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Sample records for bg bu cn

  1. Cn

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

    Cn 112 113 115 118 Periodic T able o f E lements 2 014 117 Fl 114 Lv 116 Super---Heavy N uclei, T heoreAcal C hallenges Witold Nazarewicz MSU/ORNL International Symposium on Superheavy Nuclei 2015Texas A&M University, March 31-April 2, 2015 * Science drivers (why should we care?) * Overview of the current situation in SHN/SHE theory (2-year progress report) * Extrapolations * Perspectives Two years after: TAMU Workshop, March 12-13, 2013 The Nuclear Landscape and the Big Questions (NAS

  2. BG Capital | Open Energy Information

    Open Energy Info (EERE)

    BG Capital Jump to: navigation, search Name: BG-Capital Place: Spain Zip: 8860 Product: BG-capital designs, installs and invests in PV medium scale (100-500kW) systems,...

  3. Solar BG | Open Energy Information

    Open Energy Info (EERE)

    BG - 1784 Sector: Wind energy Product: Bulgarian based company investing into hybrid wind-PV plants. References: Solar BG1 This article is a stub. You can help OpenEI by...

  4. NREL: Biomass Research - Lintao Bu

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

    Lintao Bu Photo of Lintao Bu Lintao Bu is a staff scientist at the National Renewable Energy Laboratory's National Bioenergy Center. Education Ph.D., Computational Chemistry, Boston University, 1999-2004 M.S., Physical Chemistry, Peking University, 1996-1999 B.S., Chemistry, Peking University, 1991-1996 Professional Experience Research Scientist, National Renewable Energy Laboratory, National Bioenergy Center, Golden, CO, 2008-present Postdoctoral Researcher, National Renewable Energy

  5. Biomass Gas Electric LLC BG E | Open Energy Information

    Open Energy Info (EERE)

    Gas Electric LLC BG E Jump to: navigation, search Name: Biomass Gas & Electric LLC (BG&E) Place: Norcross, Georgia Zip: 30092 Sector: Biomass Product: Project developer...

  6. SF6432-CN Construction

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

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

  7. SF6432-CN

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

    Department Release Date: 11/17/15 Page 1 of 28 Printed copies of this document are uncontrolled. Retrieve latest version electronically. SANDIA CORPORATION SF 6432-CN (11/2015) Section II STANDARD TERMS AND CONDITIONS FOR FIRM-FIXED PRICE COMMERCIAL CONSTRUCTION CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY SUPPLEMENTED OR AMENDED IN WRITING IN THE COVER PAGE OR SECTION I. (CTRL+CLICK ON A LINK BELOW

  8. SF6432-CN

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

    CN (04/2015) Section II STANDARD TERMS AND CONDITIONS FOR FIRM-FIXED PRICE COMMERCIAL CONSTRUCTION CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY SUPPLEMENTED OR AMENDED IN WRITING IN THE COVER PAGE OR SECTION I. (CTRL+CLICK ON A LINK BELOW TO ADVANCE DIRECTLY TO THAT SECTION) ACCEPTANCE OF TERMS AND CONDITIONS (Ts&Cs) APPLICABLE LAW ASSIGNMENT AUTHORIZED DISTRIBUTORS BANKRUPTCY CANCELLATION OR

  9. SF6432-CN Construction

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

    7/31/13 Page 1 of 31 Printed copies of this document are uncontrolled. Retrieve latest version electronically. SANDIA CORPORATION SF 6432-CN (07/2013) Section II STANDARD TERMS AND CONDITIONS FOR FIRM-FIXED PRICE COMMERCIAL CONSTRUCTION CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY SUPPLEMENTED OR AMENDED IN WRITING IN THE COVER PAGE OR SECTION I. (CTRL+CLICK ON A LINK BELOW TO ADVANCE DIRECTLY TO

  10. Haskel/BuTech/PPI | Department of Energy

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

    Haskel/BuTech/PPI Haskel/BuTech/PPI This presentation was given at the DOE Hydrogen Compression, Storage, and Dispensing Workshop in March 2013. PDF icon csd_workshop_5_walti.pdf More Documents & Publications DOE-HDBK-1018/2-93 Improving Compressed Air System Performance: A Sourcebook for Industry BNL Compressed Natural Gas Release Investigation

  11. CnLrJGD

    Office of Legacy Management (LM)

    l&o-1760 CnLrJGD 8CURCEN4%4UALLfCE!8SE Licenee Bo. c-3862 tnted: J. T. Baker Chemical Compfuq Phillipsburg, New Jersey Attention: Mr. Joseph L. MetcenQrf Osntlewn: Rvsunnt to the Attalc &orgy Act of 1954 au4 Section 40.21 of t& &&e of Federal Negulationr, Title 10 Control of &urea Matsrial, -Atomic !Znergy, Chapter 1, part40 - P me hereby llc need to nc lve poere of and title to up to one ld ogrem of urai~~ t t&SIG gradef for use slou R etndier on the pmparatlon of

  12. CN Solar Co Ltd | Open Energy Information

    Open Energy Info (EERE)

    CN Solar Co Ltd Jump to: navigation, search Name: CN Solar Co Ltd Place: Sangju, North Gyeongsang, Korea (Republic) Sector: Solar Product: Korean solar project developer....

  13. Example Program and Makefile for BG/Q | Argonne Leadership Computing

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

    Facility Overview of How to Compile and Link Example Program and Makefile for BG/Q How to Manage Threading bgclang Compiler Compiling and Linking FAQ Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Example Program and Makefile for BG/Q

  14. Job Scheduling Policy for BG/Q Systems | Argonne Leadership Computing

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

    Facility Policy for BG/Q Systems Contents Mira Job Scheduling Mira Queues User Interface Backfill Queue INCITE/ALCC Overburn Policy Big Run Monday Cetus Job Scheduling Vesta Job Scheduling General Scheduling Guidelines System Maintenance Day Jobs on Hold Reservations Back to top Mira Job Scheduling queue layout Back to top Mira Queues User Queue Queue Nodes Wall-clock Time (hours) Maximum Running per User Maximum Queued Per User prod prod-short 512 - 4096 0 - ≤6 5 20 prod-long 512 - 4096

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

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

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

  16. BuD, a helixloophelix DNA-binding domain for genome modification

    SciTech Connect (OSTI)

    Stella, Stefano; Molina, Rafael; Lpez-Mndez, Blanca; Juillerat, Alexandre; Bertonati, Claudia; Daboussi, Fayza; Campos-Olivas, Ramon; Duchateau, Phillippe; Montoya, Guillermo

    2014-07-01

    Crystal structures of BurrH and the BurrHDNA complex are reported. DNA editing offers new possibilities in synthetic biology and biomedicine for modulation or modification of cellular functions to organisms. However, inaccuracy in this process may lead to genome damage. To address this important problem, a strategy allowing specific gene modification has been achieved through the addition, removal or exchange of DNA sequences using customized proteins and the endogenous DNA-repair machinery. Therefore, the engineering of specific proteinDNA interactions in protein scaffolds is key to providing toolkits for precise genome modification or regulation of gene expression. In a search for putative DNA-binding domains, BurrH, a protein that recognizes a 19 bp DNA target, was identified. Here, its apo and DNA-bound crystal structures are reported, revealing a central region containing 19 repeats of a helixloophelix modular domain (BurrH domain; BuD), which identifies the DNA target by a single residue-to-nucleotide code, thus facilitating its redesign for gene targeting. New DNA-binding specificities have been engineered in this template, showing that BuD-derived nucleases (BuDNs) induce high levels of gene targeting in a locus of the human haemoglobin ? (HBB) gene close to mutations responsible for sickle-cell anaemia. Hence, the unique combination of high efficiency and specificity of the BuD arrays can push forward diverse genome-modification approaches for cell or organism redesign, opening new avenues for gene editing.

