singlet excitons, that conjugated chains are divided into segments, perhaps by some kind of defects. For the present pF chains, the segmentation either does not apply to triplet excitons or is transient so that the defects are healed or surmounted in times much shorter than 1 s. Triplets on chains without end trap groups transfer to chains with end traps on a slower time scale. Rate constants for these bimolecular triplet transfer reactions were found to increase with the length of the accepting chain, as did rate constants for triplet transfer to the chains from small molecules like biphenyl. As a result, a second set of polyfluorenes with 2-butyloctyl side chains was found to have a much lower completeness of end capping.

  11. Transport of triplet excitons along continuous 100 nm polyfluorene chains

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

    Xi, Liang; Bird, Matthew; Mauro, Gina; Asaoka, Sadayuki; Cook, Andrew R.; Chen, Hung -Cheng; Miller, John R.

    2014-12-03

    Triplet excitons created in poly-2,7-(9,9-dihexyl)fluorene (pF) chains with end trap groups in solution are efficiently transported to and captured by the end groups. The triplets explore the entire lengths of the chains, even for ~100 nm long chains enabling determination of the completeness of end capping. The results show that the chains continuous: they may contain transient barriers or traps, such as those from fluctuations of dihedral angles, but are free of major defects that stop motion of the triplets. Quantitative determinations are aided by the addition of a strong electron donor, TMPD, which removes absorption bands of the end-trappedmore » triplets. For chains having at least one end trap, triplet capture is quantitative on the 1 µs timescale imposed by the use of the donor. Fractions of chains having no end traps were 0.15 for pF samples with anthraquinone (AQ) end traps and 0.063 with naphthylimide (NI) end traps. These determinations agreed with measurements by NMR for short (<40 polymer repeat units (PRU)) chains, where NMR determinations are accurate. The results find no evidence for traps or barriers to transport of triplets, and places limits on the possible presence of defects as impenetrable barriers to less than one per 300 PRU. The present results present a paradigm different from the current consensus, derived from observations of singlet excitons, that conjugated chains are divided into “segments,” perhaps by some kind of defects. For the present pF chains, the segmentation either does not apply to triplet excitons or is transient so that the defects are healed or surmounted in times much shorter than 1 µs. Triplets on chains without end trap groups transfer to chains with end traps on a slower time scale. Rate constants for these bimolecular triplet transfer reactions were found to increase with the length of the accepting chain, as did rate constants for triplet transfer to the chains from small molecules like biphenyl. As a result, a second set of polyfluorenes with 2-butyloctyl side chains was found to have a much lower completeness of end capping.« less

  12. Synthesis and crystal structure of a novel mixed valence iron compound, ((/eta//sup 5/-cyclopentadienyl)(/eta//sup 6/-tetralin)Fe(II))/sub 3/(Fe(III)(NCS)/sub 6/)

    SciTech Connect (OSTI)

    Coleman, A.W.; Baskar, A.J.; Bott, S.G.; Atwood, J.L.

    1988-08-01

    The title compound was encountered in the course of preparing ((/eta//sup 5/-C/sub 5/H/sub 5/)(/eta//sup 6/-C/sub 10/H/sub 12/)Fe)SCN from ((/eta//sup 5/-C/sub 5/H/sub 5/)(/eta//sup 6/-C/sub 10/H/sub 12/)Fe)PF/sub 6/. The mixed valence iron compound crystallizes in the monoclinic space group P2/sub 1//c with four formula unite per unit cell. There are three crystallographically independent cations and two anions (each residing on a center of inversion) in the asymmetric unit. Lattice constants are a = 17.231(7), b = 18.167(6), c = 16.572(7) /angstrom/, and /beta/ = 97.86(4)/degree/. 23 references, 1 figure, 4 tables.

  13. Re-appraisal and extension of the Gratton-Vargas two-dimensional analytical snowplow model of plasma focus evolution in the context of contemporary research

    SciTech Connect (OSTI)

    Auluck, S. K. H.

    2013-11-15

    Recent resurgence of interest in applications of dense plasma focus and doubts about the conventional view of dense plasma focus as a purely irrotational compressive flow have re-opened questions concerning device optimization. In this context, this paper re-appraises and extends the analytical snowplow model of plasma focus sheath evolution developed by F. Gratton and J. M. Vargas [Energy Storage, Compression and Switching, edited by V. Nardi, H. Sahlin, and W. H. Bostick (Plenum, New York, 1983), Vol. 2, p. 353)] and shows its relevance to contemporary research. The Gratton-Vargas (GV) model enables construction of a special orthogonal coordinate system in which the plasma flow problem can be simplified and a model of sheath structure can be formulated. The Lawrenceville Plasma Physics (LPP) plasma focus facility, which reports neutron yield better than global scaling law, is shown to be operating closer to an optimum operating point of the GV model as compared with PF-1000.

  14. UF{sub 6} tiedowns for truck transport - right way/wrong way

    SciTech Connect (OSTI)

    Stout, F.W. Jr.

    1991-12-31

    Tiedown systems for truck transport of UF{sub 6} must be defined and controlled to assure the least risk for hauling the material over the highways. This paper and an associated poster display will present the current status of regulatory criteria for tiedowns, analyze the structural stresses involved in tiedowns for two major UF{sub 6} packaging systems, the 21PF series of overpacks and the 48 in. diameter shipping cylinders, and will present photographs showing some {open_quote}right ways{close_quotes} and some {open_quotes}wrong (or risky) ways{close_quotes} currently used for tiedown systems. Risky tiedown methods must be replaced with safer less risky methods to insure the safe transport of UF{sub 6}.

  15. NMR studies of chiral P,S-chelate platinum, rhodium, and iridium complexes and the X-ray structure of a palladium(II) allyl derivative

    SciTech Connect (OSTI)

    Albinati, A. [Univ. of Milan (Italy)] [Univ. of Milan (Italy); Eckert, J. [Los Alamos National Lab., NM (United States)] [Los Alamos National Lab., NM (United States); Pregosin, P.; Ruegger, H.; Salzmann, R.; Stoessel, C. [ETH-Zentrum, Zuerich (Switzerland)] [ETH-Zentrum, Zuerich (Switzerland)

    1997-02-18

    Several Rh(I), Ir(III), and Pt(II) complexes of the chiral P,S-bidentate ligand 2 have been prepared and characterized. Detailed two-dimensional NMR studies show that (i) the boat-type chelate ring and the stereogenic sulfur center can invert rapidly at ambient temperature and (ii) the sulfur donor may dissociate, essentially destroying the chiral pocket. The solid-state structure of [Pt({eta}{sup 3}-C{sub 3}H{sub 5})(2)]PF{sub 6} (3) has been determined and the sulfur substituent shown to have an axial orientation. The six-membered chelate ring takes up a boat-like conformation. As shown by an X-ray diffraction study for 3, and via incoherent inelastic neutron scattering (IINS) measurements for the Pd analog, 4, the OH group is remote from the metal atom. 42 refs., 11 figs., 6 tabs.

  16. Verification Of The Defense Waste Processing Facility's (DWPF) Process Digestion Methods For The Sludge Batch 8 Qualification Sample

    SciTech Connect (OSTI)

    Click, D. R.; Edwards, T. B.; Wiedenman, B. J.; Brown, L. W.

    2013-03-18

    This report contains the results and comparison of data generated from inductively coupled plasma atomic emission spectroscopy (ICP-AES) analysis of Aqua Regia (AR), Sodium Peroxide/Sodium Hydroxide Fusion Dissolution (PF) and Cold Chem (CC) method digestions and Cold Vapor Atomic Absorption analysis of Hg digestions from the DWPF Hg digestion method of Sludge Batch 8 (SB8) Sludge Receipt and Adjustment Tank (SRAT) Receipt and SB8 SRAT Product samples. The SB8 SRAT Receipt and SB8 SRAT Product samples were prepared in the SRNL Shielded Cells, and the SRAT Receipt material is representative of the sludge that constitutes the SB8 Batch or qualification composition. This is the sludge in Tank 51 that is to be transferred into Tank 40, which will contain the heel of Sludge Batch 7b (SB7b), to form the SB8 Blend composition.

  17. Structural Interactions within Lithium Salt Solvates: Acyclic Carbonates and Esters

    SciTech Connect (OSTI)

    Afroz, Taliman; Seo, D. M.; Han, Sang D.; Boyle, Paul D.; Henderson, Wesley A.

    2015-03-06

    Solvate crystal structures serve as useful models for the molecular-level interactions within the diverse solvates present in liquid electrolytes. Although acyclic carbonate solvents are widely used for Li-ion battery electrolytes, only three solvate crystal structures with lithium salts are known for these and related solvents. The present work, therefore, reports six lithium salt solvate structures with dimethyl and diethyl carbonate: (DMC)2:LiPF6, (DMC)1:LiCF3SO3, (DMC)1/4:LiBF4, (DEC)2:LiClO4, (DEC)1:LiClO4 and (DEC)1:LiCF3SO3 and four with the structurally related methyl and ethyl acetate: (MA)2:LiClO4, (MA)1:LiBF4, (EA)1:LiClO4 and (EA)1:LiBF4.

  18. Polymer filtration: A new technology for selective metals recovery

    SciTech Connect (OSTI)

    Smith, B.F.; Robison, T.W.; Cournoyer, M.E.; Wilson, K.V.; Sauer, N.N.; Mullen, K.I.; Lu, M.T.; Jarvinen, J.J.

    1995-04-01

    Polymer Filtration (PF) was evaluated for the recovery of electroplating metal ions (zinc and nickel) from rinse waters. Polymer Filtration combines the use of water-soluble metal-binding polymers and ultrafiltration to concentrate metal ions from dilute rinse water solutions. The metal ions are retained by the polymers; the smaller, unbound species freely pass through the ultrafiltration membrane. By using this process the ultrafiltered permeate more than meets EPA discharge limits. The metal ions are recovered from the concentrated polymer solution by pH adjustment using diafiltration and can be recycled to the original electroplating baths with no deleterious effects on the test panels. Metal-ion recovery is accomplished without producing sludge.

  19. Influence of a Weak Field of Pulsed DC Electricity on the Behavior and Incidence of Injury in Adult Steelhead and Pacific Lamprey, Final Report.

    SciTech Connect (OSTI)

    Mesa, Matthew

    2009-02-13

    Predation by pinnipeds, such as California sea lions Zalophus californianus, Pacific harbor seals Phoca vitulina, and Stellar sea lions Eumetopias jubatus on adult Pacific salmon Oncorhynchus spp in the lower Columbia River has become a serious concern for fishery managers trying to conserve and restore runs of threatened and endangered fish. As a result, Smith-Root, Incorporated (SRI; Vancouver, Washington), manufacturers of electrofishing and closely-related equipment, proposed a project to evaluate the potential of an electrical barrier to deter marine mammals and reduce the amount of predation on adult salmonids (SRI 2007). The objectives of their work were to develop, deploy, and evaluate a passive, integrated sonar and electric barrier that would selectively inhibit the upstream movements of marine mammals and reduce predation, but would not injure pinnipeds or impact anadromous fish migrations. However, before such a device could be deployed in the field, concerns by regional fishery managers about the potential effects of such a device on the migratory behavior of Pacific salmon, steelhead O. mykiss, Pacific lampreys Entoshpenus tridentata, and white sturgeon Acipenser transmontanus, needed to be addressed. In this report, we describe the results of laboratory research designed to evaluate the effects of prototype electric barriers on adult steelhead and Pacific lampreys. The effects of electricity on fish have been widely studied and include injury or death (e.g., Sharber and Carothers 1988; Dwyer et al. 2001; Snyder 2003), physiological dysfunction (e.g., Schreck et al. 1976; Mesa and Schreck 1989), and altered behavior (Mesa and Schreck 1989). Much of this work was done to investigate the effects of electrofishing on fish in the wild. Because electrofishing operations would always use more severe electrical settings than those proposed for the pinniped barrier, results from these studies are probably not relevant to the work proposed by SRI. Field electrofishing operations typically use high voltage and amperage settings and a variety of waveforms, pulse widths (PW), and pulse frequencies (PF), depending on conditions and target species. For example, when backpack electrofishing for trout in a small stream, one might use settings such as 500 V pulsed DC, a PW of 1 ms, and a PF of 60 Hz. In contrast, the electrical barrier proposed by SRI will produce electrical conditions significantly lower than those used in electrofishing, particularly for PW and PF (e.g., PW ranging from 300-1,000 {micro}s and PF from 2-3 Hz). Further, voltage gradients (in V/cm) are predicted to be lower in the electric barrier than those produced during typical electrofishing. Although the relatively weak, pulsed DC electric fields to be produced by the barrier may be effective at deterring pinnipeds, little, if anything, is known about the effects of such low intensity electrical fields on fish behavior. For this research, we evaluated the effects of weak, pulsed DC electric currents on the behavior of adult steelhead and Pacific lamprey and the incidence of injury in steelhead only. In a series of laboratory experiments, we: (1) documented the rate of passage of fish over miniature, prototype electric barriers when they were on and off; (2) determined some electric thresholds beyond which fish would not pass over the barrier; and (3) assessed the incidence and severity of injury in steelhead exposed to relatively severe electrical conditions. The results of this study should be useful for making decisions about whether to install electrical barriers in the lower Columbia River, or elsewhere, to reduce predation on upstream migrating salmonids and other fishes by marine pinnipeds.

  20. Business Case Analysis of Prototype Fabrication Division Recapitalization PlanSummary

    SciTech Connect (OSTI)

    Booth, Steven Richard; Benson, Faith Ann; Dinehart, Timothy Grant

    2015-04-30

    Business case studies were completed to support procurement of new machines and capital equipment in the Prototype Fabrication (PF) Division SM-39 and TA-03-0102 machine shops. Economic analysis was conducted for replacing the Mazak 30Y Mill-Turn Machine in SM-39, the Haas Vertical CNC Mill in Building 102, and the Hardinge Q10/65-SP Lathe in SM-39. Analysis was also conducted for adding a NanoTech Lathe in Building 102 and a new electrical discharge machine (EDM) in SM-39 to augment current capabilities. To determine the value of switching machinery, a baseline scenario was compared with a future scenario where new machinery was purchased and installed. Costs and benefits were defined via interviews with subject matter experts.

  1. Advanced Photovoltaic Inverter Functionality using 500 kW Power Hardware-in-Loop Complete System Laboratory Testing: Preprint

    SciTech Connect (OSTI)

    Mather, B. A.; Kromer, M. A.; Casey, L.

    2013-01-01

    With the increasing penetration of distribution connected photovoltaic (PV) systems, more and more PV developers and utilities are interested in easing future PV interconnection concerns by mitigating some of the impacts of PV integration using advanced PV inverter controls and functions. This paper describes the testing of a 500 kW PV inverter using Power Hardware-in-Loop (PHIL) testing techniques. The test setup is described and the results from testing the inverter in advanced functionality modes, not commonly used in currently interconnected PV systems, are presented. PV inverter operation under PHIL evaluation that emulated both the DC PV array connection and the AC distribution level grid connection are shown for constant power factor (PF) and constant reactive power (VAr) control modes. The evaluation of these modes was completed under varying degrees of modeled PV variability.

  2. Lithium ion battery with improved safety

    DOE Patents [OSTI]

    Chen, Chun-hua; Hyung, Yoo Eup; Vissers, Donald R.; Amine, Khalil

    2006-04-11

    A lithium battery with improved safety that utilizes one or more additives in the battery electrolyte solution wherein a lithium salt is dissolved in an organic solvent, which may contain propylene, carbonate. For example, a blend of 2 wt % triphenyl phosphate (TPP), 1 wt % diphenyl monobutyl phosphate (DMP) and 2 wt % vinyl ethylene carbonate additives has been found to significantly enhance the safety and performance of Li-ion batteries using a LiPF6 salt in EC/DEC electrolyte solvent. The invention relates to both the use of individual additives and to blends of additives such as that shown in the above example at concentrations of 1 to 4-wt % in the lithium battery electrolyte. This invention relates to additives that suppress gas evolution in the cell, passivate graphite electrode and protect it from exfoliating in the presence of propylene carbonate solvents in the electrolyte, and retard flames in the lithium batteries.