  17. B.U. Students Talk Energy Research at Lost Dog Cafe > Archived News Stories

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

    > The Energy Materials Center at Cornell Archived News Stories Latest News The perfect atom sandwich requires an extra layer › Cornell boasts 22 'highly cited' researchers › Postdoc brings open access issue to the table › In This Section EMC2 News Archived News Stories B.U. Students Talk Energy Research at Lost Dog Cafe April 10th, 2014 › There was a science café at the Lost Dog Cafe in Binghamton last night. A group of Binghamton University students and professors talked about

  18. FBP-ER-RIFS-BG-PLN-0036 Rev. 6 1 DOE/PPPO/03-0383&D4

    Office of Environmental Management (EM)

    BG-PLN-0036 Rev. 6 1 DOE/PPPO/03-0383&D4 Aerial photo of the Portsmouth Gaseous Diffusion Plant, showing the approximate 1,000-acre industrialized area within Perimeter Road PUBLIC COMMENT PERIOD NOVEMBER 12, 2014 TO JANUARY 10, 2015 HOW YOU CAN PARTICIPATE Read this Proposed Plan and review related documents in the Administrative Record. Comment on this Proposed Plan by mail, email, phone, or fax to: Ms. Kristi Wiehle Department of Energy P.O. Box 370 Piketon, Ohio 45661 Email:

  19. SF6432-CN (02-02-12) Construction

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

    Fixed Price Commercial Construction Contracts Owner: Procurement Policy & Quality Dept Release Date: 02/01/12 Page 1 of 27 Printed copies of this document are uncontrolled. Retrieve latest version electronically. SANDIA CORPORATION SF 6432-CN (02/01/12) Section II STANDARD TERMS AND CONDITIONS FOR FIRM-FIXED PRICE COMMERCIAL CONSTRUCTION CONTRACTS THE FOLLOWING CLAUSES APPLY TO THIS CONTRACT AS INDICATED UNLESS SPECIFICALLY DELETED, OR EXCEPT TO THE EXTENT THEY ARE SPECIFICALLY SUPPLEMENTED

  20. trans-K3[TcO2(CN)4

    SciTech Connect (OSTI)

    Chatterjee, Sayandev; Del Negro, Andrew S.; Edwards, Matthew K.; Twamley, Brendan; Krause, Jeanette A.; Bryan, Samuel A.

    2010-07-14

    The dioxotetracyanotechnetate anion, [TcO2(CN)4]3-, of the title complex has octahedral symmetry. The technetium is located on a center of inversion and is bound by two oxygen atoms and four cyano ligands. The Tc?O bond distance of 1.7721 (12) is consistent with double bond character. The potassium cations [located on special (1/2,0,1) and general positions] reside in octahedral or tetrahedral environments; interionic KO and KN interactions occur in the 2.7877 (19)-2.8598 (15) range.

  1. DOE Hydrogen and Fuel Cells Program Record #13007: Industry Deployed Fuel Cell Backup Power (BuP)

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

    7 Date: 09/05/2013 Title: Industry Deployed Fuel Cell Backup Power (BuP) Originators: Pete Devlin, Jim Alkire, Sara Dillich, Dimitrios Papageorgopoulos Approved by: Rick Farmer and Sunita Satyapal Date: 09/09/13 Item: Table 1: Number of fuel cells deployments (current and planned) for applications in backup power. The funding of 903 Department of Energy (DOE) fuel cell backup power systems has led to over 3,500 industry installations and on-order backup power units with no DOE funding.

  2. IAEA-CN-94/EX/C4-6

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

    IAEA-CN-94/EX/C4-6 1 Core Fluctuations and Current Profile Dynamics in the MST Reversed-Field Pinch D.L. Brower 1), W.X. Ding 1), J. Lei 2), J.K. Anderson 3), T.M. Biewer 3), B.E. Chapman 3), K.A. Connor 2), D. Craig 3), D.R. Demers 2), C.B. Forest 3), D. Holly 3), R. O'Connell 3), S.C. Prager 3), J.S. Sarff 3), P.M. Schoch 2), S.D. Terry 1), J.C. Wright 3) 1) Electrical Engineering Department, University of California at Los Angeles, Los Angeles, California USA 2) Electrical, Computer and

  3. Au133(SPh-tBu)52 Nanomolecules: X-ray Crystallography, Optical, Electrochemical, and Theoretical Analysis

    SciTech Connect (OSTI)

    Dass, Amala; Theivendran, Shevanuja; Nimmala, Praneeth Reddy; Kumara, Chanaka; Jupally, Vijay Reddy; Fortunelli, Alessandro; Sementa, Luca; Barcaro, Giovanni; Zuo, Xiaobing; Noll, Bruce C.

    2015-04-15

    Crystal structure determination has revolutionized modern science in biology, chemistry, and physics. However, the difficulty in obtaining periodic crystal lattices which are needed for X-ray crystal analysis has hindered the determination of atomic structure in nanomaterials, known as the nanostructure problem. Here, by using rigid and bulky ligands, we have overcome this limitation and successfully solved the X-ray crystallographic structure of the largest reported thiolated gold nanomolecule, Au133S52. The total composition, Au133(SPh-tBu)52, was verified using high resolution electrospray ionization mass spectrometry (ESI-MS). The experimental and simulated optical spectra show an emergent surface plasmon resonance that is more pronounced than in the slightly larger Au144(SCH2CH2Ph)60. Theoretical analysis indicates that the presence of rigid and bulky ligands is the key to the successful crystal formation.

  4. Pressure Build-Up During the Fire Test in Type B(U) Packages Containing Water - 13280

    SciTech Connect (OSTI)

    Feldkamp, Martin; Nehrig, Marko; Bletzer, Claus; Wille, Frank

    2013-07-01

    The safety assessment of packages for the transport of radioactive materials with content containing liquids requires special consideration. The main focus is on water as supplementary liquid content in Type B(U) packages. A typical content of a Type B(U) package is ion exchange resin, waste of a nuclear power plant, which is not dried, normally only drained. Besides the saturated ion exchange resin, a small amount of free water can be included in these contents. Compared to the safety assessment of packages with dry content, attention must be paid to some more specific issues. An overview of these issues is provided. The physical and chemical compatibility of the content itself and the content compatibility with the packages materials must be demonstrated for the assessment. Regarding the mechanical resistance the package has to withstand the forces resulting from the freezing liquid. The most interesting point, however, is the pressure build-up inside the package due to vaporization. This could for example be caused by radiolysis of the liquid and must be taken into account for the storage period. If the package is stressed by the total inner pressure, this pressure leads to mechanical loads to the package body, the lid and the lid bolts. Thus, the pressure is the driving force on the gasket system regarding the activity release and a possible loss of tightness. The total pressure in any calculation is the sum of partial pressures of different gases which can be caused by different effects. The pressure build-up inside the package caused by the regulatory thermal test (30 min at 800 deg. C), as part of the cumulative test scenario under accident conditions of transport is discussed primarily. To determine the pressure, the temperature distribution in the content must be calculated for the whole period from beginning of the thermal test until cooling-down. In this case, while calculating the temperature distribution, conduction and radiation as well as evaporation and condensation during the associated process of transport have to be considered. This paper discusses limiting amounts of water inside the cask which could lead to unacceptable pressure and takes into account saturated steam as well as overheated steam. However, the difficulties of assessing casks containing wet content will be discussed. From the authority assessment point of view, drying of the content could be an effective way to avoid the above described pressure build-up and the associated difficulties for the safety assessment. (authors)

  5. Reactions of the CN Radical with Benzene and Toluene: Product Detection and Low-Temperature Kinetics

    SciTech Connect (OSTI)

    Trevitt, Adam J.; Goulay, Fabien; Taatjes, Craig A.; Osborn, David L.; Leone, Stephen R.

    2009-12-23

    Low temperature rate coefficients are measured for the CN + benzene and CN + toluene reactions using the pulsed Laval nozzle expansion technique coupled with laser-induced fluorescence detection. The CN + benzene reaction rate coefficient at 105, 165 and 295 K is found to be relatively constant over this temperature range, 3.9 - 4.9 x 10-10 cm3 molecule-1 s-1. These rapid kinetics, along with the observed negligible temperature dependence, are consistent with a barrierless reaction entrance channel and reaction efficiencies approaching unity. The CN + toluene reaction is measured to have a slower rate coefficient of 1.3 x 10-10 cm3 molecule-1 s-1 at 105 K. At room temperature, non-exponential decay profiles are observed for this reaction that may suggest significant back-dissociation of intermediate complexes. In separate experiments, the products of these reactions are probed at room temperature using synchrotron VUV photoionization mass spectrometry. For CN + benzene, cyanobenzene (C6H5CN) is the only product recorded with no detectable evidence for a C6H5 + HCN product channel. In the case of CN + toluene, cyanotoluene (NCC6H4CH3) constitutes the only detected product. It is not possible to differentiate among the ortho, meta and para isomers of cyanotoluene because of their similar ionization energies and the ~;; 40 meV photon energy resolution of the experiment. There is no significant detection of benzyl radicals (C6H5CH2) that would suggest a H-abstraction or a HCN elimination channel is prominent at these conditions. As both reactions are measured to be rapid at 105 K, appearing to have barrierless entrance channels, it follows that they will proceed efficiently at the temperatures of Saturn?s moon Titan (~;;100 K) and are also likely to proceed at the temperature of interstellar clouds (10-20 K).

  6. Dynamics of CN+alkane reactions by crossed-beam dc slice imaging

    SciTech Connect (OSTI)

    Huang Cunshun; Li Wen; Estillore, Armando D.; Suits, Arthur G.

    2008-08-21

    The hydrogen atom abstraction reactions of CN (X {sup 2}{sigma}{sup +}) with alkanes have been studied using the crossed molecular beam technique with dc slice ion imaging at collision energies of 7.5 and 10.8 kcal/mol. The product alkyl radical images were obtained via single photon ionization at 157 nm for the reactions of CN (X {sup 2}{sigma}{sup +}) with n-butane, n-pentane, n-hexane, and cyclohexane. From analysis of the images, we obtained the center-of-mass frame product angular distributions and translational energy distributions directly. The results indicate that the products are largely backscattered and that most of the available energy ({approx}80%-85%) goes to the internal energy of the products. The reaction dynamics is discussed in light of recent kinetics data, theoretical calculations, and results for related halogen and oxygen atom reactions.

  7. DETECTION OF FeCN (X {sup 4}{Delta}{sub i} ) IN IRC+10216: A NEW INTERSTELLAR MOLECULE

    SciTech Connect (OSTI)

    Zack, L. N.; Halfen, D. T.; Ziurys, L. M.

    2011-06-01

    A new interstellar molecule, FeCN (X {sup 4}{Delta}{sub i} ), has been detected in the envelope of the carbon-rich asymptotic giant branch star, IRC+10216. This work is the first definitive detection of an iron-bearing molecule in the interstellar medium and is based on newly measured rest frequencies. Eight successive rotational transitions of this linear free radical in the lowest spin ladder, {Omega} = 7/2, were observed at 2 and 3 mm using the Arizona Radio Observatory (ARO) 12 m telescope. Three transitions appear as single, unblended features at the 1-2 mK level and exhibit characteristic IRC+10216 line profiles; one had previously been observed with the IRAM 30 m telescope. Two other transitions are partially blended, but exhibit distinct emission at the FeCN frequencies. The remaining transitions are either completely contaminated, or are too high in energy. Comparison of the ARO and IRAM data suggests a source size for FeCN of {approx}30'' in IRC+10216, indicating an outer shell distribution, as expected for a free radical. The column density derived for FeCN is N{sub tot} = 8.6 x 10{sup 11} cm{sup -2} with a rotational temperature of T{sub rot} = 21 K. The fractional abundance of this molecule is [FeCN]/[H{sub 2}] {approx} 2-7 x 10{sup -10}-comparable to that of MgCN and KCN in IRC+10216. FeCN is likely formed by gas-phase reactions of Fe{sup +} or neutral iron; the latter has a significant gas-phase abundance in the outer shell. The detection of FeCN is further evidence that metal cyanides/isocyanides dominate the chemistry of refractory elements in IRC+10216.

  8. Anticancer effect of genistein on BG-1 ovarian cancer growth induced by 17 ?-estradiol or bisphenol A via the suppression of the crosstalk between estrogen receptor alpha and insulin-like growth factor-1 receptor signaling pathways

    SciTech Connect (OSTI)

    Hwang, Kyung-A; Park, Min-Ah; Kang, Nam-Hee; Yi, Bo-Rim; Hyun, Sang-Hwan; Jeung, Eui-Bae; Choi, Kyung-Chul

    2013-11-01

    The interaction between estrogen receptor (ER) and insulin-like growth factor-1 receptor (IGF-1R) signaling pathway plays an important role in proliferation of and resistance to endocrine therapy to estrogen dependent cancers. Estrogen (E2) upregulates the expression of components of IGF-1 system and induces the downstream of mitogenic signaling cascades via phosphorylation of insulin receptor substrate-1 (IRS-1). In the present study, we evaluated the xenoestrogenic effect of bisphenol A (BPA) and antiproliferative activity of genistein (GEN) in accordance with the influence on this crosstalk. BPA was determined to affect this crosstalk by upregulating mRNA expressions of ER? and IGF-1R and inducing phosphorylation of IRS-1 and Akt in protein level in BG-1 ovarian cancer cells as E2 did. In the mouse model xenografted with BG-1 cells, BPA significantly increased a tumor burden of mice and expressions of ER?, pIRS-1, and cyclin D1 in tumor mass compared to vehicle, indicating that BPA induces ovarian cancer growth by promoting the crosstalk between ER and IGF-1R signals. On the other hand, GEN effectively reversed estrogenicity of BPA by reversing mRNA and protein expressions of ER?, IGF-1R, pIRS-1, and pAkt induced by BPA in cellular model and also significantly decreased tumor growth and in vivo expressions of ER?, pIRS-1, and pAkt in xenografted mouse model. Also, GEN was confirmed to have an antiproliferative effect by inducing apoptotic signaling cascades. Taken together, these results suggest that GEN effectively reversed the increased proliferation of BG-1 ovarian cancer by suppressing the crosstalk between ER? and IGF-1R signaling pathways upregulated by BPA or E2.

  9. Concurrent Collections (CnC): A new approach to parallel programming

    ScienceCinema (OSTI)

    None

    2011-10-06

    A common approach in designing parallel languages is to provide some high level handles to manipulate the use of the parallel platform. This exposes some aspects of the target platform, for example, shared vs. distributed memory. It may expose some but not all types of parallelism, for example, data parallelism but not task parallelism. This approach must find a balance between the desire to provide a simple view for the domain expert and provide sufficient power for tuning. This is hard for any given architecture and harder if the language is to apply to a range of architectures. Either simplicity or power is lost. Instead of viewing the language design problem as one of providing the programmer with high level handles, we view the problem as one of designing an interface. On one side of this interface is the programmer (domain expert) who knows the application but needs no knowledge of any aspects of the platform. On the other side of the interface is the performance expert (programmer or program) who demands maximal flexibility for optimizing the mapping to a wide range of target platforms (parallel / serial, shared / distributed, homogeneous / heterogeneous, etc.) but needs no knowledge of the domain. Concurrent Collections (CnC) is based on this separation of concerns. The talk will present CnC and its benefits. About the speaker Kathleen Knobe has focused throughout her career on parallelism especially compiler technology, runtime system design and language design. She worked at Compass (aka Massachusetts Computer Associates) from 1980 to 1991 designing compilers for a wide range of parallel platforms for Thinking Machines, MasPar, Alliant, Numerix, and several government projects. In 1991 she decided to finish her education. After graduating from MIT in 1997, she joined Digital Equipment?s Cambridge Research Lab (CRL). She stayed through the DEC/Compaq/HP mergers and when CRL was acquired and absorbed by Intel. She currently works in the Software and Services Group / Technology Pathfinding and Innovation.

  10. Search for b?u transitions in B?[K????]DK decays

    SciTech Connect (OSTI)