  3. Radiofrequency attenuator and method

    DOE Patents [OSTI]

    Warner, Benjamin P. (Los Alamos, NM); McCleskey, T. Mark (Los Alamos, NM); Burrell, Anthony K. (Los Alamos, NM); Agrawal, Anoop (Tucson, AZ); Hall, Simon B. (Palmerston North, NZ)

    2009-01-20

    Radiofrequency attenuator and method. The attenuator includes a pair of transparent windows. A chamber between the windows is filled with molten salt. Preferred molten salts include quarternary ammonium cations and fluorine-containing anions such as tetrafluoroborate (BF.sub.4.sup.-), hexafluorophosphate (PF.sub.6.sup.-), hexafluoroarsenate (AsF.sub.6.sup.-), trifluoromethylsulfonate (CF.sub.3SO.sub.3.sup.-), bis(trifluoromethylsulfonyl)imide ((CF.sub.3SO.sub.2).sub.2N.sup.-), bis(perfluoroethylsulfonyl)imide ((CF.sub.3CF.sub.2SO.sub.2).sub.2N.sup.-) and tris(trifluoromethylsulfonyl)methide ((CF.sub.3SO.sub.2).sub.3C.sup.-). Radicals or radical cations may be added to or electrochemically generated in the molten salt to enhance the RF attenuation.

  4. Scales in the fine structure of the magnetic dipole resonance: A wavelet approach to the shell model

    SciTech Connect (OSTI)

    Petermann, I.; Langanke, K.; Martinez-Pinedo, G.; Neumann-Cosel, P. von; Nowacki, F.; Richter, A.

    2010-01-15

    Wavelet analysis is applied as a tool for the examination of magnetic dipole (M1) strength distributions in pf-shell nuclei by the extraction of wavelet scales. Results from the analysis of theoretical M1 strength distributions calculated with the KB3G interaction are compared to experimental data from (e,e{sup '}) experiments and good agreement of the deduced wavelet scales is observed. This provides further insight into the nature of the scales from the model results. The influence of the number of Lanczos iterations on the development and stability of scales and the role of the model space in terms of the truncation level are studied. Moreover, differences in the scales of spin and orbital parts of the M1 strength are investigated, as is the use of different effective interactions (KB3G, GXPF1, and FPD6).

  5. FACT SHEET U.S. Department of Energy ARM Mobile Facility

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

    t a * r - m * - HarmI cf r * f f - -* f * * - s - g pf -*L n sf af * L - t f w * - p L f * arm a f f f L - - - * * - * f - * - f f* i- -L arm m f f f * HamfI f -* - f * - - * - * f * - R - *L - - - - - L f f * * t * f f L amf L * * f - RPP * - f L amfRL * * f * * f - - o RP P c -* * - * f f * f *L * f - * -* - *L - -*L - * * *L amf * * f -* a- - * f f * * f * - -* - * amf - f * - f f - - fM b * * f - f L amf * - f f - - ff * - - f s - - - * * f f ff f -- - *L - * * * f f f f -M* f * ff - * - * *

  6. GSW2015_MASTER-current-2.pptx

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

    Getting Started at the ALCF 1 Agenda ¤ Part I ¥ Blue Gene/Q hardware overview ¥ Building your code ¥ Considerations before you run ¥ Hands-on session ¤ Part II ¥ Queuing and running ¥ After your job is submitted ¥ Potential problems ¥ Hands-on session 2 Part I 3 Section: Blue Gene/Q hardware overview 4 ALCF resources ¤ Mira (Production) - IBM Blue Gene/Q ¥ 49,152 nodes / 786,432 cores ¥ 768 TB of memory ¥ Peak flop rate: 10 PF ¥ Linpack

  7. TPX: Contractor preliminary design review. Volume 5, Manufacturing R&D

    SciTech Connect (OSTI)

    Roach, J.F.; Urban, W.M.; Hartman, D.

    1995-08-04

    TPX Insulation & Impregnation R&D test results are reported for 1x2 samples designed for screening candidate conduit insulation systems for TPX PF and TF coils. The epoxy/glass insulation system and three proposed alternate insulation systems employing Kapton, was evaluated in as received sample condition and after 10 thermal cycles in liquid nitrogen. Two DGBA impregnation systems, Shell 826 and CTD101K were investigated. Square incoloy 908 and 316 LN stainless hollow conduits were used for 1x2 sample fabrication. Capacitance, dielectric loss, and insulation resistance dielectric characteristics were measured for all samples. Partial discharge performance was measured for samples either in air, under silicon oil, or under liquid nitrogen up to 10kVrms at 60 Hz. Hipot screening was performed at 10 kVdc. The samples were cross sectioned and evaluated for impregnation quality. The implications of the test results on the TPX preliminary design decision are discussed.

  8. On the explanation and calculation of anomalous reflood hydrodynamics in large PWR cores

    SciTech Connect (OSTI)

    Rodriguez, S.E.

    1985-01-01

    Reflood hydrodynamics from large-scale (1:20) test facilities in Japan have yielded apparently anomalous behavior relative to FLECHT tests. Namely, even at reflooding rates below one inch per second, very large liquid volume fractions (10-15%) exist above the quench fronts shortly after flood begins; thus cladding temperature excursions are terminated early in the reflood phase. This paper discusses an explanation for this behavior: liquid films on the core's unheated rods. The experimental findings are shown to be correctly simulated with a new four-field (vapor, films, droplets) version of the best-estimate TRAC-PF1 computer code, TRAC-FF. These experimental and analytical findings have important implications for PWR large-break LOCA licensing.

  9. Center for Inverse Design Highlight: Enabling Practical p-Type Doping in Oxide Spinels

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

    Practical p-Type Doping in Oxide Spinels The Center for Inverse Design has identified a class of metal oxide spinels-typified by Co 2 ZnO 4 -that have no intrinsic hole-killers and hence enable unopposed p-type doping in easily grown materials. Reference: J.D. Perkins, T.R. Paudel, A. Zakutayev, P.F. Ndione, P.A. Parilla, D.L. Young, S. Lany, D.S. Ginley, A. Zunger, N.H. Perry, Y. Tang, M. Grayson, T.O. Mason, J.S. Bettinger, Y. Z. Shi, and M.F. Toney, Phys. Rev. B, 10.1103/PhysRevB.84.205207

  10. Radiofrequency attenuator and method

    DOE Patents [OSTI]

    Warner, Benjamin P. (Los Alamos, NM); McCleskey, T. Mark (Los Alamos, NM); Burrell, Anthony K. (Los Alamos, NM); Agrawal, Anoop (Tucson, AZ); Hall, Simon B. (Palmerston North, NZ)

    2009-11-10

    Radiofrequency attenuator and method. The attenuator includes a pair of transparent windows. A chamber between the windows is filled with molten salt. Preferred molten salts include quarternary ammonium cations and fluorine-containing anions such as tetrafluoroborate (BF.sub.4.sup.-), hexafluorophosphate (PF.sub.6.sup.-), hexafluoroarsenate (AsF.sub.6.sup.-), trifluoromethylsulfonate (CF.sub.3SO.sub.3.sup.-), bis(trifluoromethylsulfonyl)imide ((CF.sub.3SO.sub.2).sub.2N.sup.-), bis(perfluoroethylsulfonyl)imide ((CF.sub.3CF.sub.2SO.sub.2).sub.2N.sup.-) and tris(trifluoromethylsulfonyl)methide ((CF.sub.3SO.sub.2).sub.3 C.sup.-). Radicals or radical cations may be added to or electrochemically generated in the molten salt to enhance the RF attenuation.

  11. Magnetic field distribution in the plasma flow generated by a plasma focus discharge

    SciTech Connect (OSTI)

    Mitrofanov, K. N.; Krauz, V. I. Myalton, V. V.; Velikhov, E. P.; Vinogradov, V. P.; Vinogradova, Yu. V.

    2014-11-15

    The magnetic field in the plasma jet propagating from the plasma pinch region along the axis of the chamber in a megajoule PF-3 plasma focus facility is studied. The dynamics of plasma with a trapped magnetic flow is analyzed. The spatial sizes of the plasma jet region in which the magnetic field concentrates are determined in the radial and axial directions. The magnetic field configuration in the plasma jet is investigated: the radial distribution of the azimuthal component of the magnetic field inside the jet is determined. It is shown that the magnetic induction vector at a given point in space can change its direction during the plasma flight. Conclusions regarding the symmetry of the plasma flow propagation relative to the chamber axis are drawn.

  12. Structural Interactions within Lithium Salt Solvates: Cyclic Carbonates and Esters

    SciTech Connect (OSTI)

    Seo, D. M.; Afroz, Taliman; Allen, Joshua L.; Boyle, Paul D.; Trulove, Paul C.; De Long, Hugh C.; Henderson, Wesley A.

    2014-11-13

    Only limited information is available regarding the manner in which cyclic carbonate and ester solvents coordinate Li+ cations in electrolyte solutions for lithium batteries. One approach to gleaning significant insight into these interactions is to examine crystalline solvate structures. To this end, eight new solvate structures are reported with ethylene carbonate, ?-butyrolactone and ?-valerolactone: (EC)3:LiClO4, (EC)2:LiClO4, (EC)2:LiBF4, (GBL)4:LiPF6, (GBL)1:LiClO4, (GVL)1:LiClO4, (GBL)1:LiBF4 and (GBL)1:LiCF3SO3. The crystal structure of (EC)1:LiCF3SO3 is also re-reported for comparison. These structures enable the factors which govern the manner in which the ions are coordinated and the ion/solvent packingin the solid-stateto be scrutinized in detail.

  13. AIN MAXL

    Office of Legacy Management (LM)

    - ----.-..-. ..- -.__-..-__ -- ._... ----_ ._ _..._ .____.. _. . ' 1 AIN MAXL c 8. I 4 r' l k- 7 : $-' :;y";:-i::. .: I ;,y. I ' . .i c. L. B[arl, &mm Markagm3?, Fernrld Arm Cinotnaati, Ohio NOVEMBER 2 0 ?$#@ F. W. B~EIOPO, Uireetor, Produution Ditirkon, H6r Yark Operationa Offioa mxi n&i BOL1XBE) - 8TyOHl38 wudr fmmf, axPAW SIfkBQL I m t#bmum); 4 PfP~ ' s" This 56 in rr+W8mti~ of a trluphona aonrurcurtian an &m13ber Zg betwese 8. 18. ~iObtif$on fUid ii. ii. HOtO 6oPl66ming

  14. RR UECX I DEUEetdJ16 T LEMON7 ILL =@I9 V

    Office of Legacy Management (LM)

    4 , RR UECX I DEUEetdJ16 T LEMON7 ILL =@I9 V : w ~?g+QZ FM USAEC NYK @5 TO USAEC LEMUMT Ill.. AEC WWC ; I _. _' FOR A TAMwsflO h@G NR tt0 PD Tti18~18~~10 APPROVE pf TWJNTY GRAM8 ENRICHED 1 '. , URANlUM TO 8YLyANI~q FOR W8E. IWTREPARIWG~F~VE U&AN,!UU SLUGS 7/.8 lF4j34 ' .' : ' . ~ , . LQ~JG m S/8 1%~ ~IAhiiilER pa THE-DIE WI& CW!. APOROX 300 DOLLARS Am " , SIX ~uN-~Y# WILL BE REQI!!REl! FW WJG FA~ICf' TlW PD ?eJJRCt+A= @ fmR woull] BE m OUT to 8YLVANIA AND WNT TO, V L PAf?SEGIAN Cy

  15. Quantum calculations of the IR spectrum of liquid water using ab initio and model potential and dipole moment surfaces and comparison with experiment

    SciTech Connect (OSTI)

    Liu, Hanchao; Wang, Yimin; Bowman, Joel M.

    2015-05-21

    The calculation and characterization of the IR spectrum of liquid water have remained a challenge for theory. In this paper, we address this challenge using a combination of ab initio approaches, namely, a quantum treatment of IR spectrum using the ab initio WHBB water potential energy surface and a refined ab initio dipole moment surface. The quantum treatment is based on the embedded local monomer method, in which the three intramolecular modes of each embedded H{sub 2}O monomer are fully coupled and also coupled singly to each of six intermolecular modes. The new dipole moment surface consists of a previous spectroscopically accurate 1-body dipole moment surface and a newly fitted ab initio intrinsic 2-body dipole moment. A detailed analysis of the new dipole moment surface in terms of the coordinate dependence of the effective atomic charges is done along with tests of it for the water dimer and prism hexamer double-harmonic spectra against direct ab initio calculations. The liquid configurations are taken from previous molecular dynamics calculations of Skinner and co-workers, using the TIP4P plus E3B rigid monomer water potential. The IR spectrum of water at 300 K in the range of 04000 cm{sup ?1} is calculated and compared with experiment, using the ab initio WHBB potential and new ab initio dipole moment, the q-TIP4P/F potential, which has a fixed-charged description of the dipole moment, and the TTM3-F potential and dipole moment surfaces. The newly calculated ab initio spectrum is in very good agreement with experiment throughout the above spectral range, both in band positions and intensities. This contrasts to results with the other potentials and dipole moments, especially the fixed-charge q-TIP4P/F model, which gives unrealistic intensities. The calculated ab initio spectrum is analyzed by examining the contribution of various transitions to each band.

  16. Current parallel I/O limitations to scalable data analysis.

    SciTech Connect (OSTI)

    Mascarenhas, Ajith Arthur; Pebay, Philippe Pierre

    2011-07-01

    This report describes the limitations to parallel scalability which we have encountered when applying our otherwise optimally scalable parallel statistical analysis tool kit to large data sets distributed across the parallel file system of the current premier DOE computational facility. This report describes our study to evaluate the effect of parallel I/O on the overall scalability of a parallel data analysis pipeline using our scalable parallel statistics tool kit [PTBM11]. In this goal, we tested it using the Jaguar-pf DOE/ORNL peta-scale platform on a large combustion simulation data under a variety of process counts and domain decompositions scenarios. In this report we have recalled the foundations of the parallel statistical analysis tool kit which we have designed and implemented, with the specific double intent of reproducing typical data analysis workflows, and achieving optimal design for scalable parallel implementations. We have briefly reviewed those earlier results and publications which allow us to conclude that we have achieved both goals. However, in this report we have further established that, when used in conjuction with a state-of-the-art parallel I/O system, as can be found on the premier DOE peta-scale platform, the scaling properties of the overall analysis pipeline comprising parallel data access routines degrade rapidly. This finding is problematic and must be addressed if peta-scale data analysis is to be made scalable, or even possible. In order to attempt to address these parallel I/O limitations, we will investigate the use the Adaptable IO System (ADIOS) [LZL+10] to improve I/O performance, while maintaining flexibility for a variety of IO options, such MPI IO, POSIX IO. This system is developed at ORNL and other collaborating institutions, and is being tested extensively on Jaguar-pf. Simulation code being developed on these systems will also use ADIOS to output the data thereby making it easier for other systems, such as ours, to process that data.

  17. Plutonium (III) and uranium (III) nitrile complexes

    SciTech Connect (OSTI)

    Enriquez, A. E.; Matonic, J. H.; Scott, B. L.; Neu, M. P.

    2002-01-01

    Iodine oxidation of uranium and plutonium metals in tetrahydrofuran and pyridine form AnI{sub 3}(THF){sub 4} and AnI{sub 3}(py){sub 4} (An = Pu, U). These compounds represent convenient entries Into solution An(III) chemistry in organic solvents. Extensions of the actinide metal oxidation methodology in nitrile solvents by I{sub 2}, AgPF{sub 6}, and TIPF{sub 6} are presented here. Treatment of Pu{sup 0} in acetonitrile with iodine yields a putative PuI{sub 3}(NCMe){sub x} intermediate which can be trapped with the tripodal nitrogen donor ligand tpza (tpza = (tris[(2-pyrazinyl)methyl]amine)) and forms the eight-coordinate complex (tpza)PuI{sub 3}(NCMe). Treatment of excess U{sup 0} metal by iodine in acetonitrile afforded a brown crystalline mixed valence complex, [U(NCMe){sub 9}][UI{sub 6}][I], instead of UI{sub 3}(NCMe){sub 4}. The analogous reaction in bezonitrile forms red crystalline UI{sub 4}(NCPh){sub 4}. In contrast, treatment of UI{sub 3}(THF){sub 4} with excess acetonitrile cleanly generates [U(NCMe){sub 9}][I]{sub 3}. Oxidation of Pu{sup 0} by either TI(I) or Ag(I) hexafluorophosphate salts generates a nine-coordinate homoleptic acetonitrile adduct [Pu(NCMe){sub 9}][PF{sub 6}]{sub 3}. Attempts to oxidize U{sub 0} with these salts were unsuccessful.

  18. MAR flow mapping of Analytical Chemistry Operations (Preliminary Report)

    SciTech Connect (OSTI)

    Barr, Mary E.; Farish, Thomas J.