    Lees, J. P.; Poireau, V.; Tisserand, V.; Garra Tico, J.; Grauges, E.; Martinelli, M.; Milanes, D. A.; Palano, A.; Pappagallo, M.; Eigen, G.; Stugu, B.; Sun, L.; Brown, D. N.; Kerth, L. T.; Kolomensky, Yu.?G.; Lynch, G.; Koch, H.; Schroeder, T.; Asgeirsson, D. J.; Hearty, C.; Mattison, T. S.; McKenna, J. A.; Khan, A.; Blinov, V. E.; Buzykaev, A. R.; Druzhinin, V. P.; Golubev, V. B.; Kravchenko, E. A.; Onuchin, A. P.; Serednyakov, S. I.; Skovpen, Yu.?I.; Solodov, E. P.; Todyshev, K.?Yu.; Yushkov, A. N.; Bondioli, M.; Curry, S.; Kirkby, D.; Lankford, A. J.; Mandelkern, M.; Stoker, D. P.; Atmacan, H.; Gary, J. W.; Liu, F.; Long, O.; Vitug, G. M.; Campagnari, C.; Hong, T. M.; Kovalskyi, D.; Richman, J. D.; West, C. A.; Eisner, A. M.; Kroseberg, J.; Lockman, W. S.; Martinez, A. J.; Schalk, T.; Schumm, B. A.; Seiden, A.; Cheng, C. H.; Doll, D. A.; Echenard, B.; Flood, K. T.; Hitlin, D. G.; Ongmongkolkul, P.; Porter, F. C.; Rakitin, A. Y.; Andreassen, R.; Dubrovin, M. S.; Meadows, B. T.; Sokoloff, M. D.; Bloom, P. C.; Ford, W. T.; Gaz, A.; Nagel, M.; Nauenberg, U.; Smith, J. G.; Wagner, S. R.; Ayad, R.; Toki, W. H.; Spaan, B.; Kobel, M. J.; Schubert, K. R.; Schwierz, R.; Bernard, D.; Verderi, M.; Clark, P. J.; Playfer, S.; Watson, J. E.; Bettoni, D.; Bozzi, C.; Calabrese, R.; Cibinetto, G.; Fioravanti, E.; Garzia, I.; Luppi, E.; Munerato, M.; Negrini, M.; Piemontese, L.; Baldini-Ferroli, R.; Calcaterra, A.; de Sangro, R.; Finocchiaro, G.; Nicolaci, M.; Pacetti, S.; Patteri, P.; Peruzzi, I. M.; Piccolo, M.; Rama, M.; Zallo, A.; Contri, R.; Guido, E.; Lo Vetere, M.; Monge, M. R.; Passaggio, S.; Patrignani, C.; Robutti, E.; Bhuyan, B.; Prasad, V.; Lee, C. L.; Morii, M.; Edwards, A. J.; Adametz, A.; Marks, J.; Uwer, U.; Bernlochner, F. U.; Ebert, M.; Lacker, H. M.; Lueck, T.; Dauncey, P. D.; Tibbetts, M.; Behera, P. K.; Mallik, U.; Chen, C.; Cochran, J.; Crawley, H. B.; Meyer, W. T.; Prell, S.; Rosenberg, E. I.; Rubin, A. E.; Gritsan, A. V.; Guo, Z. J.; Arnaud, N.; Davier, M.; Derkach, D.; Grosdidier, G.; Le Diberder, F.; Lutz, A. M.; Malaescu, B.; Roudeau, P.; Schune, M. H.; Stocchi, A.; Wormser, G.; Lange, D. J.; Wright, D. M.; Bingham, I.; Chavez, C. A.; Coleman, J. P.; Fry, J. R.; Gabathuler, E.; Hutchcroft, D. E.; Payne, D. J.; Touramanis, C.; Bevan, A. J.; Di Lodovico, F.; Sacco, R.; Sigamani, M.; Cowan, G.; Paramesvaran, S.; Brown, D. N.; Davis, C. L.; Denig, A. G.; Fritsch, M.; Gradl, W.; Hafner, A.; Prencipe, E.; Alwyn, K. E.; Bailey, D.; Barlow, R. J.; Jackson, G.; Lafferty, G. D.; Cenci, R.; Hamilton, B.; Jawahery, A.; Roberts, D. A.; Simi, G.; Dallapiccola, C.; Cowan, R.; Dujmic, D.; Sciolla, G.; Lindemann, D.; Patel, P. M.; Robertson, S. H.; Schram, M.; Biassoni, P.; Lazzaro, A.; Lombardo, V.; Palombo, F.; Stracka, S.; Cremaldi, L.; Godang, R.; Kroeger, R.; Sonnek, P.; Summers, D. J.; Nguyen, X.; Taras, P.; De Nardo, G.; Monorchio, D.; Onorato, G.; Sciacca, C.; Raven, G.; Snoek, H. L.; Jessop, C. P.; Knoepfel, K. J.; LoSecco, J. M.; Wang, W. F.; Honscheid, K.; Kass, R.; Brau, J.; Frey, R.; Sinev, N. B.; Strom, D.; Torrence, E.; Feltresi, E.; Gagliardi, N.; Margoni, M.; Morandin, M.; Posocco, M.; Rotondo, M.; Simonetto, F.; Stroili, R.; Ben-Haim, E.; Bomben, M.; Bonneaud, G. R.; Briand, H.; Calderini, G.; Chauveau, J.; Hamon, O.; Leruste, Ph.; Marchiori, G.; Ocariz, J.; Sitt, S.; Biasini, M.; Manoni, E.; Rossi, A.; Angelini, C.; Batignani, G.; Bettarini, S.; Carpinelli, M.; Casarosa, G.; Cervelli, A.; Forti, F.; Giorgi, M. A.; Lusiani, A.; Neri, N.; Oberhof, B.; Paoloni, E.; Perez, A.; Rizzo, G.; Walsh, J. J.; Lopes Pegna, D.; Lu, C.; Olsen, J.; Smith, A. J. S.; Telnov, A. V.; Anulli, F.; Cavoto, G.; Faccini, R.; Ferrarotto, F.; Ferroni, F.; Gaspero, M.; Li Gioi, L.; Mazzoni, M. A.; Piredda, G.; Buenger, C.; Hartmann, T.; Leddig, T.; Schrder, H.; Waldi, R.; Adye, T.; Olaiya, E. O.; Wilson, F. F.; Emery, S.; Hamel de Monchenault, G.; Vasseur, G.; Yche, Ch.; Aston, D.; Bard, D. J.; Bartoldus, R.; Benitez, J. F.; Cartaro, C.; Convery, M. R.; Dorfan, J.; Dubois-Felsmann, G. P.; Dunwoodie, W.; Field, R. C.; Franco Sevilla, M.; Fulsom, B. G.; Gabareen, A. M.; Graham, M. T.; Grenier, P.; Hast, C.; Innes, W. R.; Kelsey, M. H.; Kim, H.; Kim, P.; Kocian, M. L.; Leith, D. W. G. S.; Lewis, P.; Li, S.; Lindquist, B.; Luitz, S.; Luth, V.; Lynch, H. L.; MacFarlane, D. B.; Muller, D. R.; Neal, H.; Nelson, S.; Ofte, I.; Perl, M.; Pulliam, T.; Ratcliff, B. N.; Roodman, A.; Salnikov, A. A.; Santoro, V.; Schindler, R. H.; Snyder, A.; Su, D.; Sullivan, M. K.; Vavra, J.; Wagner, A. P.; Weaver, M.; Wisniewski, W. J.; Wittgen, M.; Wright, D. H.; Wulsin, H. W.; Yarritu, A. K.; Young, C. C.; Ziegler, V.; Park, W.; Purohit, M. V.; White, R. M.; Wilson, J. R.; Randle-Conde, A.; Sekula, S. J.; Bellis, M.

    2011-07-06

    We present a study of the decays B?DK with D mesons reconstructed in the K????? or K????? final states, where D indicates a D? or a D0 meson. Using a sample of 47410? BB pairs collected with the BABAR detector at the PEP-II asymmetric-energy e?e? collider at SLAC, we measure the ratios R?((?(B?[K????]DK))/((?(B?[K????]DK)). We obtain R?=(5?12?10(stat)?2?4(syst))10? and R?=(12?12?10(stat)?3?5(syst))10?, from which we extract the upper limits at 90% probability: R?<2310? and R?<2910?. Using these measurements, we obtain an upper limit for the ratio rB of the magnitudes of the b?u and b?c amplitudes rB<0.13 at 90% probability.

  11. Atmospheric Pressure Plasma CVD of Amorphous Hydrogenated Silicon Carbonitride (a-SiCN:H) Films Using Triethylsilane and Nitrogen

    SciTech Connect (OSTI)

    Srinivasan Guruvenket; Steven Andrie; Mark Simon; Kyle W. Johnson; Robert A. Sailer

    2011-10-04

    Amorphous hydrogenated silicon carbonitride (a-SiCN:H) thin films are synthesized by atmospheric pressure plasma enhanced chemical vapor (AP-PECVD) deposition using the Surfx Atomflow{trademark} 250D APPJ source with triethylsilane (HSiEt{sub 3}, TES) and nitrogen as the precursor and the reactive gases, respectively. The effect of the substrate temperature (T{sub s}) on the growth characteristics and the properties of a-SiCN:H films was evaluated. The properties of the films were investigated via scanning electron microscopy (SEM), atomic force microscopy (AFM) for surface morphological analyses, Fourier transform infrared spectroscopy (FTIR), and X-ray photoelectron spectroscopy (XPS) for chemical and compositional analyses; spectroscopic ellipsometry for optical properties and thickness determination and nanoindentation to determine the mechanical properties of the a-SiCN:H films. Films deposited at low T{sub s} depict organic like features, while the films deposited at high T{sub s} depict ceramic like features. FTIR and XPS studies reveal that an increases in T{sub s} helps in the elimination of organic moieties and incorporation of nitrogen in the film. Films deposited at T{sub s} of 425 C have an index of refraction (n) of 1.84 and hardness (H) of 14.8 GPa. A decrease in the deposition rate between T{sub s} of 25 and 250 C and increase in deposition rate between T{sub s} of 250 and 425 C indicate that the growth of a-SiCN:H films at lower T{sub s} are surface reaction controlled, while at high temperatures film growth is mass-transport controlled. Based on the experimental results, a potential route for film growth is proposed.

  12. The fluxes of CN neutrinos from the Sun in case of mixing in a spherical layer in the solar core

    SciTech Connect (OSTI)

    Kopylov, Anatoly; Petukhov, Valery E-mail: beril@inr.ru

    2012-03-01

    The results of the calculation are presented for the fluxes of CN neutrinos from the Sun in case of mixing in a spherical layer in the solar core, consistent with the seismic data and with the measured solar neutrino fluxes. It is shown that a substantial increase of the flux of {sup 13}N neutrinos can be gained in this case. The possible implications for experiment are discussed.

  13. A Linear trans -Bis(imido) Neptunium(V) Actinyl Analog: NpV (NDipp)2 ( tBu2 bipy)2Cl (Dipp = 2,6- i Pr2C6H3)

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

    Brown, Jessie L.; Batista, Enrique R.; Boncella, James M.; Gaunt, Andrew J.; Reilly, Sean D.; Scott, Brian L.; Tomson, Neil C.

    2015-07-22

    We present the discovery that imido analogs of actinyl dioxo cations can be extended beyond uranium into the transuranic elements. Synthesis of the Np(V) complex, Np(NDipp)2(tBu2bipy)2Cl (1), is achieved through treatment of a Np(IV) precursor with a bipyridine co-ligand and lithium-amide reagent. Complex 1 has been structurally characterized, analyzed by 1H NMR and UV/vis/NIR spectroscopies, and the electronic structure evaluated by DFT calculations.

  14. Fate of nutrient enrichment on continental shelves as indicated by the C/N content of bottom sediments

    SciTech Connect (OSTI)

    Walsh, J.J.; Premuzic, E.T.; Whitledge, T.E.

    1980-01-01

    The trajectory and fate of particulate matter are poorly understood processes in a spatially heterogeneous coastal ocean. Parameterization of appropriate hydrodynamics for a quantitative description of these loss processes must thus await definition of the important biological time and space scales. Since the bottom sands tend to record the history of the water column, we have selected the C/N content of shelf sediments as a possible tracer of (1) sites of nutrient introduction to the shelf by various physical mechanisms, of (2) areas of subsequent downstream utilization by the phytoplankton, and of (3) where loss of particulate matter might occur from the water column. An analysis is made of the C/N patterns of bottom surface sediments in relation to the nitrogen sources from upwelling, river runoff, and tidal mixing on the Peruvian, west African, Amazonian, Gulf of Mexico, eastern US, Bering, and North Sea shelves in an initial attempt to proscribe the particle trajectories of organic matter on the continental shelf.

  15. Draft Genome sequence of Frankia sp. strains CN3 , an atypical, non-infective (Nod-) ineffective (Fix-) isolate from Coriaria nepalensis

    SciTech Connect (OSTI)

    Ghodhbane-Gtari, Faten; Beauchemin, Nicholas; Bruce, David; Chain, Patrick S. G.; Chen, Amy; Davenport, Karen W.; Deshpande, Shweta; Detter, J. Chris; Furnholm, Teal; Goodwin, Lynne A.; Gtari, Maher; Han, Cliff; Han, James; Huntemann, Marcel; Ivanova, N; Kyrpides, Nikos C; Land, Miriam L; Markowitz, Victor; Mavromatis, K; Nolan, Matt; Nouioui, Imen; Pagani, Ioanna; Pati, Amrita; Pitluck, Sam; Santos, Catarina; Sen, Arnab; Sur, Saubashya; Szeto, Ernest; Tavares, Fernando; Hazuki, Teshima; Thakur, Subarna; Wall, Luis; Woyke, Tanja; Tisa, Louis S.

    2013-01-01

    We report here the genome sequence of Frankia sp. strain CN3, which was isolated from Coriaria nepalensis. This genome sequence is the first from the fourth lineage of Frankia, that are unable to re-infect actinorhizal plants. At 10 Mb, it represents the largest Frankia genome sequenced to date.

  16. Structural and Morphological Difference Between Ti/TiN/TiCN Coatings Grown in Multilayer and Graded Form

    SciTech Connect (OSTI)

    Restrepo, E.; Baena, A.; Agudelo, C.; Castillo, H.; Devia, A.; Marino, A.

    2006-12-04

    Thin films can be grown in super-lattice, multilayers and graded form, having each one advantages and disadvantages. The difference between multilayer and graded coatings is the interface. In multilayers the interface is abrupt and in graded coatings it is diffuse. The interface influences many chemical and physical properties of the materials, and its choice depends on the application. Graded coatings have the advantage of having gradual properties such as thermal expansion coefficient and lattice parameter, avoiding adherence problems due to good match between their component materials. In this work the comparison between some properties of coatings grown as multilayer and graded is performed. The materials are produced using the sputtering DC technique because of its facility to control the deposition parameters and generate a slow growth. The target is a disc of titanium and the samples are made of stainless steel 304. The working gases are argon, nitrogen and methane, which are mixed according to the material to be produced, i.e. Ti layer is grown with argon, the TiN film is produced with a mixture of argon and nitrogen, and the TiCN material is obtained mixing argon, nitrogen and methane. These materials are characterized with AFM in order to determine grain size and with XPS studying the chemical composition and performing depth profiles.

  17. Energy and charge transfers between (Bu{sub 4}N){sub 2}(Ru)(dcbpyH){sub 2}(NCS){sub 2} (N719) and ZnO thin films

    SciTech Connect (OSTI)

    Ni Manman; Cheng Qiang; Zhang, W. F.

    2010-03-15

    ZnO thin films and (Bu{sub 4}N){sub 2}(Ru)(dcbpyH){sub 2}(NCS){sub 2} (called N719) sensitized ZnO thin films are grown on fluorine-doped tin oxide (FTO) conducting glass substrates using laser molecular beam epitaxy. Ultraviolet-visible absorption, photoluminescence (PL), surface photovoltage spectroscopy, and Raman scattering are employed to probe into the transition process of photogenerated charges and the interaction between ZnO and N719. The experimental results indicate that there is a significant electronic interaction between N719 and ZnO through chemiadsorption. The interaction greatly enhances the photogenerated charge separation and thus the photovoltaic response of the ZnO film but remarkedly weakens its radiative recombination, i.e., PL, implying strong energy and charge transfer occurring between N719 and ZnO. In addition, a new PL peak observed at about 720 nm in N719 sensitized ZnO/FTO is attributed to the electron-hole recombination of N719.

  18. Improved synthesis and crystal structure of the flexible pillared layer porous coordination polymer: Ni(1,2-bis(4-pyridyl)ethylene)[Ni(CN)4

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

    Wong-Ng, W.; Culp, J. T.; Chen, Y. S.; Zavalij, P.; Espinal, L.; Siderius, D. W.; Allen, A. J.; Scheins, S.; Matranga, C.

    2013-01-01

    This paper reports our synthesis of flexible coordination polymer, Ni(L)[Ni(CN)4], (L = 1,2-bis(4-pyridyl)ethylene (nicknamed bpene)), and its structural characterization using synchrotron single crystal X-ray diffraction. The structure of the purplish crystals has been determined to be monoclinic, space group P21/m, a = 13.5941(12) Å, b = 14.3621(12) Å, c = 14.2561(12) Å, β = 96.141(2)°, V = 2767.4(4) Å3, Z = 4, Dc = 1.46 g cm-1. Ni(bpene)[Ni(CN)4] assumes a pillared layer structure with layers defined by Ni[Ni(CN)4]n nets and bpene ligands acting as pillars. With the present crystallization technique which involves the use of concentrated ammonium hydroxide solution andmore » dimethyl sulfoxide (DMSO), disordered free bpene ligands and solvents of crystallization (DMSO and water molecules) occupy the pores, resulting in a formula of Ni(bpene)[Ni(CN)4](1/2)bpene∙DMSO2H2O, or Ni2N7C24H25SO3. Without the inclusion of free bpene ligands and solvent molecules, the free volume is approximately 61% of the total volume; this free volume fraction is reduced to 50% with the free ligands present. Pores without the free ligands were found to have a local diameter of 5.7 Å and a main aperture of 3.5 Å. Based on the successful crystal synthesis, we also devised a new bulk synthetic technique which yielded a polycrystalline material with a significantly improved CO2 uptake as compared to the originally reported powder material. The improved synthetic technique yielded a polycrystalline material with 40% higher CO2 uptake compared to the previously reported powder material. An estimated 14.4 molecules of CO2 per unit cell was obtained.« less