    2012-06-13

    The recently released Supplemental Directive, NA-1 SD 1027, updates the radionuclide threshold values in DOE-STD-1027-92 CN1 to reflect the use of modern parameters for dose conversion factors and breathing rates. The directive also corrects several arithmetic errors within the original standard. The result is a roughly four-fold increase in the amount of weapons-grade nuclear material allowed within a designated radiological facility. Radiological laboratory space within the recently constructed Radiological Laboratory Office and Utility Building (RLUOB) is slated to house selected analytical chemistry support activities in addition to small-scale actinide R&D activities. RLUOB is within the same facility operations envelope as TA-55. Consolidation of analytical chemistry activities to RLUOB and PF-4 offers operational efficiency improvements relative to the current pre-CMRR plans of dividing these activities between RLUOB, PF-4, and CMR. RLUOB is considered a Radiological Facility under STD-1027 - 'Facilities that do not meet or exceed Category 3 threshold criteria but still possess some amount of radioactive material may be considered Radiological Facilities.' The supplemental directive essentially increases the allowable material-at-risk (MAR) within radiological facilities from 8.4 g to 38.6 g for {sup 239}Pu. This increase in allowable MAR provides a unique opportunity to establish additional analytical chemistry support functions in RLUOB without negatively impacting either R&D activities or facility operations. Individual radiological facilities are tasked to determine MAR limits (up to the Category 3 thresholds) appropriate to their operational conditions. This study presents parameters that impact establishing MAR limits for RLUOB and an assessment of how various analytical chemistry support functions could operate within the established MAR limits.

  19. Determining the exchange parameters of spin-1 metal-organic molecular magnets in pulsed magnetic fields

    SciTech Connect (OSTI)

    Mcdonald, Ross D; Singleton, John; Lancaster, Tom; Goddard, Paul; Manson, Jamie

    2011-01-14

    We nave measured the high-field magnetization of a number of Ni-based metal-organic molecular magnets. These materials are self-assembly coordination polymers formed from transition metal ions and organic ligands. The chemistry of the compounds is versatile allowing many structures with different magnetic properties to be formed. These studies follow on from previous measurements of the Cu-based analogues in which we showed it was possible to extract the exchange parameters of low-dimensional magnets using pulsed magnetic fields. In our recent experiments we have investigated the compound (Ni(HF{sub 2})(pyz){sub 2})PF{sub 6}, where pyz = pyrazine, and the Ni-ions are linked in a quasi-two-dimensional (Q2D) square lattice via the pyrazine molecules, with the layers held together by HF{sub 2} ligands. We also investigated Ni(NCS){sub 2}(pyzdo){sub 2}, where pyzdo = pyrazine dioxide. The samples are grown at Eastern Washington University using techniques described elsewhere. Measurements are performed at the pulsed magnetic field laboratory in Los Alamos. The magnetization of powdered samples is determined using a compensated coil magnetometer in a 65 T short pulse magnet. Temperatures as low as 500 mK are achievable using a {sup 3}He cryostat. The main figure shows the magnetization of the spin-1 [Ni(HF{sub 2})(pyz){sub 2}]PF{sub 6} compound at 1.43 K. The magnetization rises slowly at first, achieving a rounded saturation whose midpoint is around 19 T. A small anomaly is also seen in the susceptibility at low fields ({approx}3 T), which might be attributed to a spin-flop transition. In contrast, the spin-1/2 [Cu(HF{sub 2})(pyz){sub 2}]PF{sub 6} measured previously has a saturation magnetization of 35.5 T and a strongly concave form of M(B) below this field. This latter compound was shown to be a good example of a Q2D Heisenberg antiferromagnet with the strong exchange coupling (J{sub 2D} = 12.4 K, J{sub {perpendicular}}/J{sub 2D} {approx} 10{sup -2}) directed along the Cu-pyz-Cu directions. The structure of the two compounds is similar, but in the case of the Cu-compound the Cu-Cu pathways are linear, whereas in the Ni-compound they are kinked. The pulsed-field data combined with information from temperature-dependent susceptibility, muon-spin rotation, electron-spin resonance and ligand-field calculations suggest that, far from being magnetically Q2D, the Ni-compound is fairly one-dimensional with the dominant exchange (J{sub 1D} = 3.1 K and J{sub {perpendicular}}/J{sub 1D} = 0.63) directed along the Ni-FHF-Ni direction. Ni(NCS){sub 2}(pyzdo){sub 2} was also investigated. Previous ultra-high field measurements using the 100 T magnet have shown that this compound has a saturation field close to 80 T. The purpose of the present studies is to map out the phase diagram of this material at mid-range fields. The data are shown in the inset to the figure. This continuing project probes the ability of organic ligands to mediate magnetic exchange, the link between structure, dimensionality and bulk magnetic properties, as well as the role of spin number in quantum magnets. Ultimately the investigations aim to determine to what extent it is possible to produce self-assembly molecular materials with tailor-made magnetic characteristics.

  20. Polarizability effects on the structure and dynamics of ionic liquids

    SciTech Connect (OSTI)

    Cavalcante, Ary de Oliveira; Ribeiro, Mauro C. C.; Skaf, Munir S.

    2014-04-14

    Polarization effects on the structure and dynamics of ionic liquids are investigated using molecular dynamics simulations. Four different ionic liquids were simulated, formed by the anions Cl{sup ?} and PF{sub 6}{sup ?}, treated as single fixed charge sites, and the 1-n-alkyl-3-methylimidazolium cations (1-ethyl and 1-butyl-), which are polarizable. The partial charge fluctuation of the cations is provided by the electronegativity equalization model (EEM) and a complete parameter set for the cations electronegativity (?) and hardness (J) is presented. Results obtained from a non-polarizable model for the cations are also reported for comparison. Relative to the fixed charged model, the equilibrium structure of the first solvation shell around the imidazolium cations shows that inclusion of EEM polarization forces brings cations closer to each other and that anions are preferentially distributed above and below the plane of the imidazolium ring. The polarizable model yields faster translational and reorientational dynamics than the fixed charges model in the rotational-diffusion regime. In this sense, the polarizable model dynamics is in better agreement with the experimental data.

  1. Assessment of the Electrohol process to manufacture acetaldehyde from ethanol electrogeneratively. Final report

    SciTech Connect (OSTI)

    Trevino, A.A.

    1985-04-10

    Preliminary process economics data for the electrogenerative process to manufacture acetaldehyde from ethanol were generated based on patent information. The technology was assessed in four alternative processing options. The Electrohol process is viable in the US only if integrated to the production of 190 pf ethanol from corn in a large scale unit. To be competitive, the Electrohol process must show yields in excess of 93%. Its attractiveness depends on corn prices remaining under $2.90/bu and DDG selling for more than $132/T. A corn price of $2.00/bu is needed to make a farm-size corn-based processing alternative competitive. A plant based on the fermentation of molasses proved too expensive under the US economic assumptions. The Electrohol technology based on purchased ethanol cannot compete with the existing ethylene-based process under current conditions. To become attractive, the Electrohol process must have access to cheap ethanol ($1.43/gal). The zero electricity generation mode is the most attractive mode of operation for the Electrohol technology in the US. The penalty for low levels of generation (0.130 kwh/kg AcH) is, however, negligible. The optimum operating mode in W. Europe is the generation of 0.312 kwh/kg AcH. In Japan, the low generation level is perferred (0.130 kwh/kg AcH). In general, higher energy prices improve the competitiveness of the Electrohol processing alternatives.

  2. Crystallization and preliminary crystallographic analysis of orotidine 5?-monophosphate decarboxylase from the human malaria parasite Plasmodium falciparum

    SciTech Connect (OSTI)

    Krungkrai, Sudaratana R.; Tokuoka, Keiji; Kusakari, Yukiko; Inoue, Tsuyoshi; Adachi, Hiroaki; Matsumura, Hiroyoshi; Takano, Kazufumi; Murakami, Satoshi; Mori, Yusuke; Kai, Yasushi; Krungkrai, Jerapan; Horii, Toshihiro

    2006-06-01

    Orotidine 5?-monophosphate decarboxylase of human malaria parasite P. falciparum was crystallized by the seeding method in a hanging drop using PEG 3000 as a precipitant. A complete set of diffraction data from a native crystal was collected to 2.7 resolution at 100 K using synchrotron radiation. Orotidine 5?-monophosphate (OMP) decarboxylase (OMPDC; EC 4.1.1.23) catalyzes the final step in the de novo synthesis of uridine 5?-monophosphate (UMP) and defects in the enzyme are lethal in the malaria parasite Plasmodium falciparum. Active recombinant P. falciparum OMPDC (PfOMPDC) was crystallized by the seeding method in a hanging drop using PEG 3000 as a precipitant. A complete set of diffraction data from a native crystal was collected to 2.7 resolution at 100 K using synchrotron radiation at the Swiss Light Source. The crystal exhibits trigonal symmetry (space group R3), with hexagonal unit-cell parameters a = b = 201.81, c = 44.03 . With a dimer in the asymmetric unit, the solvent content is 46% (V{sub M} = 2.3 {sup 3} Da{sup ?1})

  3. Axial magnetic field and toroidally streaming fast ions in the dense plasma focus are natural consequences of conservation laws in the curved axisymmetric geometry of the current sheath

    SciTech Connect (OSTI)

    Auluck, S. K. H.

    2014-10-15

    Direct measurement of axial magnetic field in the PF-1000 dense plasma focus (DPF), and its reported correlation with neutron emission, call for a fresh look at previous reports of existence of axial magnetic field component in the DPF from other laboratories, and associated data suggesting toroidal directionality of fast ions participating in fusion reactions, with a view to understand the underlying physics. In this context, recent work dealing with application of the hyperbolic conservation law formalism to the DPF is extended in this paper to a curvilinear coordinate system, which reflects the shape of the DPF current sheath. Locally unidirectional shock propagation in this coordinate system enables construction of a system of 7 one-dimensional hyperbolic conservation law equations with geometric source terms, taking into account all the components of magnetic field and flow velocity. Rankine-Hugoniot jump conditions for this system lead to expressions for the axial magnetic field and three components of fluid velocity having high ion kinetic energy.

  4. Fluoroalkyl containing salts combined with fluorinated solvents for electrolytes

    DOE Patents [OSTI]

    Tikhonov, Konstantin; Yip, Ka Ki; Lin, Tzu-Yuan; Erickson, Michael Jason

    2015-04-21

    Provided are electrochemical cells and electrolytes used to build such cells. An electrolyte may include a fluoroalkyl-substituted LiPF.sub.6 salt or a fluoroalkyl-substituted LiBF.sub.4 salt. In some embodiments, at least one fluorinated alkyl of the salt has a chain length of from 1 to 8 or, more specifically, between about 2 and 8. These fluorinated alkyl groups, in particular, relatively large fluorinated alkyl groups improve solubility of these salts in fluorinated solvents that are less flammable than, for example, conventional carbonate solvents. At the same time, the size of fluoroalkyl-substituted salts should be limited to ensure adequate concentration of the salt in an electrolyte and low viscosity of the electrolyte. In some embodiments, the concentration of a fluoroalkyl-substituted salt is at least about 0.5M. Examples of fluorinated solvents include various fluorinated esters, fluorinated ethers, and fluorinated carbonates, such a 1-methoxyheptafluoropropane, methyl nonafluorobutyl ether, ethyl nonafluorobutyl ether, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-pentane, 3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-trifluoromethyl-hexane, and 1,1,1,2,3,3-hexafluoro-4-(1,1,2,3,3,3-hexafluoropropoxy)-pentane.

  5. Structure, Function and Inhibition of the Phosphoethanolamine Methyltransferases of the Human Malaria Parasites Plasmodium vivax and Plasmodium knowlesi

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

    Garg, Aprajita; Lukk, Tiit; Kumar, Vidya; Choi, Jae-Yeon; Augagneur, Yoann; Voelker, Dennis R.; Nair, Satish; Mamoun, Choukri Ben

    2015-03-12

    Phosphoethanolamine methyltransferases (PMTs) catalyze the three-step methylation of phosphoethanolamine to form phosphocholine, a critical step in the synthesis of phosphatidylcholine in a select number of eukaryotes including human malaria parasites, nematodes and plants. Genetic studies in the malaria parasite Plasmodium falciparum have shown that the methyltransferase PfPMT plays a critical function in parasite development and differentiation. The presence of PMT orthologs in other malaria parasites that infect humans and their absence in mammals make them ideal targets for the development of selective antimalarials with broad specificity against different Plasmodium species. Here we describe the X-ray structures and biochemical properties ofmore » PMT orthologs from Plasmodium vivax and Plasmodium knowlesi and show that both enzymes are inhibited by amodiaquine and NSC158011, two drugs with potent antimalarial activity. Metabolic studies in a yeast mutant that relies on PkPMT or PvPMT for survival demonstrated that these compounds inhibit phosphatidylcholine biosynthesis from ethanolamine. Our structural and functional data provide insights into the mechanism of catalysis and inhibition of PMT enzymes and set the stage for a better design of more specific and selective antimalarial drugs.« less

  6. Stability of the solid electrolyte Li{sub 3}OBr to common battery solvents

    SciTech Connect (OSTI)

    Schroeder, D.J.; Hubaud, A.A.; Vaughey, J.T.

    2014-01-01

    Graphical abstract: The stability of the anti-perovskite phase Li{sub 3}OBr has been assessed in a variety of battery solvents. - Highlights: Lithium stable solid electrolyte Li{sub 3}OBr unstable to polar organic solvents. Solvation with no dissolution destroys long-range structure. Ion exchange with protons observed. - Abstract: Recently a new class of solid lithium ion conductors was reported based on the anti-perovskite structure, notably Li{sub 3}OCl and Li{sub 3}OBr. For many beyond lithium-ion battery uses, the solid electrolyte is envisioned to be in direct contact with liquid electrolytes and lithium metal. In this study we evaluated the stability of the Li{sub 3}OBr phase against common battery solvents electrolytes, including diethylcarbonate (DEC) and dimethylcarbonate (DMC), as well as a LiPF{sub 6} containing commercial electrolyte. In contact with battery-grade organic solvents, Li{sub 3}OBr was typically found to be insoluble but lost its crystallinity and reacted with available protons and in some cases with the solvent. A low temperature heat treatment was able to restore crystallinity of the samples; however evidence of proton ion exchange was conserved.

  7. Self-assembly molecular squares with metal complexes as bridging ligands

    SciTech Connect (OSTI)

    Sun, S.S.; Silva, A.S.; Brinn, I.M.; Lees, A.J.

    2000-04-03

    Polynuclear transition metal complexes containing multichromophoric units, such as metal polypyridyl complexes, are of considerable current interest. Much attention has been paid to the synthesis of multicomponent systems that exhibit photoinduced intercomponent electron and/or energy-transfer processes and to their potential applications for photonic and electronic devices. Systems incorporating Re(I)- Ru(II)-, and Os(II)-based polypyridyl chromophores are the most commonly studied because of their favorable redox and spectroscopic characteristics. In this communication, the authors combine the concepts of self-assembly and complexes as ligands and report the preparation of a series of molecular squares with the general molecular formula [fac-Br(CO){sub 3}Re({mu}-(pyterpy){sub 2}M)]{sub 4}(PF{sub 6}){sub 8}, where pyterpy is 4{prime}-(4{prime}{double_prime}-pyridyl)-2,2{prime}:6{prime}2{double_prime}-terpyridine and M = Fe, Ru, or Os. The spectroscopic properties and a preliminary anion binding study of these novel octanuclear molecular squares are also presented.

  8. Review of Wind Energy Forecasting Methods for Modeling Ramping Events

    SciTech Connect (OSTI)

    Wharton, S; Lundquist, J K; Marjanovic, N; Williams, J L; Rhodes, M; Chow, T K; Maxwell, R

    2011-03-28

    Tall onshore wind turbines, with hub heights between 80 m and 100 m, can extract large amounts of energy from the atmosphere since they generally encounter higher wind speeds, but they face challenges given the complexity of boundary layer flows. This complexity of the lowest layers of the atmosphere, where wind turbines reside, has made conventional modeling efforts less than ideal. To meet the nation's goal of increasing wind power into the U.S. electrical grid, the accuracy of wind power forecasts must be improved. In this report, the Lawrence Livermore National Laboratory, in collaboration with the University of Colorado at Boulder, University of California at Berkeley, and Colorado School of Mines, evaluates innovative approaches to forecasting sudden changes in wind speed or 'ramping events' at an onshore, multimegawatt wind farm. The forecast simulations are compared to observations of wind speed and direction from tall meteorological towers and a remote-sensing Sound Detection and Ranging (SODAR) instrument. Ramping events, i.e., sudden increases or decreases in wind speed and hence, power generated by a turbine, are especially problematic for wind farm operators. Sudden changes in wind speed or direction can lead to large power generation differences across a wind farm and are very difficult to predict with current forecasting tools. Here, we quantify the ability of three models, mesoscale WRF, WRF-LES, and PF.WRF, which vary in sophistication and required user expertise, to predict three ramping events at a North American wind farm.

  9. Molecular metal-Oxo catalysts for generating hydrogen from water

    DOE Patents [OSTI]

    Long, Jeffrey R; Chang, Christopher J; Karunadasa, Hemamala I

    2015-02-24

    A composition of matter suitable for the generation of hydrogen from water is described, the positively charged cation of the composition having the general formula [(PY5W.sub.2)MO].sup.2+, wherein PY5W.sub.2 is (NC.sub.5XYZ)(NC.sub.5H.sub.4).sub.4C.sub.2W.sub.2, M is a transition metal, and W, X, Y, and Z can be H, R, a halide, CF.sub.3, or SiR.sub.3, where R can be an alkyl or aryl group. The two accompanying counter anions, in one embodiment, can be selected from the following Cl.sup.-, I.sup.-, PF.sub.6.sup.-, and CF.sub.3SO.sub.3.sup.-. In embodiments of the invention, water, such as tap water containing electrolyte or straight sea water can be subject to an electric potential of between 1.0 V and 1.4 V relative to the standard hydrogen electrode, which at pH 7 corresponds to an overpotential of 0.6 to 1.0 V, with the result being, among other things, the generation of hydrogen with an optimal turnover frequency of ca. 1.5 million mol H.sub.2/mol catalyst per h.

  10. Design and Construction of the NSTX Bakeout, Cooling and Vacuum Systems

    SciTech Connect (OSTI)

    L.E. Dudek; M. Kalish; R. Gernhardt; R.F. Parsells; W. Blanchard

    1999-11-01

    This paper will describe the design, construction and initial operation of the NSTX bakeout, water cooling and vacuum systems. The bakeout system is designed for two modes of operation. The first mode allows heating of the first wall components to 350 degrees C while the external vessel is cooled to 150 degrees C. The second mode cools the first wall to 150 degrees C and the external vessel to 50 degrees C. The system uses a low viscosity heat transfer oil which is capable of high temperature low pressure operation. The NSTX Torus Vacuum Pumping System (TVPS) is designed to achieve a base pressure of approximately 1x10 (superscript -8) Torr and to evacuate the plasma fuel gas loads in less than 5 minutes between discharges. The vacuum pumping system is capable of a pumping speed of approximately 3400 l/s for deuterium. The hardware consists of two turbo molecular pumps (TMPs) and a mechanical pump set consisting of a mechanical and a Roots blower pump. A PLC is used as the control system to provide remote monitoring, control and software interlock capability. The NSTX cooling water provides chilled, de ionized water for heat removal in the TF, OH and PF, power supplies, bus bar systems, and various diagnostics. The system provides flow monitoring via a PLC to prevent damage due to loss of flow.

  11. Highly Quantitative Electrochemical Characterization of Non-Aqueous Electrolytes & Solid Electrolyte Interphases

    SciTech Connect (OSTI)

    Sergiy V. Sazhin; Kevin L. Gering; Mason K. Harrup; Harry W. Rollins

    2012-10-01

    The methods to measure solid electrolyte interphase (SEI) electrochemical properties and SEI formation capability of non-aqueous electrolyte solutions are not adequately addressed in the literature. And yet, there is a strong demand in new electrolyte generations that promote stabilized SEIs and have an influence to resolve safety, calendar life and other limitations of Li-ion batteries. To fill this gap, in situ electrochemical approach with new descriptive criteria for highly quantitative characterization of SEI and electrolytes is proposed. These criteria are: SEI formation capacity, SEI corrosion rate, SEI maintenance rate, and SEI kinetic stability. These criteria are associated with battery parameters like irreversible capacity, self-discharge, shelf-life, power, etc. Therefore, they are especially useful for electrolyte development and standard fast screening, allowing a skillful approach to narrow down the search for the best electrolyte. The characterization protocol also allows retrieving information on interfacial resistance for SEI layers and the electrochemical window of electrolytes, the other important metrics of characterization. The method validation was done on electrolyte blends containing phosphazenes, developed at Idaho National Laboratory, as 1.2M LiPF6 [80 % EC-MEC (2:8) (v/v) + 20% Phosphazene variety] (v/v), which were targeted for safer electrolyte variations.

  12. VERIFICATION OF THE DEFENSE WASTE PROCESSING FACILITY'S (DWPF) PROCESS DIGESTION METHOD FOR THE SLUDGE BATCH 7A QUALIFICATION SAMPLE

    SciTech Connect (OSTI)

    Click, D.; Edwards, T.; Jones, M.; Wiedenman, B.

    2011-03-14

    For each sludge batch that is processed in the Defense Waste Processing Facility (DWPF), the Savannah River National Laboratory (SRNL) performs confirmation of the applicability of the digestion method to be used by the DWPF lab for elemental analysis of Sludge Receipt and Adjustment Tank (SRAT) receipt samples and SRAT product process control samples. DWPF SRAT samples are typically dissolved using a room temperature HF-HNO{sub 3} acid dissolution (i.e., DWPF Cold Chem Method, see DWPF Procedure SW4-15.201) and then analyzed by inductively coupled plasma - atomic emission spectroscopy (ICP-AES). This report contains the results and comparison of data generated from performing the Aqua Regia (AR), Sodium peroxide/Hydroxide Fusion (PF) and DWPF Cold Chem (CC) method digestions of Sludge Batch 7a (SB7a) SRAT Receipt and SB7a SRAT Product samples. The SB7a SRAT Receipt and SB7a SRAT Product samples were prepared in the SRNL Shielded Cells, and the SRAT Receipt material is representative of the sludge that constituates the SB7a Batch or qualification composition. This is the sludge in Tank 51 that is to be transferred into Tank 40, which will contain the heel of Sludge Batch 6 (SB6), to form the Sb7a Blend composition.

  13. Accurate static and dynamic properties of liquid electrolytes for Li-ion batteries from ab initio molecular dynamics

    SciTech Connect (OSTI)

    Ganesh, P.; Jiang, D.; Kent, P.R.C.

    2011-03-31

    Lithium-ion batteries have the potential to revolutionize the transportation industry, as they did for wireless communication. A judicious choice of the liquid electrolytes used in these systems is required to achieve a good balance among high-energy storage, long cycle life and stability, and fast charging. Ethylene-carbonate (EC) and propylene-carbonate (PC) are popular electrolytes. However, to date, almost all molecular-dynamics simulations of these fluids rely on classical force fields, while a complete description of the functionality of Li-ion batteries will eventually require quantum mechanics. We perform accurate ab initio molecular-dynamics simulations of ethylene- and propylene-carbonate with LiPF6 at experimental concentrations to build solvation models which explain available neutron scattering and nuclear magnetic resonance (NMR) results and to compute Li-ion solvation energies and diffusion constants. Our results suggest some similarities between the two liquids as well as some important differences. Simulations also provide useful insights into formation of solid-electrolyte interphases in the presence of electrodes in conventional Li-ion batteries.

  14. Accurate static and dynamic properties of liquid-electrolytes for Li-ion batteries from ab initio molecular dynamics

    SciTech Connect (OSTI)

    Ganesh, Panchapakesan; Jiang, Deen; Kent, Paul R

    2011-01-01

    Lithium-ion batteries have the potential to revolutionize the transportation industry, as they did for wireless communication. A judicious choice of the liquid electrolytes used in these systems is required to achieve a good balance among high-energy storage, long cycle life and stability, and fast charging. Ethylene-carbonate (EC) and propylene-carbonate (PC) are popular electrolytes. However, to date, almost all molecular-dynamics simulations of these fluids rely on classical force fields, while a complete description of the functionality of Li-ion batteries will eventually require quantum mechanics. We perform accurate ab initio molecular-dynamics simulations of ethylene- and propylene-carbonate with LiPF6 at experimental concentrations to build solvation models which explain available neutron scattering and nuclear magnetic resonance (NMR) results and to compute Li-ion solvation energies and diffusion constants. Our results suggest some similarities between the two liquids as well as some important differences. Simulations also provide useful insights into formation of solid-electrolyte interphases in the presence of electrodes in conventional Li-ion batteries.

  15. Fluorinated Phosphazene Co-solvents for Improved Thermal and Safety Performance in Lithium-Ion Battery Electrolytes

    SciTech Connect (OSTI)

    Harry W. Rollins; Mason K. Harrup; Eric J. Dufek; David K. Jamison; Sergiy V. Sazhin; Kevin L. Gering; Dayna L. Daubaras

    2014-10-01

    The safety of lithium-ion batteries is coming under increased scrutiny as they are being adopted for large format applications especially in the vehicle transportation industry and for grid-scale energy storage. The primary short-comings of lithium-ion batteries are the flammability of the liquid electrolyte and sensitivity to high voltage and elevated temperatures. We have synthesized a series of non-flammable fluorinated phosphazene liquids and blended them with conventional carbonate solvents. While the use of these phosphazenes as standalone electrolytes is highly desirable, they simply do not satisfy all of the many requirements that must be met such as high LiPF6 solubility and low viscosity, thus we have used them as additives and co-solvents in blends with typical carbonates. The physical and electrochemical properties of the electrolyte blends were characterized, and then the blends were used to build 2032-type coin cells which were evaluated at constant current cycling rates from C/10 to C/1. We have evaluated the performance of the electrolytes by determining the conductivity, viscosity, flash point, vapor pressure, thermal stability, electrochemical window, cell cycling data, and the ability to form solid electrolyte interphase (SEI) films. This paper presents our results on a series of chemically similar fluorinated cyclic phosphazene trimers, the FM series, which has exhibited numerous beneficial effects on battery performance, lifetimes, and safety aspects.

  16. Crystallization and doping of amorphous silicon on low temperature plastic

    DOE Patents [OSTI]

    Kaschmitter, James L.; Truher, Joel B.; Weiner, Kurt H.; Sigmon, Thomas W.

    1994-01-01

    A method or process of crystallizing and doping amorphous silicon (a-Si) on a low-temperature plastic substrate using a short pulsed high energy source in a selected environment, without heat propagation and build-up in the substrate. The pulsed energy processing of the a-Si in a selected environment, such as BF3 and PF5, will form a doped micro-crystalline or poly-crystalline silicon (pc-Si) region or junction point with improved mobilities, lifetimes and drift and diffusion lengths and with reduced resistivity. The advantage of this method or process is that it provides for high energy materials processing on low cost, low temperature, transparent plastic substrates. Using pulsed laser processing a high (>900.degree. C.), localized processing temperature can be achieved in thin films, with little accompanying temperature rise in the substrate, since substrate temperatures do not exceed 180.degree. C. for more than a few microseconds. This method enables use of plastics incapable of withstanding sustained processing temperatures (higher than 180.degree. C.) but which are much lower cost, have high tolerance to ultraviolet light, have high strength and good transparency, compared to higher temperature plastics such as polyimide.

  17. Crystallization and doping of amorphous silicon on low temperature plastic

    DOE Patents [OSTI]

    Kaschmitter, J.L.; Truher, J.B.; Weiner, K.H.; Sigmon, T.W.

    1994-09-13

    A method or process of crystallizing and doping amorphous silicon (a-Si) on a low-temperature plastic substrate using a short pulsed high energy source in a selected environment, without heat propagation and build-up in the substrate is disclosed. The pulsed energy processing of the a-Si in a selected environment, such as BF3 and PF5, will form a doped micro-crystalline or poly-crystalline silicon (pc-Si) region or junction point with improved mobilities, lifetimes and drift and diffusion lengths and with reduced resistivity. The advantage of this method or process is that it provides for high energy materials processing on low cost, low temperature, transparent plastic substrates. Using pulsed laser processing a high (>900 C), localized processing temperature can be achieved in thin films, with little accompanying temperature rise in the substrate, since substrate temperatures do not exceed 180 C for more than a few microseconds. This method enables use of plastics incapable of withstanding sustained processing temperatures (higher than 180 C) but which are much lower cost, have high tolerance to ultraviolet light, have high strength and good transparency, compared to higher temperature plastics such as polyimide. 5 figs.

  18. Coordinating Tectons: Bipyridyl Terminated Allenylidene Complexes

    SciTech Connect (OSTI)

    Cifuentes, Marie P.; Humphrey, Mark G.; Koutsantonis, George A.; Lengkeek, Nigel A.; Petrie, Simon; Sanford, Vanessa; Schauer, Phil A.; Skelton, Brian W.; Stranger, Robert; White, Allan H.

    2009-01-15

    A series of complexes with {pi}-conjugated carbon chains terminated by bipyridyl moieties has been prepared. These allenylidene complexes were derived from 9-hydroxy-9-ethynyl-4,5-diazafluorene, the preparation of which is reported; the new allenylidene complexes are highly colored with the cumulated carbon chain terminating in a bipyridyl unit providing a site for further coordination. The synthesis, characterization, and X-ray structure determination of trans-[MCl(P{intersection}P){sub 2}{sub {double_bond}}C{sub {double_bond}}C{sub {double_bond}}(4,5-diazafluoren-9-yl)]PF{sub 6} (M = Ru, P{intersection}P = bis(diphenylphosphino)methane (dppm), 1,2-bis(diphenylphosphino)ethane (dppe), 1,2-bis(dimethylphosphino)ethane (dmpe); M = Os, P{intersection}P = dppm) are described. The effect of the variation in metal and ligand on electronic and electrochemical characteristics of these complexes has been investigated by using UV-vis, solution electrochemistry, and a combination of these techniques in spectroelectrochemical experiments. DFT calculations have been performed on trans-[RuCl(P{intersection}P){sub 2}{sub {double_bond}}C{sub {double_bond}}C{sub {double_bond}}(4,5-diazafluoren-9-yl)]{sup q} (P{intersection}P = dppm, bis(dimethylphosphino)methane (dmpm); q = -1, 0, +1, +2) and subsequently solvent-corrected calculations with use of COSMO were also undertaken to examine the nature of electronic transitions in various oxidation states.

  19. Static characterization of a soft elastomeric capacitor for non destructive evaluation applications

    SciTech Connect (OSTI)

    Saleem, Hussam; Laflamme, Simon; Zhang, Huanhuan; Geiger, Randall; Kessler, Michael; Rajan, Krishna

    2014-02-18

    A large and flexible strain transducer consisting of a soft elastomeric capacitor (SEC) has been proposed by the authors. Arranged in a network setup, the sensing strategy offers tremendous potential at conducting non-destructive evaluation of large-scale surfaces. In prior work, the authors have demonstrated the performance of the sensor at tracking strain history, localizing cracks, and detecting vibration signatures. In this paper, we characterize the static performance of the proposed SEC. The characterization includes sensitivity of the signal, and temperature and humidity dependences. Tests are conducted on a simply supported aluminum beam subjected to bending as well as on a free standing sensor. The performance of the SEC is compared against off-the-shelf resistance-based strain gauges with resolution of 1 ??. A sensitivity of 1190 pF/? is obtained experimentally, in agreement with theory. Results also show the sensor linearity over the given level of strain, showing the promise of the SEC at monitoring of surface strain.

  20. Influence of the counteranion on the ability of 1-dodecyl-3-methyltriazolium ionic liquids to form mesophases

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

    Stappert, Kathrin; Ünal, Derya; Spielberg, Eike T.; Mudring, Anja -Verena

    2014-11-25

    The influence of the counteranion on the ability of the mesogenic cation 1-methyl-3-dodecyl-triazolium to form mesophases is explored. To that avail, salts of the cation with anions of different size, shape, and hydrogen bonding capability such as Cl–, Br–, I–, I3–, PF6–, and Tf2N– [bis(trifluorosulfonyl)amide] were synthesized and characterized. The crystal structures of the bromide, the iodide, and the triiodide reveal that the cations form bilayers with cations oriented in opposite directions featuring interdigitated alkyl tails. Within the layers, the cations are separated by anions. The rod-shaped triiodide anion forces the triazolium cation to align with it in this crystalmore » structure but due to its space requirement reduces the alkyl chain interdigitation which prevents the formation of a mesophase. Rather the compound transforms directly from a crystalline solid to an (ionic) liquid like the analogous bis(trifluorosulfonyl)amide. In contrast, the simple halides and the hexafluorophosphate form liquid crystalline phases. As a result, their clearing points shift with increasing anion radius to lower temperatures.« less

  1. Intruder negative-parity states of neutron-rich {sup 33}Si

    SciTech Connect (OSTI)

    Wang, Z. M.; Chapman, R.; Liang, X.; Burns, M.; Hodsdon, A.; Keyes, K.; Kumar, V.; Papenberg, A.; Smith, J. F.; Spohr, K. M.; Haas, F.; Bouhelal, M.; Caurier, E.; Curien, D.; Nowacki, F.; Azaiez, F.; Ibrahim, F.; Verney, D.; Behera, B. R.; Corradi, L.