  19. Fabrication of the C-N co-doped rod-like TiO{sub 2} photocatalyst with visible-light responsive photocatalytic activity

    SciTech Connect (OSTI)

    Li, Liang-Hai; Lu, Juan; Wang, Zuo-Shan; State Key Laboratory of Explosion Science and Technology, Beijing Institute of Technology, Beijing 100081 ; Yang, Lu; Zhou, Xiu-Feng; Han, Lu

    2012-06-15

    Highlights: ? Novel synthesis of C-N co-doped TiO{sub 2}. ? Self-assembly of C-N co-doped TiO{sub 2} nanorods by nanoparticles. ? Excellent photocatalytic efficiency. -- Abstract: The C-N co-doped TiO{sub 2} nanorods were synthesized by the vapor transport method of water molecules, and urea was used as the carbon and nitrogen source. The samples were characterized by X-ray diffraction and photoelectron spectroscopy analysis. The scanning electron microscope images showed that as-prepared TiO{sub 2} powders were nanorods, which were formed by the stacking of nanoparticles with a uniform size around 40 nm. The degradation of methylene blue with the prepared nanorods demonstrated the photocatalytic activities of TiO{sub 2} under visible light are improved by doping with C and N elements. The main reasons were discussed: doping with C and N elements could enhance the corresponding visible-light absorption of TiO{sub 2}. On the other hand, doping C and N could create more oxygen vacancies in the TiO{sub 2} crystals, which could capture the photogenerated electrons more effectively. Thus, more photogenerated holes could be left to improve the photocatalytic activity of TiO{sub 2}.

  20. SF6432-CN

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

    a third party, resulting from failure to comply with the requirements of this contract or failure to exercise reasonable care in performing the work. If the Contractor fails or...

  1. Local magnetism in the molecule-based metamagnet [Ru2(O2CMe)4]3[Cr(CN)6] probed with implanted muons

    SciTech Connect (OSTI)

    Lancaster, T.; Pratt, F. L.; Blundell, S. J.; Steele, Andrew J.; Baker, Peter J.; Wright, Jack D.; Fishman, Randy Scott; Miller, Joel S.

    2011-01-01

    We present a muon-spin relaxation study of local magnetism in the molecule-based metamagnet [Ru2(O2CMe)4]3[Cr(CN)6]. We observe magnetic order with TN = 33 K, although above 25 K the sublattice spins become less rigid and a degree of static magnetic disorder is observed. The comparison of measurements in applied magnetic field with simulations allows us to understand the origin of the muon response across the metamagnetic transition and to map out the phase diagram of the material. Applied hydrostatic pressures of up to 6 kbar lead to an increase in the local magnetic field along with a complex change in the internal magnetic field distribution.

  2. Intermolecular interactions involving C-H bonds, 3, Structure and energetics of the interaction between CH{sub 4} and CN{sup {minus}}

    SciTech Connect (OSTI)

    Novoa, J.J.; Whangbo, Myung-Hwan; Williams, J.M.

    1991-12-31

    On the basis of SCF and single reference MP2 calculations, the full potential energy surface of the interaction between CH{sub 4} and CN{sup {minus}} was studied using extended basis sets of up to near Hartree-Fock limit quality. Colinear arrangements C-N{sup {minus}}{hor_ellipsis}H-CH{sub 3} and N-C{sup {minus}}{hor_ellipsis}H-CH{sub 3} are found to be the only two energy minima. The binding energies of these two structures are calculated to be 2.5 and 2.1 kcal/mol, respectively, at the MP2 level. The full vibrational analyses of two structures show a red shift of about 30 cm{sup {minus}1} for the v{sub s} C-H stretching.

  3. Tuning MPI on BG/Q | Argonne Leadership Computing Facility

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

    that the kernel can de-schedule them in favor of the communication threads. The MPI Fortran Model You must use a module compiled with the same Fortran compiler (GNU or XLF) that...

  4. BG/Q Performance Counters | Argonne Leadership Computing Facility

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

    Performance Tools & APIs Tuning MPI on BGQ Tuning and Analysis Utilities (TAU) HPCToolkit HPCTW mpiP gprof Profiling Tools Darshan PAPI BGQ Performance Counters BGPM...

  5. BG/Q Drivers Status | Argonne Leadership Computing Facility

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

    Blue GeneQ Versus Blue GeneP BGQ Drivers Status Machine Overview Machine Partitions Torus Network Data Storage & File Systems Compiling & Linking Queueing & Running Jobs Data...

  6. BG/Q File Systems | Argonne Leadership Computing Facility

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

    BGQ File Systems Disk Quota Using HPSS Compiling & Linking Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM...

  7. BG/Q DGEMM Performance | Argonne Leadership Computing Facility

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

    BGQ DGEMM Performance The table below represents the percentage of peak performance for a matrix-matrix multiply BLAS3 dgemm routine as it is implemented in a BGQ Power A2 core...

  8. Systematic investigation of electronic structure in BEDT-TTF based organic superconductors with Tc above 10 K; [kappa]-(BEDT-TTF)[sub 2]X (X = Cu(NCS)[sub 2], Cu[N(CN)[sub 2

    SciTech Connect (OSTI)

    Nakamura, Toshikazu; Nobutoki, Tomoko; Miyamoto, Masao; Tsubokura, Yuichi; Tsuchiya, Ryota; Takahashi, Toshihiro ); Kanoda, Kazushi ); Saito, Gunzi )

    1994-06-01

    The electronic structure of the title superconductors has been investigated by electrical resistivity, complex susceptibility, and electron paramagnetic resonance (EPR) measurements. The superconducting properties (pressure dependence of Tc, magnetic penetration depth, upper critical field, and so on) of these three salts are similar to each other, while transport properties in the normal state have shown a large variety in the temperature dependence. In order to clarify the electronic structure in the normal state, the EPR parameters, the spin susceptibility ([Chi][sub spin]), and the linewidth ([Delta]H[sub pp]), are compared. An anomalous temperature dependence of the g-value has been observed below 150 K in the Cu(NCS)[sub 2] and Cu(CN)[N(CN)[sub 2

  9. 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.

  10. DETECTIONS OF C{sub 2}H, CYCLIC-C{sub 3}H{sub 2}, AND H{sup 13}CN IN NGC 1068

    SciTech Connect (OSTI)

    Nakajima, T.; Takano, S.; Kohno, K.; Inoue, H.

    2011-02-20

    We used the Nobeyama 45 m telescope to conduct a spectral line survey in the 3 mm band (85.1-98.4 GHz) toward one of the nearest galaxies with an active galactic nucleus (AGN), NGC 1068, and the prototypical starburst galaxy NGC 253. The beam size of this telescope is {approx} 18'', which was sufficient to spatially separate the nuclear molecular emission from the emission of the circumnuclear starburst region in NGC 1068. We detected rotational transitions of C{sub 2}H, cyclic-C{sub 3}H{sub 2}, and H{sup 13}CN in NGC 1068. These are detections of carbon-chain and carbon-ring molecules in NGC 1068. In addition, the C{sub 2}H N = 1-0 lines were detected in NGC 253. The column densities of C{sub 2}H were determined to be 3.4 x 10{sup 15} cm{sup -2} in NGC 1068 and 1.8 x 10{sup 15} cm{sup -2} in NGC 253. The column densities of cyclic-C{sub 3}H{sub 2} were determined to be 1.7 x 10{sup 13} cm{sup -2} in NGC 1068 and 4.4 x 10{sup 13} cm{sup -2} in NGC 253. We calculated the abundances of these molecules relative to CS for both NGC 1068 and NGC 253, and found that there were no significant differences in the abundances between the two galaxies. This result suggests that the basic carbon-containing molecules are either insusceptible to AGN or are tracing cold (T{sub rot} {approx} 10 K) molecular gas rather than X-ray irradiated hot gas.

  11. Location of gap nodes in the organic superconductors {kappa}-(ET){sub 2}Cu(NCS){sub 2} and {kappa}-(ET){sub 2}Cu[N(CN){sub 2}Br determined by magnetocalorimetry.

    SciTech Connect (OSTI)

    Malone, L.; Taylor, O. J.; Schlueter, J. A.; Carrington, A.; Materials Science Division; Univ. Bristol

    2010-07-16

    We report specific-heat measurements of the organic superconductors {kappa}-(ET){sub 2}Cu(NCS){sub 2} and {kappa}-(ET){sub 2}Cu[N(CN){sub 2}]Br. When the magnetic field is rotated in the highly conducting planes at low temperature (T = 0.4 K), we observe clear oscillations of specific heat which have a strong fourfold component. The observed strong field and temperature dependence of this fourfold component identifies it as originating from nodes in the superconducting energy gap which point along the in-plane crystal axes (d{sub xy} symmetry).