    2010-06-15

    Yrast states in the neutron-rich {sub 14}{sup 33}Si{sub 19} nucleus have been studied using binary grazing reactions produced by the interaction of a 215-MeV beam of {sup 36}S ions with a thin {sup 208}Pb target. An experimental setup that combines the large-acceptance magnetic spectrometer PRISMA and the high-efficiency gamma-ray detection array CLARA was used in the experiment. Four new gamma-ray photopeaks at energies of 971, 1724, 1772, and 2655 keV were observed and assigned to the {sup 33}Si level scheme. The experimental level scheme is compared with the results of 1(Planck constant/2pi)omega p-sd-pf large-scale shell-model calculations using the recently developed PSDPFB effective interaction; good agreement is obtained. The structure of the populated states of {sup 33}Si is discussed within the context of an odd neutron coupled to states of the {sup 32}Si core.

  2. Lifetime measurements in {sup 63}Co and {sup 65}Co

    SciTech Connect (OSTI)

    Dijon, A.; Clement, E.; France, G. de; Van Isacker, P.; Rejmund, M.; Schmitt, C.; Goergen, A.; Obertelli, A.; Korten, W.; Dewald, A.; Hackstein, M.; Pissulla, Th.; Rother, W.; Zell, K. O.; Gadea, A.; Gaudefroy, L.; Mengoni, D.; Recchia, F.; Sahin, E.

    2011-06-15

    Lifetimes of the 9/2{sub 1}{sup -} and 3/2{sub 1}{sup -} states in {sup 63}Co and the 9/2{sub 1}{sup -} state in {sup 65}Co were measured using the recoil distance Doppler shift and the differential decay curve methods. The nuclei were populated by multinucleon transfer reactions in inverse kinematics. {gamma} rays were measured with the EXOGAM Ge array and the recoiling fragments were fully identified using the large-acceptance VAMOS spectrometer. The E2 transition probabilities from the 3/2{sub 1}{sup -} and 9/2{sub 1}{sup -} states to the 7/2{sup -} ground state could be extracted in {sup 63}Co as well as an upper limit for the 9/2{sub 1}{sup -}{yields}7/2{sub 1}{sup -} B(E2) value in {sup 65}Co. The experimental results were compared to large-scale shell-model calculations in the pf and pfg{sub 9/2} model spaces, allowing us to draw conclusions on the single-particle or collective nature of the various states.

  3. Minor antigen graft-versus-host reactions revealed in irradiated spleen and popliteal lymph node assays

    SciTech Connect (OSTI)

    Claman, H.N.; Jaffee, B.D.

    1984-10-01

    The graft-versus-hot (GVH) reaction across minor (non-H-2) histocompatibility barriers was studied in mice, in vivo. To increase GVH potential and to mimic clinical bone marrow transplantation protocols, we modified the popliteal lymph node (PLN) and the splenomegaly assays by irradiating the recipients before they received allogeneic lymphoid cell suspensions. In several combinations across major (H-2), minor (non-H-2) and multiple minor (non-H-2 plus minor lymphocyte stimulation) barriers, increased recipient organ weight (a measure of GVH activity) was seen with irradiated F1 recipients of parental cells. The irradiated splenomegaly (x-splenomegaly) assay was more sensitive than the (x-PLN) assay, but both correlated with in vivo GVH experiments of the P----F1 variety. The x-splenomegaly test indicated histoincompatibility in a system (B10.D2----BALB/c) in which the primary in vitro mixed leukocyte reactions is nonreactive, but in which systemic GVH can be induced. The x-splenomegaly test should be useful in analyzing complex reactions involving minor histocompatibility antigens in vivo.

  4. Nonaqueous electrolyte for electrical storage devices

    DOE Patents [OSTI]

    McEwen, Alan B. (Melrose, MA); Yair, Ein-Eli (Waltham, MA)

    1999-01-01

    Improved nonaqueous electrolytes for application in electrical storage devices such as electrochemical capacitors or batteries are disclosed. The electrolytes of the invention contain salts consisting of alkyl substituted, cyclic delocalized aromatic cations, and their perfluoro derivatives, and certain polyatomic anions having a van der Waals volume less than or equal to 100 .ANG..sup.3, preferably inorganic perfluoride anions and most preferably PF.sub.6.sup.-, the salts being dissolved in organic liquids, and preferably alkyl carbonate solvents, or liquid sulfur dioxide or combinations thereof, at a concentration of greater than 0.5M and preferably greater than 1.0M. Exemplary electrolytes comprise 1-ethyl-3-methylimidazolium hexafluorophosphate dissolved in a cyclic or acylic alkyl carbonate, or methyl formate, or a combination therof. These improved electrolytes have useful characteristics such as higher conductivity, higher concentration, higher energy storage capabilities, and higher power characteristics compared to prior art electrolytes. Stacked capacitor cells using electrolytes of the invention permit high energy, high voltage storage.

  5. Studies of ionic liquids in lithium-ion battery test systems

    SciTech Connect (OSTI)

    Salminen, Justin; Prausnitz, John M.; Newman, John

    2006-06-01

    In this work, thermal and electrochemical properties of neat and mixed ionic liquid - lithium salt systems have been studied. The presence of a lithium salt causes both thermal and phase-behavior changes. Differential scanning calorimeter DSC and thermal gravimetric analysis TGA were used for thermal analysis for several imidazolium bis(trifluoromethylsulfonyl)imide, trifluoromethansulfonate, BF{sub 4}, and PF{sub 6} systems. Conductivities and diffusion coefficient have been measured for some selected systems. Chemical reactions in electrode - ionic liquid electrolyte interfaces were studied by interfacial impedance measurements. Lithium-lithium and lithium-carbon cells were studied at open circuit and a charged system. The ionic liquids studied include various imidazolium systems that are already known to be electrochemically unstable in the presence of lithium metal. In this work the development of interfacial resistance is shown in a Li|BMIMBF{sub 4} + LiBF{sub 4}|Li cell as well as results from some cycling experiments. As the ionic liquid reacts with the lithium electrode the interfacial resistance increases. The results show the magnitude of reactivity due to reduction of the ionic liquid electrolyte that eventually has a detrimental effect on battery performance.

  6. Electrolytes including fluorinated solvents for use in electrochemical cells

    DOE Patents [OSTI]

    Tikhonov, Konstantin; Yip, Ka Ki; Lin, Tzu-Yuan

    2015-07-07

    Provided are electrochemical cells and electrolytes used to build such cells. The electrolytes include ion-supplying salts and fluorinated solvents capable of maintaining single phase solutions with the salts at between about -30.degree. C. to about 80.degree. C. The fluorinated solvents, such as fluorinated carbonates, fluorinated esters, and fluorinated esters, are less flammable than their non-fluorinated counterparts and increase safety characteristics of cells containing these solvents. The amount of fluorinated solvents in electrolytes may be between about 30% and 80% by weight not accounting weight of the salts. Fluorinated salts, such as fluoroalkyl-substituted LiPF.sub.6, fluoroalkyl-substituted LiBF.sub.4 salts, linear and cyclic imide salts as well as methide salts including fluorinated alkyl groups, may be used due to their solubility in the fluorinated solvents. In some embodiments, the electrolyte may also include a flame retardant, such as a phosphazene or, more specifically, a cyclic phosphazene and/or one or more ionic liquids.

  7. Solid-state chemistry of molecular metal oxide clusters. Multiple, sequential C-H activation processes in the hydrogenation of coordinated cyclooctene. Lattice mobility of small organic molecules

    SciTech Connect (OSTI)

    Siedle, A.R.; Newmark, R.A.; Sahyun, M.R.V.; Lyon, P.A.; Hunt, S.L.; Skarjune, R.P. )

    1989-10-25

    Reaction of solid ((Ph{sub 3}P){sub 2}Ir(C{sub 8}H{sub 12})){sub 3}PW{sub 12}O{sub 40} with D{sub 2} gas produces cyclooctane containing up to 16 deuterium atoms. The c-C{sub 8}D{sub n}H{sub 16-n} isotopomer distribution is analyzed by Poisson statistics and interpreted in terms of C-H activation involving Ir-D-C-H exchange in an intermediate species containing coordinated cyclooctene. The results are compared with those from D{sub 2} reduction of ((Ph{sub 3}P){sub 2}Ir(C{sub 8}H{sub 12}))(PF{sub 6}) in the solid state and in acetone solution, in which cases, an additional exchange process operates. Solid-state {sup 2}H NMR shows that, even at low temperatures, small organic molecules such as cyclooctane and benzene undergo nearly isotropic motion.

  8. Progression of soot cake layer properties during the systematic regeneration of diesel particulate filters measured with neutron tomography

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

    Toops, Todd J.; Pihl, Josh A.; Finney, Charles E. A.; Gregor, Jens; Bilheux, Hassina

    2015-01-16

    Although particulate filters (PFs) have been a key component of the emission control system for modern diesel engines, there remain significant questions about the basic regeneration behavior of the filters and how it changes with accumulation of increasing soot layers. This effort describes a systematic deposition and regeneration of particulate matter in 25-mm diameter 76-mm long wall-flow PFs composed of silicon carbide (SiC) material. The initial soot distributions were analyzed for soot cake thickness using a nondestructive neutron imaging technique. With the PFs intact, it was then possible to sequentially regenerate the samples and reanalyze them, which was performedmoreafter nominal 20, 50, and 70 % regenerations. The loaded samples show a relatively uniform distribution of particulate with an increasing soot cake thickness and nearly identical initial density of 70 mg/cm3. Throughout regeneration, the soot cake thickness initially decreases significantly while the density increases to 8090 mg/cm3. After ~50 % regeneration, the soot cake thickness stays relatively constant, but instead, the density decreases as pores open up in the layer (~35 mg/cm3 at 70 % regeneration). Complete regeneration initially occurs at the rear of the PF channels. With this information, a conceptual model of the regeneration is proposed.less

  9. Infrared signature of micro-hydration in the organophosphate sarin: An ab initio study

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

    Alam, Todd M.; Pearce, Charles Joseph

    2015-06-28

    The infrared (IR) spectra of micro-hydrated Sarin•(H2O)n clusters containing between one and four explicit waters have been studied using ab initio density functional theory (DFT) methods. The phosphate group P=O bond vibration region (~1270 to 1290 cm–1) revealed the largest frequency variation with hydration, with a frequency red shift reflecting the direct hydrogen bond formation between the P=O of Sarin and water. Small variations to the P-F stretch (~810 to 815 cm–1) and the C-O-P vibrational modes (~995 to 1004 cm–1) showed that the water interactions with these functional groups were minor, and that the structures of Sarin were notmore » extensively perturbed in the hydrated complexes. Increasing the number of explicit hydration waters produced only small vibrational changes in the lowest free energy complexes. These minor changes were consistent with a single water-phosphate hydrogen bond being the dominant structure, though a second water-phosphate hydrogen bond was observed in some complexes and was identified by an additional red shift of the P=O bond vibration. As a result, the H2O•H2O vibrational modes (~3450 to 3660 cm–1) increased in complexity with higher hydration levels and reflect the extended hydrogen bonding networks formed between the explicit waters in the hydrated Sarin clusters.« less

  10. Rhodium mediated bond activation: from synthesis to catalysis

    SciTech Connect (OSTI)

    Ho, Hung-An

    2012-03-06

    Recently, our lab has developed monoanionic tridentate ligand, To{sup R}, showing the corresponding coordination chemistry and catalyst reactivity of magnesium, zirconium, zinc and iridium complexes. This thesis details synthetic chemistry, structural study and catalytic reactivity of the To{sup R}-supported rhodium compounds. Tl[To{sup R}] has been proved to be a superior ligand transfer agent for synthesizing rhodium complexes. The salt metathesis route of Tl[To{sup M}] with [Rh({mu}-Cl)(CO)]{sub 2} and [Rh({mu}- Cl)(COE)]{sub 2} gives To{sup M}Rh(CO){sub 2} (2.2) and To{sup M}RhH({eta}{sup 3}-C{sub 8}H{sub 13}) (3.1) respectively while Tl[To{sup P}] with [Rh({mu}-Cl)(CO)]{sub 2} affords To{sup P}Rh(CO){sub 2} (2.3). 2.2 reacts with both strong and weak electrophiles, resulting in the oxazoline N-attacked and the metal center-attacked compounds correspondingly. Using one of the metal center-attacked electrophiles, 2.3 was demonstrated to give high diastereoselectivity. Parallel to COE allylic C-H activation complex 3.1, the propene and allylbenzene allylic C-H activation products have also been synthesized. The subsequent functionalization attempts have been examined by treating with Brnsted acids, Lewis acids, electrophiles, nucleophiles, 1,3-dipolar reagents and reagents containing multiple bonds able to be inserted. Various related complexes have been obtained under these conditions, in which one of the azide insertion compounds reductively eliminates to give an allylic functionalization product stoichiometrically. 3.1 reacts with various primary alcohols to give the decarbonylation dihydride complex To{sup M}Rh(H){sub 2}CO (4.1). 4.1 shows catalytic reactivity for primary alcohol decarbonylation under a photolytic condition. Meanwhile, 2.2 has been found to be more reactive than 4.1 for catalytic alcohol decarbonylation under the same condition. Various complexes and primary alcohols have been investigated as well. The proposed mechanism is based on the stochiometric reactions of the possible metal and organic intermediates. Primary amines, hypothesized to undergo a similar reaction pathway, have been verified to give dehydrogenative coupling product, imines. In the end, the well-developed neutral tridentate Tpm coordinates to the rhodium bis(ethylene) dimer in the presence of TlPF{sub 6} to give the cationic complex, [TpmRh(C{sub 2}H{sub 4}){sub 2}][PF{sub 6}] (5.1). 5.1 serves as the first example of explicit determination of the solid state hapticity, evidenced by X-ray structure, among all the cationic Tpm{sup R}M(C{sub 2}H{sub 4}){sub 2}{sup +} (Tpm{sup R} = Tpm, Tpm*, M = Rh, Ir) derivatives. The substitution chemistry of this compound has been studied by treating with soft and hard donors. The trimethylphosphine-sbustituted complex activates molecular hydrogen to give the dihydride compound.

  11. Accident Conditions versus Regulatory Test for NRC-Approved UF6 Packages

    SciTech Connect (OSTI)

    MILLS, G. SCOTT; AMMERMAN, DOUGLAS J.; LOPEZ, CARLOS

    2003-01-01

    The Nuclear Regulatory Commission (NRC) approves new package designs for shipping fissile quantities of UF{sub 6}. Currently there are three packages approved by the NRC for domestic shipments of fissile quantities of UF{sub 6}: NCI-21PF-1; UX-30; and ESP30X. For approval by the NRC, packages must be subjected to a sequence of physical tests to simulate transportation accident conditions as described in 10 CFR Part 71. The primary objective of this project was to relate the conditions experienced by these packages in the tests described in 10 CFR Part 71 to conditions potentially encountered in actual accidents and to estimate the probabilities of such accidents. Comparison of the effects of actual accident conditions to 10 CFR Part 71 tests was achieved by means of computer modeling of structural effects on the packages due to impacts with actual surfaces, and thermal effects resulting from test and other fire scenarios. In addition, the likelihood of encountering bodies of water or sufficient rainfall to cause complete or partial immersion during transport over representative truck routes was assessed. Modeled effects, and their associated probabilities, were combined with existing event-tree data, plus accident rates and other characteristics gathered from representative routes, to derive generalized probabilities of encountering accident conditions comparable to the 10 CFR Part 71 conditions. This analysis suggests that the regulatory conditions are unlikely to be exceeded in real accidents, i.e. the likelihood of UF{sub 6} being dispersed as a result of accident impact or fire is small. Moreover, given that an accident has occurred, exposure to water by fire-fighting, heavy rain or submersion in a body of water is even less probable by factors ranging from 0.5 to 8E-6.

  12. Preconversion catalytic deoxygenation of phenolic functional groups. Quarterly technical progress report, April 1, 1992--June 30, 1992

    SciTech Connect (OSTI)

    Kubiak, C.P.

    1992-11-01

    Aryl carbon-oxygen bond cleavage is a chemical transformation of importance in coal liquefaction and the upgrading of coal liquids as well as in the synthesis of natural products. There have been numerous attempts to discover general methods for the cleavage of aryl carbon-oxygen bonds. All the stoichiometric organic methods for phenol deoxygenation have limited applications and involve expensive reagents. Catalytic method, for the hydrodeoxygenation (HDO) of phenols involve supported transition metal oxides, such as Mo/{gamma}-Al{sub 2}O{sub 3}, Ni-MO/{gamma}-Al{sub 2}O{sub 3}, Co-Mo/{gamma}-Al{sub 2}O{sub 3}, and Fe{sub 2}O{sub 3}/SiO{sub 2}. Typical phenol hydrodeoxygenation conditions involve hydrogen pressures in excess of 100 atm and temperatures in excess of 200{degrees}C. Under these conditions arene ring hydrogenation is generally found to compete with phenol deoxygenation; and the coproduct water is found to impair the activity of the catalysts. This proposed research offers the possibility of effecting the selective catalytic deoxygenation of phenolic functional groups using CO. The deoxygenation of phenols by carbon monoxide mediated by Ir(triphos)OAr has provided us with a catalytic Phenol deoxygenation pathway, through the elimination of CO{sub 2} and formation of a benzyne intermediate. Although the [Pt(triphos)(O-Ph-Me)]PF{sub 6} system is not expected to be as efficient a catalyst as some of the other transition metals systems we are currently exploring, it will provide more information about the deoxygenation mechanism in these triphos complexes. This is due to the presence of the structurally sensitive {sup 3l}P--{sup 195}Pt coupling constant and comparisons to the extensively studied Pt(dppe)(O-Ph){sub 2} systems.

  13. Nuclear quantum effects on the structure and the dynamics of [H{sub 2}O]{sub 8} at low temperatures

    SciTech Connect (OSTI)

    Videla, Pablo E.; Rossky, Peter J.; Laria, D.

    2013-11-07

    We use ring-polymer-molecular-dynamics (RPMD) techniques and the semi-empirical q-TIP4P/F water model to investigate the relationship between hydrogen bond connectivity and the characteristics of nuclear position fluctuations, including explicit incorporation of quantum effects, for the energetically low lying isomers of the prototype cluster [H{sub 2}O]{sub 8} at T = 50 K and at 150 K. Our results reveal that tunneling and zero-point energy effects lead to sensible increments in the magnitudes of the fluctuations of intra and intermolecular distances. The degree of proton spatial delocalization is found to map logically with the hydrogen-bond connectivity pattern of the cluster. Dangling hydrogen bonds exhibit the largest extent of spatial delocalization and participate in shorter intramolecular O-H bonds. Combined effects from quantum and polarization fluctuations on the resulting individual dipole moments are also examined. From the dynamical side, we analyze the characteristics of the infrared absorption spectrum. The incorporation of nuclear quantum fluctuations promotes red shifts and sensible broadening relative to the classical profile, bringing the simulation results in much more satisfactory agreement with direct experimental information in the mid and high frequency range of the stretching band. While RPMD predictions overestimate the peak position of the low frequency shoulder, the overall agreement with that reported using an accurate, parameterized, many-body potential is reasonable, and far superior to that one obtains by implementing a partially adiabatic centroid molecular dynamics approach. Quantum effects on the collective dynamics, as reported by instantaneous normal modes, are also discussed.

  14. TOKOPS: Tokamak Reactor Operations Study: The influence of reactor operations on the design and performance of tokamaks with solid-breeder blankets: Final report

    SciTech Connect (OSTI)

    Conn, R.W.; Ghoniem, N.M.; Firestone, M.A.

    1986-09-01

    Reactor system operation and procedures have a profound impact on the conception and design of power plants. These issues are studied here using a model tokamak system employing a solid-breeder blanket. The model blanket is one which has evolved from the STARFIRE and BCSS studies. The reactor parameters are similar to those characterizing near-term fusion engineering reactors such as INTOR or NET (Next European Tokamak). Plasma startup, burn analysis, and methods for operation at various levels of output power are studied. A critical, and complicating, element is found to be the self-consistent electromagnetic response of the system, including the presence of the blanket and the resulting forces and loadings. Fractional power operation, and the strategy for burn control, is found to vary depending on the scaling law for energy confinement, and an extensive study is reported. Full-power reactor operation is at a neutron wall loading pf 5 MW/m/sup 2/ and a surface heat flux of 1 MW/m/sup 2/. The blanket is a pressurized steel module with bare beryllium rods and low-activation HT-9-(9-C-) clad LiAlO/sub 2/ rods. The helium coolant pressure is 5 MPa, entering the module at 297/sup 0/C and exiting at 550/sup 0/C. The system power output is rated at 1000 MW(e). In this report, we present our findings on various operational scenarios and their impact on system design. We first start with the salient aspects of operational physics. Time-dependent analyses of the blanket and balance of plant are then presented. Separate abstracts are included for each chapter.

  15. Catalytic ionic hydrogenation of ketones using tungsten or molybdenum catalysts with increased lifetimes

    DOE Patents [OSTI]

    Bullock, R. Morris; Kimmich, Barbara F. M.; Fagan, Paul J.; Hauptman, Elisabeth

    2003-09-02

    The present invention is a process for the catalytic hydrogenation of ketones and aldehydes to alcohols at low temperatures and pressures using organometallic molybdenum and tungsten complexes and the catalyst used in the process. The reactants include a functional group which is selected from groups represented by the formulas R*(C.dbd.O)R' and R*(C.dbd.O)H, wherein R* and R' are selected from hydrogen or any alkyl or aryl group. The process includes reacting the organic compound in the presence of hydrogen and a catalyst to form a reaction mixture. The catalyst is prepared by reacting Ph.sub.3 C.sup.+ A.sup.- with a metal hydride. A.sup.- represents an anion and can be BF.sub.4.sup.-, PF.sub.6.sup.-, CF.sub.3 SO.sub.3.sup.- or Bar'.sub.4.sup.-, wherein Ar'=3,5-bis(trifluoromethyl)phenyl. The metal hydride is represented by the formula: HM(CO).sub.2 [.eta..sup.5 :.eta..sup.1 --C.sub.5 H.sub.4 (XH.sub.2).sub.n PR.sub.2 ] wherein M represents a molybdenum (Mo) atom or a tungsten (W) atom; X is a carbon atom, a silicon atom or a combination of carbon (C) and silicon (Si) atoms; n is any positive integer; R represents two hydrocarbon groups selected from H, an aryl group and an alkyl group, wherein both R groups can be the same or different. The metal hydride is reacted with Ph.sub.3 C.sup.+ A.sup.- either before reacting with the organic compound or in the reaction mixture.

  16. IMPROVED OIL RECOVERY IN MISSISSIPPIAN CARBONATE RESERVOIRS OF KANSAS - NEAR TERM - CLASS 2

    SciTech Connect (OSTI)

    Timothy R. Carr; Don W. Green; G. Paul Willhite

    2000-04-30

    This annual report describes progress during the final year of the project entitled ''Improved Oil Recovery in Mississippian Carbonate Reservoirs in Kansas''. This project funded under the Department of Energy's Class 2 program targets improving the reservoir performance of mature oil fields located in shallow shelf carbonate reservoirs. The focus of the project was development and demonstration of cost-effective reservoir description and management technologies to extend the economic life of mature reservoirs in Kansas and the mid-continent. As part of the project, tools and techniques for reservoir description and management were developed, modified and demonstrated, including PfEFFER spreadsheet log analysis software. The world-wide-web was used to provide rapid and flexible dissemination of the project results through the Internet. A summary of demonstration phase at the Schaben and Ness City North sites demonstrates the effectiveness of the proposed reservoir management strategies and technologies. At the Schaben Field, a total of 22 additional locations were evaluated based on the reservoir characterization and simulation studies and resulted in a significant incremental production increase. At Ness City North Field, a horizontal infill well (Mull Ummel No.4H) was planned and drilled based on the results of reservoir characterization and simulation studies to optimize the location and length. The well produced excellent and predicted oil rates for the first two months. Unexpected presence of vertical shale intervals in the lateral resulted in loss of the hole. While the horizontal well was not economically successful, the technology was demonstrated to have potential to recover significant additional reserves in Kansas and the Midcontinent. Several low-cost approaches were developed to evaluate candidate reservoirs for potential horizontal well applications at the field scale, lease level, and well level, and enable the small independent producer to identify efficiently candidate reservoirs and also to predict the performance of horizontal well applications.

  17. Determining the Radiation Damage Effect on Glovebox Glove Material.

    SciTech Connect (OSTI)

    Cournoyer, M. E.; Balkey, J. J.; Andrade, R.M.

    2005-01-01

    The Nuclear Material Technology (NMT) Division has the largest inventory of glove box gloves at Los Alamos National Laboratory. The minimization of unplanned breaches in the glovebox, e.g., glove failures, is a primary concern in the daily operations in NMT Division facilities, including the Plutonium Facility (PF-4) at TA-55 and Chemical and Metallurgy Research (CMR) Facility. Glovebox gloves in these facilities are exposed to elevated temperatures and exceptionally aggressive radiation environments (particulate {sup 239}Pu and {sup 238}Pu). Predictive models are needed to estimate glovebox glove service lifetimes, i.e. change-out intervals. Towards this aim aging studies have been initiated that correlate changes in mechanical (physical) properties with degradation chemistry. This present work derives glovebox glove change intervals based on previously reported mechanical data of thermally aged hypalon glove samples. Specifications for 30 mil tri-layered hypalon/lead glovebox gloves (TLH) and 15 mil hypalon gloves (HYP) have already been established. The relevant mechanical properties are shown on Table 1. Tensile strength is defined as the maximum load applied in breaking a tensile test piece divided by the original cross-sectional area of the test piece (Also termed maximum stress and ultimate tensile stress). Ultimate elongation is the elongation at time of rupture (Also termed maximum strain). The specification for the tensile test and ultimate elongation are the minimum acceptable values. In addition, the ultimate elongation must not vary 20% from the original value. In order to establish a service lifetimes for glovebox gloves in a thermal environment, the mechanical properties of glovebox glove materials were studied.

  18. Develop and Manufacture an airlock sliding tray

    SciTech Connect (OSTI)

    Lawton, Cindy M.

    2014-02-26

    Objective: The goal of this project is to continue to develop an airlock sliding tray and then partner with an industrial manufacturing company for production. The sliding tray will be easily installed into and removed from most glovebox airlocks in a few minutes. Technical Approach: A prototype of a sliding tray has been developed and tested in the LANL cold lab and 35 trays are presently being built for the plutonium facility (PF-4). The current, recently approved design works for a 14-inch diameter round airlock and has a tray length of approximately 20 inches. The grant will take the already tested and approved round technology and design for the square airlock. These two designs will be suitable for the majority of the existing airlocks in the multitude of DOE facilities. Partnering with an external manufacturer will allow for production of the airlock trays at a much lower cost and increase the availability of the product for all DOE sites. Project duration is estimated to be 12-13 months. Benefits: The purpose of the airlock sliding trays is fourfold: 1) Mitigate risk of rotator cuff injuries, 2) Improve ALARA, 3) Reduce risk of glovebox glove breaches and glove punctures, and 4) Improve worker comfort. I have had the opportunity to visit many other DOE facilities including Savannah, Y-12, ORNL, Sandia, and Livermore for assistance with ergonomic problems and/or injuries. All of these sites would benefit from the airlock sliding tray and I can assume all other DOE facilities with gloveboxes built prior to 1985 could also use the sliding trays.

  19. Large Bore Powder Gun Qualification (U)

    SciTech Connect (OSTI)

    Rabern, Donald A.; Valdiviez, Robert

    2012-04-02

    A Large Bore Powder Gun (LBPG) is being designed to enable experimentalists to characterize material behavior outside the capabilities of the NNSS JASPER and LANL TA-55 PF-4 guns. The combination of these three guns will create a capability to conduct impact experiments over a wide range of pressures and shock profiles. The Large Bore Powder Gun will be fielded at the Nevada National Security Site (NNSS) U1a Complex. The Complex is nearly 1000 ft below ground with dedicated drifts for testing, instrumentation, and post-shot entombment. To ensure the reliability, safety, and performance of the LBPG, a qualification plan has been established and documented here. Requirements for the LBPG have been established and documented in WE-14-TR-0065 U A, Large Bore Powder Gun Customer Requirements. The document includes the requirements for the physics experiments, the gun and confinement systems, and operations at NNSS. A detailed description of the requirements is established in that document and is referred to and quoted throughout this document. Two Gun and Confinement Systems will be fielded. The Prototype Gun will be used primarily to characterize the gun and confinement performance and be the primary platform for qualification actions. This gun will also be used to investigate and qualify target and diagnostic modifications through the life of the program (U1a.104 Drift). An identical gun, the Physics Gun, will be fielded for confirmatory and Pu experiments (U1a.102D Drift). Both guns will be qualified for operation. The Gun and Confinement System design will be qualified through analysis, inspection, and testing using the Prototype Gun for the majority of process. The Physics Gun will be qualified through inspection and a limited number of qualification tests to ensure performance and behavior equivalent to the Prototype gun. Figure 1.1 shows the partial configuration of U1a and the locations of the Prototype and Physics Gun/Confinement Systems.

  20. Changes in the peripheral blood transcriptome associated with occupational benzene exposure identified by cross-comparison on two microarray platforms

    SciTech Connect (OSTI)

    McHale, Cliona M.; Zhang, Luoping; Lan, Qing; Li, Guilan; Hubbard, Alan E.; Forrest, Matthew S.; Vermeulen, Roel; Chen, Jinsong; Shen, Min; Rappaport, Stephen M.; Yin, Songnian; Smith, Martyn T.; Rothman, Nathaniel

    2009-03-01

    Benzene is an established cause of leukemia and a possible cause of lymphoma in humans but the molecular pathways underlying this remain largely undetermined. This study sought to determine if the use of two different microarray platforms could identify robust global gene expression and pathway changes associated with occupational benzene exposure in the peripheral blood mononuclear cell (PBMC) gene expression of a population of shoe-factory workers with well-characterized occupational exposures to benzene. Microarray data was analyzed by a robust t-test using a Quantile Transformation (QT) approach. Differential expression of 2692 genes using the Affymetrix platform and 1828 genes using the Illumina platform was found. While the overall concordance in genes identified as significantly associated with benzene exposure between the two platforms was 26% (475 genes), the most significant genes identified by either array were more likely to be ranked as significant by the other platform (Illumina = 64%, Affymetrix = 58%). Expression ratios were similar among the concordant genes (mean difference in expression ratio = 0.04, standard deviation = 0.17). Four genes (CXCL16, ZNF331, JUN and PF4), which we previously identified by microarray and confirmed by real-time PCR, were identified by both platforms in the current study and were among the top 100 genes. Gene Ontology analysis showed over representation of genes involved in apoptosis among the concordant genes while Ingenuity{reg_sign} Pathway Analysis (IPA) identified pathways related to lipid metabolism. Using a two-platform approach allows for robust changes in the PBMC transcriptome of benzene-exposed individuals to be identified.

  1. Screening of low cost sorbents for arsenic and mercury capture in gasification systems

    SciTech Connect (OSTI)

    Cedric Charpenteau; Revata Seneviratne; Anthe George; Marcos Millan; Denis R. Dugwell; Rafael Kandiyoti

    2007-09-15

    A novel laboratory-scale fixed-bed reactor has been developed to investigate trace metal capture on selected sorbents for cleaning the hot raw gas in Integrated Gasification Combined Cycle (IGCC) power plants. The new reactor design is presented, together with initial results for mercury and arsenic capture on five sorbents. It was expected that the capture efficiency of sorbents would decrease with increasing temperature. However, a commercial activated carbon, Norit Darco 'Hg', and a pyrolysis char prepared from scrap tire rubber exhibit similar efficiencies for arsenic at 200 and at 400{sup o}C (70% and 50%, respectively). Meta-kaolinite and fly ash both exhibit an efficiency of around 50% at 200{sup o}C, which then dropped as the test temperature was increased to 400{sup o}C. Activated scrap tire char performed better at 200{sup o}C than the pyrolysis char showing an arsenic capture capacity similar to that of commercial Norit Darco 'Hg'; however, efficiency dropped to below 40% at 400{sup o}C. These results suggest that the capture mechanism of arsenic (As4) is more complex than purely physical adsorption onto the sorbents. Certain elements within the sorbents may have significant importance for chemical adsorption, in addition to the effect of surface area, as determined by the BET method. This was indeed the case for the mercury capture efficiency for all four sorbents tested. Three of the sorbents tested retained 90% of the mercury when operated at 100{sup o}C. As the temperature increased, the efficiency of activated carbon and pyrolysis char reduced significantly. Curiously, despite having the smallest Brunauer-Emmet-Teller (BET) surface area, a pf-combustion ash was the most effective in capturing mercury over the temperature range studied. These observations suggest that the observed mercury capture was not purely physical adsorption but a combination of physical and chemical processes. 27 refs., 4 figs., 4 tabs.