  12. Temperature measurement of an atmospheric pressure arc discharge plasma jet using the diatomic CN (B {sup 2}{sigma}{sup +}-X {sup 2}{sigma}{sup +}, violet system) molecular spectra

    SciTech Connect (OSTI)

    Moon, Se Youn; Kim, D. B.; Gweon, B.; Choe, W.

    2009-03-01

    The CN (B {sup 2}{sigma}{sup +}-X {sup 2}{sigma}{sup +}) molecular emission spectrum is used to measure both the vibrational and rotational temperatures in atmospheric pressure arc jet discharges. The vibrational and rotational temperature effects on the synthetic diatomic molecular spectra were investigated from the (v{sup '},v{sup ''})=(0,0) band to the (5,5) band. The temperatures obtained from the synthetic spectra compared with the experimental result of a low-frequency arc discharge show a vibrational temperature of (4250-5010) K and a rotational temperature of (3760-3980) K for the input power in the range of (80-280) W. As the (0,0) band is isolated from other vibrational transition bands, determination of the rotational temperature is possible based only on the (0,0) band, which simplifies the temperature measurement. From the result, it was found that the CN molecular spectrum can be used as a thermometer for atmospheric pressure plasmas containing carbon and nitrogen.

  13. Microsoft Word - long-cn.doc

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

    Next Generation Flux Analysis: Adding Clear-Sky LW and LW Cloud Effects, Cloud Optical Depths, and Improved Sky Cover Estimates C. N. Long Pacific Northwest National Laboratory Richland, Washington Introduction The original Shortwave Flux Analysis (SWFA), based on Long and Ackerman (2000) and Long et al. (1999), deals only with daylight shortwave (SW) data. The SWFA algorithm produces continuous estimates of clear-sky downwelling diffuse, direct, and total SW; estimated fractional sky cover; and

  14. PP-366_CX_CN.pdf

    Energy Savers [EERE]

  15. IAEA-F1-CN69.pdf

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

    NUMBER SCALING, PLASMA FLOW, AND REDUCED TRANSPORT G. Fiksel, 1 A.F. Almagri, 1 J.K. Anderson, 1 T.M. Biewer, 1 D.L. Brower, 2 C-S. Chiang, 1 B.E. Chapman, 1 J.T. Chapman, 1 D.J....

  16. EA-137-A_NYSEG_CN.pdf

    Office of Environmental Management (EM)

  17. EA-171-C_Powerex_CN.pdf

    Office of Environmental Management (EM)

  18. EA-171-D Powerex (CN)_0.pdf

    Office of Environmental Management (EM)

  19. EA-171-D Powerex CN.pdf

    Office of Environmental Management (EM)

  20. EA-182-D HQUS (CN).pdf

    Office of Environmental Management (EM)

  1. EA-409 Saracen Power (CN).pdf

    Office of Environmental Management (EM)

  2. EA-410 CWP Energy (CN).pdf

    Office of Environmental Management (EM)

  3. EA-410 CWP Energy CN.pdf

    Office of Environmental Management (EM)

  4. EA-411 Targray (CN).pdf

    Office of Environmental Management (EM)

  5. EA-414 Roctop (CN).pdf

    Office of Environmental Management (EM)

  6. EA-414 Roctop (CN).pdf

    Office of Environmental Management (EM)

  7. EA-416 CEE (CN).pdf

    Office of Environmental Management (EM)

  8. EA-97-C_Portland_CN.pdf

    Office of Environmental Management (EM)

  9. EA-97-D PGE (CN).pdf

    Office of Environmental Management (EM)

  10. Queuing and Running on BG/Q Systems FAQ | Argonne Leadership...

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

    Queuing and Running on BGQ Systems FAQ Contents Is there a limit on stack size? My job had empty stdout, and the stderr looks like it died immediately after it started. What...

  11. Optimizing the FLASH code: preparing for Mira BG/Q and improving...

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

    April 30, 2013 10:00-11:00 PDT Oakland Scientific Facility Room 238 FLASH is a multi-physics, component-based scientific code which has been used on the largest HPC platforms...

  12. Torus Network on a BG/Q System | Argonne Leadership Computing...

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

    Blue GeneQ Versus Blue GeneP BGQ Drivers Status Machine Overview Machine Partitions Torus Network Data Storage & File Systems Compiling & Linking Queueing & Running Jobs Data...

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

    SciTech Connect (OSTI)

    Napora, Robert A

    2004-10-01

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

  14. LINE LISTS FOR THE A {sup 2}?-X {sup 2}?{sup +} (RED) AND B {sup 2}?{sup +}-X {sup 2}?{sup +} (VIOLET) SYSTEMS OF CN, {sup 13}C{sup 14}N, AND {sup 12}C{sup 15}N, AND APPLICATION TO ASTRONOMICAL SPECTRA

    SciTech Connect (OSTI)

    Sneden, Christopher; Lucatello, Sara; Ram, Ram S.; Brooke, James S. A.; Bernath, Peter E-mail: sara.lucatello@oapd.inaf.it E-mail: jsabrooke@gmail.com

    2014-10-01

    New red and violet system line lists for the CN isotopologues {sup 13}C{sup 14}N and {sup 12}C{sup 15}N have been generated. These new transition data are combined with those previously derived for {sup 12}C{sup 14}N, and applied to the determination of CNO abundances in the solar photosphere and in four red giant stars: Arcturus, the bright, very low-metallicity star HD 122563, and the carbon-enhanced metal-poor stars HD 196944 and HD 201626. When both red and violet system lines are detectable in a star, their derived N abundances are in good agreement. The mean N abundances determined in this work are also generally in accord with published values.

  15. BIG SANDY IDA ONEID A WILL IAM SBU RG BU RNIN G SPRIN GS WIN

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

    100.1 - 1,000 MMCF 1,000.1 - 10,000 MMCF 10,000.1 - 100,000 MMCF > 100,000 MMCF Appalachian Basin Boundary Appalachian Basin, TN-KY (Panel 7 of 7) Oil and Gas Fields By 2001 Gas

  16. BIG SANDY IDA ONEID A WILL IAM SBU RG BU RNIN G SPRIN GS WIN

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

    100.1 - 1,000 MBOE 1,000.1 - 10,000 MBOE 10,000.1 - 100,000 MBOE > 100,000 MBOE Appalachian Basin Boundary Appalachian Basin, TN-KY (Panel 7 of 7) Oil and Gas Fields By 2001 BOE

  17. ALT AMONT BLU EBELL NATUR AL BU TT ES PLAT EAU CATHED RAL RED WASH

    Gasoline and Diesel Fuel Update (EIA)

    BOE Reserve Class No 2001 reserves 0.1 - 10 MBOE 10.1 - 100 MBOE 100.1 - 1,000 MBOE 1,000.1 - 10,000 MBOE 10,000.1 - 100,000 MBOE > 100,000 MBOE Basin Outline Total Total Total Number Liquid Gas BOE of Reserves Reserves Reserves Fields (Mbbl) (MMcf) (Mbbl) Uinta-Piceance 180 254,329 7,181,669 1,451,274 Basin Uinta-Piceance Basin Oil & Gas Fields By 2001 BOE

  18. ALT AMONT BLU EBELL NATUR AL BU TT ES PLAT EAU CATHED RAL RED WASH

    Gasoline and Diesel Fuel Update (EIA)

    Gas Reserve Class No 2001 gas reserves 0.1 - 10 MMCF 10.1 - 100 MMCF 100.1 - 1,000 MMCF 1,000.1 - 10,000 MMCF 10,000.1 - 100,000 MMCF > 100,000 MMCF Basin Outline Total Total Total Number Liquid Gas BOE of Reserves Reserves Reserves Fields (Mbbl) (MMcf) (Mbbl) Uinta-Piceance 180 254,329 7,181,669 1,451,274 Basin Uinta-Piceance Basin Oil & Gas Fields By 2001 Gas

  19. ALT AMONT BLU EBELL NATUR AL BU TT ES PLAT EAU CATHED RAL RED WASH

    Gasoline and Diesel Fuel Update (EIA)

    Liquids Reserve Class No 2001 liquids reserves 0.1 - 10 Mbbl 10.1 - 100 Mbbl 100.1 - 1,000 Mbbl 1,000.1 - 10,000 Mbbl 10,000.1 - 100,000 Mbbl Basin Outline Total Total Total Number Liquid Gas BOE of Reserves Reserves Reserves Fields (Mbbl) (MMcf) (Mbbl) Uinta-Piceance 180 254,329 7,181,669 1,451,274 Basin Uinta-Piceance Basin Oil & Gas Fields By 2001 Liquids