  2. Development and application of LEESA (Low Energy Electrostatic Sensitivity Apparatus)

    SciTech Connect (OSTI)

    Carlson, R.S. ); Wood, R.L. )

    1990-01-01

    A precision Low Energy Electrostatic Sensitivity Apparatus (LEESA) was developed in the voltage range 0--3000 volts dc and was employed over a capacitance range of 25--50,000 pF on sensitive, very sensitive, and extremely sensitive pyrotechnic fuels and compositions. Zirconium powder, Zr/KClO{sub 4} pyrotechnic, titanium powder, Ti/KClO{sub 4} and TiH{sub x}/KClO{sub 4} pyrotechnics (x = 0.65, 1.65) and several other sensitive materials were evaluated. LEESA simulates casual human contact with potentially hazardous materials. In operation, a hand-held probe is applied to the sample to discharge the capacitance. As the probe approaches the sample, a spark jumps from the probe tip to the sample when the gap closes to the appropriate distance. This is analagous to a finger or a tool touching a sensitive material during which maneuver a spark jumps to the material. LEESA defines the probability of ignition over a voltage or energy range and is capable of thousands of trials on a test material in the span of a few hours. In addition to evaluating static sensitivity, the effect of electrode polarity, individual differences between operators, test method, humidity, sample size, particle size, capacitance, time constant RC, and voltage versus energy have been determined. The equipment is inexpensive and easy to build and use and is a low risk method because of the small quantities of sensitive material being tested at any one time. The accuracy and precision of the results surpasses that of methods currently in use. 7 refs., 11 figs., 1 tab.

  3. Effects of Village Power Quality on Fuel Consumption and Operating Expenses

    SciTech Connect (OSTI)

    Richard Wies; Ron Johnson

    2008-12-31

    Alaska's rural village electric utilities are isolated from the Alaska railbelt electrical grid intertie and from each other. Different strategies have been developed for providing power to meet demand in each of these rural communities. Many of these communities rely on diesel electric generators (DEGs) for power. Some villages have also installed renewable power sources and automated generation systems for controlling the DEGs and other sources of power. For example, Lime Village has installed a diesel battery photovoltaic hybrid system, Kotzebue and Wales have wind-diesel hybrid systems, and McGrath has installed a highly automated system for controlling diesel generators. Poor power quality and diesel engine efficiency in village power systems increases the cost of meeting the load. Power quality problems may consist of poor power factor (PF) or waveform disturbances, while diesel engine efficiency depends primarily on loading, the fuel type, the engine temperature, and the use of waste heat for nearby buildings. These costs take the form of increased fuel use, increased generator maintenance, and decreased reliability. With the cost of bulk fuel in some villages approaching $1.32/liter ($5.00/gallon) a modest 5% decrease in fuel use can result in substantial savings with short payback periods depending on the village's load profile and the cost of corrective measures. This project over its five year history has investigated approaches to improving power quality and implementing fuel savings measures through the use of performance assessment software tools developed in MATLAB{reg_sign} Simulink{reg_sign} and the implementation of remote monitoring, automated generation control, and the addition of renewable energy sources in select villages. The results have shown how many of these communities would benefit from the use of automated generation control by implementing a simple economic dispatch scheme and the integration of renewable energy sources such as wind generation.

  4. Infrared signature of micro-hydration in the organophosphate sarin: An ab initio study

    SciTech Connect (OSTI)

    Alam, Todd M.; Pearce, Charles Joseph

    2015-06-28

    The infrared (IR) spectra of micro-hydrated Sarin(H2O)n clusters containing between one and four explicit waters have been studied using ab initio density functional theory (DFT) methods. The phosphate group P=O bond vibration region (~1270 to 1290 cm1) revealed the largest frequency variation with hydration, with a frequency red shift reflecting the direct hydrogen bond formation between the P=O of Sarin and water. Small variations to the P-F stretch (~810 to 815 cm1) and the C-O-P vibrational modes (~995 to 1004 cm1) showed that the water interactions with these functional groups were minor, and that the structures of Sarin were not extensively perturbed in the hydrated complexes. Increasing the number of explicit hydration waters produced only small vibrational changes in the lowest free energy complexes. These minor changes were consistent with a single water-phosphate hydrogen bond being the dominant structure, though a second water-phosphate hydrogen bond was observed in some complexes and was identified by an additional red shift of the P=O bond vibration. As a result, the H2OH2O vibrational modes (~3450 to 3660 cm1) increased in complexity with higher hydration levels and reflect the extended hydrogen bonding networks formed between the explicit waters in the hydrated Sarin clusters.

  5. The dynamic behavior of thin-film ionic transition metal complex-based light-emitting electrochemical cells

    SciTech Connect (OSTI)

    Meier, Sebastian B., E-mail: sebastian.meier@belectric.com, E-mail: wiebke.sarfert@siemens.com [Department of Materials Science VI: Materials for Electronics and Energy Technology, Friedrich-Alexander-University of Erlangen-Nuremberg, 91058 Erlangen (Germany); Siemens AG, Corporate Technology, CT RTC MAT IEC-DE, 91058 Erlangen (Germany); Hartmann, David; Sarfert, Wiebke, E-mail: sebastian.meier@belectric.com, E-mail: wiebke.sarfert@siemens.com [Siemens AG, Corporate Technology, CT RTC MAT IEC-DE, 91058 Erlangen (Germany); Winnacker, Albrecht [Department of Materials Science VI: Materials for Electronics and Energy Technology, Friedrich-Alexander-University of Erlangen-Nuremberg, 91058 Erlangen (Germany)

    2014-09-14

    Light-emitting electrochemical cells (LECs) have received increasing attention during recent years due to their simple architecture, based on solely air-stabile materials, and ease of manufacture in ambient atmosphere, using solution-based technologies. The LEC's active layer offers semiconducting, luminescent as well as ionic functionality resulting in device physical processes fundamentally different as compared with organic light-emitting diodes. During operation, electrical double layers (EDLs) form at the electrode interfaces as a consequence of ion accumulation and electrochemical doping sets in leading to the in situ development of a light-emitting p-i-n junction. In this paper, we comment on the use of impedance spectroscopy in combination with complex nonlinear squares fitting to derive key information about the latter events in thin-film ionic transition metal complex-based light-emitting electrochemical cells based on the model compound bis-2-phenylpyridine 6-phenyl-2,2-bipyridine iridium(III) hexafluoridophosphate ([Ir(ppy)?(pbpy)][PF?]). At operating voltages below the bandgap potential of the ionic complex used, we obtain the dielectric constant of the active layer, the conductivity of mobile ions, the transference numbers of electrons and ions, and the thickness of the EDLs, whereas the transient thickness of the p-i-n junction is determined at voltages above the bandgap potential. Most importantly, we find that charge transport is dominated by the ions when carrier injection from the electrodes is prohibited, that ion movement is limited by the presence of transverse internal interfaces and that the width of the intrinsic region constitutes almost 60% of the total active layer thickness in steady state at a low operating voltage.

  6. The performance of magnetic lens for focusing VCN-SANS.

    SciTech Connect (OSTI)

    Yamada, M.; Iwashita, Y.; Kanaya, T.; Ichikawa, M.; Tongu, H.; Kennedy, S. J.; Shimizu, H. M.; Mishima, K.; Yamada, N. L.; Hirota, K.; Carpenter, J..; Lal, J.; Anderson, K.; Geltenbort, P.; Guerard, B.; Manzin, G.; Hino, M.; Kitaguchi, M.; Bleuel, M.; NOP Collaboration

    2011-01-01

    We have developed a prototype rotating-permanent magnet sextupole lens (named rot-PMSx) for more efficient experiments with neutron beams in time of flight (ToF) mode. This lens can modulate the focusing strength over range 1.5 x 10{sup 4} T/m{sup 2} {le} g' {le} 5.9 x 10{sup 4} T/m{sup 2}. Synchronization between the modulation and the beam pulse produces a focused beam without significant chromatic aberration. We anticipate that this lens could be utilized in focusing small angle neutron scattering (SANS) instruments for novel approach to high resolution SANS. We carried out experiments testing the principle of this lens at the very cold neutron (VCN) beamline (PF2) at Institut Laue-Langevin (ILL), France. The focused beam image size at the detector was kept constant at the same beam size as the source ({approx} 3 mm) over a wavelength range of 30 {angstrom} {le} {lambda} {le} 48 {angstrom} in focal length of {approx} 1.14 m. The flux gain was about 12 relative to a beam without focusing, and the depth of focus was quite large. These results show the good performance of this lens and the system. Thereupon we have demonstrated the performance of this test bed for high resolution focusing of VCN-SANS for a well-studied softmatter sample; a deuterium oxide solution of Pluronic F127, an (PEO){sub 100}(PPO){sub 65}(PEO){sub 100} tri-block copolymer in deuterium oxide. The results of the focusing experiment and the focusing VCN-SANS are presented.

  7. Effects of electrolyte salts on the performance of Li-O2 batteries

    SciTech Connect (OSTI)

    Nasybulin, Eduard N.; Xu, Wu; Engelhard, Mark H.; Nie, Zimin; Burton, Sarah D.; Cosimbescu, Lelia; Gross, Mark E.; Zhang, Jiguang

    2013-02-05

    It is well known that the stability of nonaqueous electrolyte is critical for the rechargeable Li-O2 batteries. Although stability of many solvents used in the electrolytes has been investigated, considerably less attention has been paid to the stability of electrolyte salt which is the second major component. Herein, we report the systematic investigation of the stability of seven common lithium salts in tetraglyme used as electrolytes for Li-O2 batteries. The discharge products of Li-O2 reaction were analyzed by X-ray diffraction, X-ray photoelectron spectroscopy and nuclear magnetic resonance spectroscopy. The performance of Li-O2 batteries was strongly affected by the salt used in the electrolyte. Lithium tetrafluoroborate (LiBF4) and lithium bis(oxalato)borate (LiBOB) decompose and form LiF and lithium borates, respectively during the discharge of Li-O2 batteries. Several other salts, including lithium bis(trifluoromethane)sulfonamide (LiTFSI), lithium trifluoromethanesulfonate (LiTf), lithium hexafluorophosphate (LiPF6), lithium perchlorate (LiClO4) , and lithium bromide (LiBr) led to the discharge products which mainly consisted of Li2O2 and only minor signs of decomposition of LiTFSI, LiTf, LPF6 and LiClO4 were detected. LiBr showed the best stability during the discharge process. As for the cycling performance, LiTf and LiTFSI were the best among the studied salts. In addition to the instability of lithium salts, decomposition of tetraglyme solvent was a more significant factor contributing to the limited cycling stability. Thus a more stable nonaqueous electrolyte including organic solvent and lithium salt still need to be further developed to reach a fully reversible Li-O2 battery.

  8. Physics and Engineering Assessments ?of the K-DEMO Magnet Configuration

    SciTech Connect (OSTI)

    Neilson, George H.; Brown, Thomas

    2014-09-01

    Increased attention is being given now to studies of next-step fusion facilities with nuclear missions. Among these, South Korea's K DEMO is unique in its focus on a high toroidal magnetic field, large major radius, steady-state tokamak design for the core of a facility to test fusion nuclear components in Phase I and, after upgrades, produce 500 MW of electricity in a Phase II. Innovative features of the K DEMO magnet set include the use of two toroidal field (TF) coil winding packs with conductor grading and a machine configuration designed for vertical maintenance. The magnet arrangement features large TF coils and widelyspaced poloidal field (PF) coils to accommodate removal of in-vessel components as large modules. Physics and engineering assessments of the pre-conceptual K-DEMO magnet configuration are reported, including: 1) design point and operating space assessment, 2) conductor assessment, and 3) structural assessment. It is found that a reference design point at 6.8 m major radius and 7.4 T toroidal field provides sufficient operating margins for the 500 MWe Phase II mission. Analyses of candidate cable-in-conduit conductors provide predictions of critical current degradation, both in the initial load cycle and an additionally with cyclic loading. A first-pass global analysis of the magnet system found minimal out-of-plane deformations of the TF coil, but an overstress condition in the inner leg of the TF coil. However an analysis taking into account elastic-plastic behavior, frictional sliding, and displacement shows that the structure can safely carry the load. Although the design evolution is still at an early stage, these assessments support the design point choices to date and the expectation that a feasible solution for the high-field K DEMO magnet system can be found.

  9. Waking the sleeping giant: Introducing new heat exchanger technology into the residential air-conditioning marketplace

    SciTech Connect (OSTI)

    Chapp, T.; Voss, M.; Stephens, C.

    1998-07-01

    The Air Conditioning Industry has made tremendous strides in improvements to the energy efficiency and reliability of its product offerings over the past 40 years. These improvement can be attributed to enhancements of components, optimization of the energy cycle, and modernized and refined manufacturing techniques. During this same period, energy consumption for space cooling has grown significantly. In January of 1992, the minimum efficiency requirement for central air conditioning equipment was raised to 10 SEER. This efficiency level is likely to increase further under the auspices of the National Appliance Energy Conservation Act (NAECA). A new type of heat exchanger was developed for air conditioning equipment by Modine Manufacturing Company in the early 1990's. Despite significant advantages in terms of energy efficiency, dehumidification, durability, and refrigerant charge there has been little interest expressed by the air conditioning industry. A cooperative effort between Modine, various utilities, and several state energy offices has been organized to test and demonstrate the viability of this heat exchanger design throughout the nation. This paper will review the fundamentals of heat exchanger design and document this simple, yet novel technology. These experiences involving equipment retrofits have been documented with respect to the performance potential of air conditioning system constructed with PF{trademark} Heat Exchangers (generically referred to as microchannel heat exchangers) from both an energy efficiency as well as a comfort perspective. The paper will also detail the current plan to introduce 16 to 24 systems into an extended field test throughout the US which commenced in the Fall of 1997.

  10. Using the OECD/NRC Pressurized Water Reactor Main Steam Line Break Benchmark to Study Current Numerical and Computational Issues of Coupled Calculations

    SciTech Connect (OSTI)

    Ivanov, Kostadin N.; Todorova, Nadejda K.; Sartori, Enrico

    2003-05-15

    Incorporating full three-dimensional (3-D) models of the reactor core into system transient codes allows for a 'best-estimate' calculation of interactions between the core behavior and plant dynamics. Recent progress in computer technology has made the development of coupled thermal-hydraulic (T-H) and neutron kinetics code systems feasible. Considerable efforts have been made in various countries and organizations in this direction. Appropriate benchmarks need to be developed that will permit testing of two particular aspects. One is to verify the capability of the coupled codes to analyze complex transients with coupled core-plant interactions. The second is to test fully the neutronics/T-H coupling. One such benchmark is the Pressurized Water Reactor Main Steam Line Break (MSLB) Benchmark problem. It was sponsored by the Organization for Economic Cooperation and Development, U.S. Nuclear Regulatory Commission, and The Pennsylvania State University. The benchmark problem uses a 3-D neutronics core model that is based on real plant design and operational data for the Three Mile Island Unit 1 nuclear power plant. The purpose of this benchmark is threefold: to verify the capability of system codes for analyzing complex transients with coupled core-plant interactions; to test fully the 3-D neutronics/T-H coupling; and to evaluate discrepancies among the predictions of coupled codes in best-estimate transient simulations. The purposes of the benchmark are met through the application of three exercises: a point kinetics plant simulation (exercise 1), a coupled 3-D neutronics/core T-H evaluation of core response (exercise 2), and a best-estimate coupled core-plant transient model (exercise 3).In this paper we present the three exercises of the MSLB benchmark, and we summarize the findings of the participants with regard to the current numerical and computational issues of coupled calculations. In addition, this paper reviews in some detail the sensitivity studies on exercises 2 and 3 performed by the benchmark team using the coupled code TRAC-PF1/NEM. The purpose of these supporting studies was to aid participants in developing their models.

  11. Quantification of Electrochemical Nanoscale Processes in Lithium Batteries By OperandoEC-(S)TEM

    SciTech Connect (OSTI)

    Mehdi, Beata L.; Qian, Jiangfeng; Nasybulin, Eduard; Welch, David A.; Park, Chiwoo; Faller, Roland; Mehta, Hardeep S.; Henderson, Wesley A.; Xu, Wu; Evans, James E.; Liu, Jun; Zhang, Jiguang; Mueller, Karl T.; Browning, Nigel D.

    2015-07-27

    Lithium (Li)-ion batteries are currently used for a wide variety of portable electronic devices, electric vehicles and renewable energy applications. In addition, extensive worldwide research efforts are now being devoted to more advanced beyond Li-ion battery chemistries - such as lithium-sulfur (Li-S) and lithium-air (Li-O2) - in which the carbon anode is replaced with Li metal. However, the practical application of Li metal anode systems has been highly problematic. The main challenges involve controlling the formation of a solid-electrolyte interphase (SEI) layer and the suppression of Li dendrite growth during the charge/discharge process (achieving dendrite-free cycling). The SEI layer formation continuously consumes the electrolyte components creating highly resistive layer, which leads to the rapid decrease of cycling performance and degradation of the Li anode. The growth of Li metal dendrites at the anode contributes to rapid capacity fading (the presence of dead Li created during the discharge leads to an increased overpotential) and, in the case of continuous growth, leads to internal short circuits and extreme safety issues. Here we demonstrate the application of an operando electrochemical scanning transmission electron microscopy (ec-(S)TEM) cell to study the SEI layer formation and the initial stages of Li dendrite growth - the goal is to develop a mechanism for mitigating the degradation processes and increasing safety. Bright field (BF) STEM images in Figure 1 A-C show Li metal deposition and dissolution processes at the interface between the Pt working electrode and the lithium hexafluorophosphate (LiPF6) in propylene carbonate (PC) electrolyte during three charge/discharge cycles. A contrast reversal caused by Li metal being lighter/less dense than surrounding electrolyte (Li appears brighter than the background in BF STEM images) allows Li to be uniquely identified from the other components in the system - the only solid material that is less dense than the electrolyte is Li metal. Using these images, we can precisely quantify the total volume of Li deposition, the thickness of the SEI layer (observed as a ring of positive contrast around the electrode) and alloy formation due to Li+ ion insertion during each cycle. Furthermore, at the end of each discharge cycle we can quantify the presence of dead Li detached from the Pt electrode, thereby demonstrating the degree of irreversibility (and degradation of Pt electrode) associated with insertion/removal of Li+during this process with direct correlation to electrochemical performance. Such analyses provide significant insights into Li metal dendrite growth, which is critical to understand the complex interfacial reactions needed to be controlled for future Li-based and next generation energy storage systems.

  12. InP quantum dots: Electronic structure, surface effects, and the redshifted emission

    SciTech Connect (OSTI)

    Fu, H.; Zunger, A.

    1997-07-01

    We present pseudopotential plane-wave electronic-structure calculations on InP quantum dots in an effort to understand quantum confinement and surface effects and to identify the origin of the long-lived and redshifted luminescence. We find that (i) unlike the case in small GaAs dots, the lowest unoccupied state of InP dots is the {Gamma}{sub 1c}-derived direct state rather than the X{sub 1c}-derived indirect state and (ii) unlike the prediction of {bold k}{center_dot}{bold p} models, the highest occupied state in InP dots has a 1sd-type envelope function rather than a (dipole-forbidden) 1pf envelope function. Thus explanations (i) and (ii) to the long-lived redshifted emission in terms of an orbitally forbidden character can be excluded. Furthermore, (iii) fully passivated InP dots have no surface states in the gap. However, (iv) removal of the anion-site passivation leads to a P dangling bond (DB) state just above the valence band, which will act as a trap for photogenerated holes. Similarly, (v) removal of the cation-site passivation leads to an In dangling-bond state below the conduction band. While the energy of the In DB state depends only weakly on quantum size, its radiative lifetime increases with quantum size. The calculated {approximately}300-meV redshift and the {approximately}18 times longer radiative lifetime relative to the dot-interior transition for the 26-{Angstrom} dot with an In DB are in good agreement with the observations of full-luminescence experiments for unetched InP dots. Yet, (vi) this type of redshift due to surface defect is inconsistent with that measured in {ital selective} excitation for HF-etched InP dots. (vii) The latter type of ({open_quotes}resonant{close_quotes}) redshift is compatible with the calculated {ital screened} singlet-triplet splitting in InP dots, suggesting that the slow emitting state seen in selective excitation could be a triplet state. {copyright} {ital 1997} {ital The American Physical Society}

  13. PLUTONIUM METALLOGRAPHY AT LOS ALAMOS

    SciTech Connect (OSTI)

    PEREYRA, RAMIRO A.; LOVATO, DARRYL

    2007-01-08

    From early days of the Manhattan program to today, scientists and engineers have continued to investigate the metallurgical properties of plutonium (Pu). Although issues like aging was not a concern to the early pioneers, today the reliability of our aging stockpile is of major focus. And as the country moves toward a new generation of weapons similar problems that the early pioneers faced such as compatibility, homogeneity and malleability have come to the forefront. And metallography will continue to be a principle tool for the resolution of old and new issues. Standard metallographic techniques are used for the preparation of plutonium samples. The samples are first cut with a slow speed idamond saw. After mounting in Epon 815 epoxy resin, the samples are ground through 600 grit silicon carbide paper. PF 5070 (a Freon substitute) is used as a coolant, lubricant, and solvent for most operations. Rough mechanical polished is done with 9-{mu} diamond using a nap less cloth, for example nylon or cotton. Final polish is done with 1-{mu} diamond on a nappy cloth such as sylvet. Ethyl alcohol is then used ultrasonically to clean the samples before electro polishing. The sample is then electro-polished and etched in an electrolyte containing 10% nitric acid, and 90% dimethyleneformalmide. Ethyl alcohol is used as a final cleaning agent. Although standard metallographic preparation techniques are used, there are several reasons why metallography of Pu is difficult and challenging. Firstly, because of the health hazards associated with its radioactive properties, sample preparation is conducted in glove boxes. Figure 1 shows the metallography line, in an R and D facility. Since they are designed to be negative in pressure to the laboratory, cross-contamination of abrasives is a major problem. In addition, because of safety concerns and waste issues, there is a limit to the amount of solvent that can be used. Secondly, Pu will readily hydride or oxidize when in contact with metallographic polishing lubricants, solvents, or chemicals. And water being one of the most reactive solutions, is not used in the preparation. Figure 2 shows an example of a plutonium sample in which an oxide film has formed on the surface due to overexposure to solutions. it has been noted that nucleation of the hydride/oxide begins around inclusions and samples with a higher concentration of impurities seem to be more susceptible to this reaction. Figure 3 shows examples of small oxide rings, forming around inclusions. Lastly, during the cutting, grinding, or polishing process there is enough stress induced in the sample that the surface can transform from the soft face-centered-cubic delta phase (30 HV) to the strain-induced monoclinic alpha{prime} phase (300 HV). Figure 4 and 5 shows cross-sectional views of samples in which one was cut using a diamond saw and the other was processed through 600 grit. The white layers on the edges is the strain induced alpha{prime} phase. The 'V' shape indentation in Figure 5 was caused by a coarser abrasive which resulted in transformations to a depth of approximately 20 {micro}m. Another example of the transformation sensitivity of plutonium can be seen in Figure 6, in which the delta phase has partly transformed to alpha{prime} during micro hardness indentation.

  14. A BRIEF DESCRIPTION OF THE SMALL-SCALE SAFETY TESTING SYSTEMS AT LAWRENCE LIVERMORE NATIONAL LABORATORY

    SciTech Connect (OSTI)

    HSU, P C

    2008-07-31

    Small-scale sensitivity testing is important for determining material response to various stimuli including impact, friction, and static spark. These tests, briefly described below, provide parameters for safety in handling. ERL Type 12 drop hammer equipment at LLNL, shown in Figure 1, was used to determine the impact sensitivity. The equipment includes a 2.5-kg drop weight, a striker (upper anvil, 2.5 kg for solid samples and 1.0 kg for liquid samples), a bottom anvil, a microphone sensor, and a peakmeter. For each drop, sample (35 mg for solid or 45 microliter for liquid) is placed on the bottom anvil surface and impacted by the drop weight from different heights. Signs of reactions upon impact are observed and recorded. These signs include noises, flashes or sparks, smoke, pressure, gas emissions, temperature rise due to exothermic reaction, color change of the sample, and changes to the anvil surface (noted by inspection). For solid samples, a 'GO' was defined as a microphone sensor (for noise detection) response of {ge} 1.3 V as measured by a peakmeter. The higher the DH{sub 50} values, the lower the impact sensitivity. The method used to calculate DH{sub 50} values is the 'up and down' or Bruceton method. PETN and RDX have impact sensitivities of 15 and 35 cm, respectively. TATB has impact sensitivity more than 177 cm. For liquid samples, a 'GO' was determined by the noise levels as measured by the peakmeter, appearance of flashes, temperature rise of the anvil, and visual inspection of the anvil surface. Two liquid samples TMETN and FEFO have impact sensitivities of 14 and 32 cm, respectively. Figure 2 shows a 'GO' event observed during the impact sensitivity test; flashes appeared as the drop weight impacted the sample. A BAM friction sensitivity test machine, as shown in Figure 3, was used to determine the frictional sensitivity. The system uses a fixed porcelain pin and a movable porcelain plate that executes a reciprocating motion. Weight affixed to a torsion arm allows for a variation in applied force between 0.5 kg to 36.0 kg. The relative measure of the frictional sensitivity of a material is based upon the smallest load (kg) at which reaction occurs for a 1-in-10 series of attempts. The lower the load values, the higher the frictional sensitivity. PETN has a frictional sensitivity of 6.4 kg. The static spark machine at LLNL is used to evaluate the electrostatic discharge hazards (human ESD) associated with the handling of explosives. The machine was custom-built almost 30 years ago and consists of a capacitor bank (up to 20,000 pF), a voltage meter, and a discharge circuit, as shown in Figure 4. An adjustable resistor up to 510 ohms (chosen to simulate human body) is wired to the discharge circuit. A 5-mg sample is placed in a Teflon washer sealed to a steel disc and covered with a Mylar tape. High static voltage (up to 10 kv) is applied and discharged to the sample. Evidence of reaction is judged from the condition of Mylar tape, smokes, and color change of the sample. Voltage, capacitance, and resistance can be adjusted to achieve the desired static energy. The results obtained are expressed as a zero in 10 or one-in-ten at a specific voltage and joules. One reaction in ten trials at {le} 0.25 joules is considered spark-sensitive. Primary explosives show reaction at 0.1 joule.

  15. The activation of carbon dioxide by niobocene complexes

    SciTech Connect (OSTI)

    Fu, P.F.

    1993-01-01

    The reduction of Cp[prime][sub 2]Nb(Cl)R (Cp[prime] = [eta][sup 5]-C[sub 5]H[sub 4]CH[sub 3]) by Na/Hg under one atmosphere of CO[sub 2] produces Cp[prime][sub 2]Nb([eta][sup 2]-CO[sub 2])R (R = CH[sub 2]SiMe[sub 3], CH[sub 2]CMe[sub 3], CH[sub 2]Ph, CH[sub 3]). Thermolysis of Cp [sub 2]Nb([eta][sup 2]-CO[sub 2])R (R = CH[sub 2]SiMe[sub 3], CH[sub 2]CMe[sub 3], CH[sub 2]Ph) in THF at 60[degrees]C (at low concentration for R = CH[sub 2]Ph) resulted in decarbonylation of the complex with first order kinetics to generate the corresponding metal-oxo complexes Cp[prime][sub 2]Nb(O)R. The same process is greatly accelerated photochemically with a quantum yield of 0.17 for R = CH[sub 2]SiMe[sub 3]. At higher concentration, carbonyl complex Cp[prime][sub 2]Nb(CO)Ch[sub 2]Ph is also generated in the thermolysis of Cp[prime][sub 2]Nb([eta][sup 2]-CO[sub 2])CH[sub 2]Ph. In continuing effort to promote migratory insertion of Cp[prime][sub 2]Nb([eta][sup 2]-CO[sub 2])CH[sub 2]SiMe[sub 3], its reactions with of a variety of Lewis acids (LiPF[sub 6], BF[sub 3][center dot]Et[sub 2]O, ZnCl[sub 2], HgCl[sub 2], CdCl[sub 2], and ClSiMe[sub 3]) have been investigated. The interaction of Cp[prime][sub 2]Nb([eta][sup 2]-CO[sub 2])CH[sub 2]SiMe[sub 3] with several Lewis acids resulted in its facile decarbonylation. The carbonyl complexes Cp[prime][sub 2]Nb(CO)R (R = CH[sub 2]SiMe[sub 3], CH[sub 2]CMe[sub 3], CH[sub 2]Ph, CH[sub 3]) reacted cleanly and quantitatively with molecular oxygen under ambient conditions to produce the corresponding CO[sub 2] complexes, Cp[prime][sub 2]Nb([eta][sup 2]-CO[sub 2])R, in high yield. The interaction of Cp[prime][sub 2]Nb(CO)H with O[sub 2] generates a novel formato complex. The reaction of Cp[prime][sub 2]Nb(CO)CH[sub 2]SiMe[sub 3] with elemental sulfur (S[sub 8]) gives a carbonyl sulfide complex Cp[prime][sub 2]Nb([eta][sup 2]-CSO) CH[sub 2]SiMe[sub 3], whose structure has been established crystallographically.

  16. High Temperature Integrated Thermoelectric Ststem and Materials

    SciTech Connect (OSTI)

    Mike S. H. Chu

    2011-06-06

    The final goal of this project is to produce, by the end of Phase II, an all ceramic high temperature thermoelectric module. Such a module design integrates oxide ceramic n-type, oxide ceramic p-type materials as thermoelectric legs and oxide ceramic conductive material as metalizing connection between n-type and p-type legs. The benefits of this all ceramic module are that it can function at higher temperatures (> 700 C), it is mechanically and functionally more reliable and it can be scaled up to production at lower cost. With this all ceramic module, millions of dollars in savings or in new opportunities recovering waste heat from high temperature processes could be made available. A very attractive application will be to convert exhaust heat from a vehicle to reusable electric energy by a thermoelectric generator (TEG). Phase I activities were focused on evaluating potential n-type and p-type oxide compositions as the thermoelectric legs. More than 40 oxide ceramic powder compositions were made and studied in the laboratory. The compositions were divided into 6 groups representing different material systems. Basic ceramic properties and thermoelectric properties of discs sintered from these powders were measured. Powders with different particles sizes were made to evaluate the effects of particle size reduction on thermoelectric properties. Several powders were submitted to a leading thermoelectric company for complete thermoelectric evaluation. Initial evaluation showed that when samples were sintered by conventional method, they had reasonable values of Seebeck coefficient but very low values of electrical conductivity. Therefore, their power factors (PF) and figure of merits (ZT) were too low to be useful for high temperature thermoelectric applications. An unconventional sintering method, Spark Plasma Sintering (SPS) was determined to produce better thermoelectric properties. Particle size reduction of powders also was found to have some positive benefits. Two composition systems, specifically 1.0 SrO - 0.8 x 1.03 TiO2 - 0.2 x 1.03 NbO2.5 and 0.97 TiO2 - 0.03 NbO2.5, have been identified as good base line compositions for n-type thermoelectric compositions in future module design. Tests of these materials at an outside company were promising using that company's processing and material expertise. There was no unique p-type thermoelectric compositions identified in phase I work other than several current cobaltite materials. Ca3Co4O9 will be the primary p-type material for the future module design until alternative materials are developed. BaTiO3 and rare earth titanate based dielectric compositions show both p-type and n-type behavior even though their electrical conductivities were very low. Further research and development of these materials for thermoelectric applications is planned in the future. A preliminary modeling and optimization of a thermoelectric generator (TEG) that uses the n-type 1.0 SrO - 1.03 x 0.8 TiO2 - 1.03 x 0.2 NbO2.5 was performed. Future work will combine development of ceramic powders and manufacturing expertise at TAM, development of SPS at TAM or a partner organization, and thermoelectric material/module testing, modeling, optimization, production at several partner organizations.