  20. BASIN VER DE GREAT ER ANETH BU G BAR KER DOME HOR SESH OE UTE DOME

    Gasoline and Diesel Fuel Update (EIA)

    BOE Reserve Class 0 20 40 10 30 Miles ± The mapped oil and gas field boundary outlines were created by the Reserves and Production Division, Office of Oil and Gas, Energy Information Administration pursuant to studies required by Section 604 of the Energy Policy and Conservation Act Amendments of 2000 (P.L. 106-469). The boundaries are not informed by subsurface structural information. The data and methods used in their creation are detailed in a report, "Scientific Inventory of Onshore

  1. BASIN VER DE GREAT ER ANETH BU G BAR KER DOME HOR SESH OE UTE DOME

    Gasoline and Diesel Fuel Update (EIA)

    Gas Reserve Class 0 20 40 10 30 Miles ± The mapped oil and gas field boundary outlines were created by the Reserves and Production Division, Office of Oil and Gas, Energy Information Administration pursuant to studies required by Section 604 of the Energy Policy and Conservation Act Amendments of 2000 (P.L. 106-469). The boundaries are not informed by subsurface structural information. The data and methods used in their creation are detailed in a report, "Scientific Inventory of Onshore

  2. BASIN VER DE GREAT ER ANETH BU G BAR KER DOME HOR SESH OE UTE...

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

    Liquids Reserve Class 0 20 40 10 30 Miles The mapped oil and gas field boundary outlines were created by the Reserves and Production Division, Office of Oil and Gas, Energy ...

  3. FBP-ER-RIFS-BG-PLN-0036 Rev. 6 1 DOE/PPPO/03-0383&D4

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

    ... (as measured by ex cess lifetim e cancer risk ELCR to humans) or from other ... Excess Lifetime Cancer Risk (ELCR) - ELCR considers the cumulative probability of humans ...

  4. Magnetic field, frequency and temperature dependence of complex conductance of ultrathin La1.65Sr0.45CuO4/La2CuO4 films and the organic superconductors κ-(BEDT-TTF)2Cu[N(CN)2]Br

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

    V. A. Gasparov; Bozovic, I.; He, Xi; Dubuis, G.; Pavuna, D.; Kushch, N. D.; Yagubskii, E. B.; Schlueter, J. A.

    2015-09-01

    In this study, we used atomic-layer molecular beam epitaxy (ALL-MBE) to synthesize bilayer films of a cuprate metal (La1.65Sr0.45CuO4) and a cuprate insulator (La2CuO4), in which interface superconductivity occurs in a layer that is just one-half unit cell thick. We have studied the magnetic field and temperature dependence of the complex sheet conductance, σ(ω), of these films, and compared them to κκ-(BEDT-TTF)2Cu[N(CN)2]Br single crystals. The magnetic field H was applied both parallel and perpendicular to the 2D conducting layers. Experiments have been carried out at frequencies between 23 kHz and 50 MHz using either two-coil mutual inductance technique, or themore » LC resonators with spiral or rectangular coils. The real and the imaginary parts of the mutual-inductance M(T,ω) between the coil and the sample were measured and converted to complex conductivity. For H perpendicular to the conducting layers, we observed almost identical behavior in both films and κ-Br single crystals: (i) the transition onset in the inductive response, Lk–1(T) occurs at a temperature lower by 2 K than in Re σ(T), (ii) this shift is almost constant with magnetic field up to 8 T; (iii) the vortex diffusion constant D(T) is exponential due to pinning of vortex cores. These results can be described by the extended dynamic theory of the Berezinski–Kosterlitz–Thouless (BKT) transition and dynamics of bound vortex–antivortex pairs with short separation lengths.« less

  5. Cobalt Complexes Containing Pendant Amines in the Second Coordination Sphere as Electrocatalysts for H2 Production

    SciTech Connect (OSTI)

    Fang, Ming; Wiedner, Eric S.; Dougherty, William G.; Kassel, W. S.; Liu, Tianbiao L.; DuBois, Daniel L.; Bullock, R. Morris

    2014-10-27

    A series of heteroleptic 17e- cobalt complexes, [CpCoII(PtBu2NPh2)](BF4), [CpC6F5CoII(PtBu2NPh2)](BF4), [CpC5F4NCoII(PtBu2NPh2)](BF4), [where P2tBuN2Ph = 1,5-diphenyl-3,7-di(tert-butyl)-1,5-diaza-3,7-diphosphacyclooctane, CpC6F5 = C5H4(C6F5), and CpC5F4N = C5H4(C5F4N)] were synthesized, and structures of all three were determined by X-ray crystallography. Electrochemical studies showed that the CoIII/II couple of [CpC5F4NCoII(PtBu2NPh2)]+ appears 250 mV positive of the CoIII/II couple of [CpCoII(PtBu2NPh2)] as a result of the strongly electron-withdrawing perfluorpyridyl substituent on the Cp ring. Reduction of these paramagnetic CoII complexes by KC8 led to the diamagnetic 18e- complexes CpICo(PtBu2NPh2), CpC6F5CoI(PtBu2NPh2), CpC5F4NCoI(PtBu2NPh2), which were also characterized by crystallography. Protonation of these neutral CoI complexes led to the cobalt hydrides [CpCoIII(PtBu2NPh2)H](BF4), [CpC6F5CoIII(PtBu2NPh2)H](BF4), and [CpC5F4NCoIII(PtBu2NPh2)H](BF4). The cobalt hydride with the most electron-withdrawing Cp ligand, [CpC5F4NCoIII(PtBu2NPh2)H]+ is an electrocatalyst for production of H2 using 4-MeOC6H4NH3BF4 (pKaMeCN = 11.86) with a turnover frequency of 350 s-1 and an overpotential of 0.75 V. Experimental measurement of thermochemical data provided further insights into the thermodynamics of H2 elimination. This research was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for the U.S. Department of Energy.

  6. EA-161-A_Duke_Energy_Indiana_CN.pdf

    Office of Environmental Management (EM)

  7. EA-185-C_Morgan_Stanley_CN.pdf

    Office of Environmental Management (EM)

  8. EA-196-D Minnesota Power (CN).pdf

    Office of Environmental Management (EM)

  9. EA-210-C PPL EnergyPlus CN.pdf

    Office of Environmental Management (EM)

  10. EA-211-B_DTE_Energy_CN.pdf

    Office of Environmental Management (EM)

  11. EA-232-B_OGE_Energy__CN.pdf

    Office of Environmental Management (EM)

  12. EA-248-D Constellation NewEnergy (CN).pdf

    Office of Environmental Management (EM)

  13. EA-257-D Emera Energy Svcs (CN).pdf

    Office of Environmental Management (EM)

  14. EA-260-E CP Energy Marketing (CN).pdf

    Office of Environmental Management (EM)

  15. EA-283_Pub_Svs_of_CO___CN.pdf

    Office of Environmental Management (EM)

  16. EA-287-A_Emera_Sub_1_CN.pdf

    Office of Environmental Management (EM)

  17. EA-295-A_Merrill_Lynch_CN.pdf

    Office of Environmental Management (EM)

  18. EA-295-B Merrill Lynch Commodities (CN).pdf

    Office of Environmental Management (EM)

  19. EA-296-B Rainbow Energy (CN).pdf

    Office of Environmental Management (EM)

  20. EA-296-B Rainbow Energy CN.pdf

    Office of Environmental Management (EM)

  1. EA-368-A Brookfield Energy (CN)_0.pdf

    Office of Environmental Management (EM)

  2. EA-389 Great Bay Energy (CN).pdf

    Office of Environmental Management (EM)

  3. EA-411 Targray Americas FRN (CN).pdf

    Office of Environmental Management (EM)

  4. EA-416 Consolidated Edison Energy (CN).pdf

    Office of Environmental Management (EM)

  5. DOE Hydrogen and Fuel Cells Program Record #13007: Industry Deployed Fuel Cell Backup Power (BuP)

    Broader source: Energy.gov [DOE]

    This record from the DOE Hydrogen and Fuel Cells Program describes the number of current and planned fuel cell deployments for backup power applications.

  6. Template:FlexiBlock | Open Energy Information

    Open Energy Info (EERE)

    (654px wide instead of 314px) Background: nobg bg-green bg-grey bg-orange bg-pink bg-red bg-purple bg-purple-grey Custom: custom-flite-widget (helps format FLITE widgets with...

  7. Preliminary assessment report for Bee Caves Armory (former Nike BG-80 Fire Control Facility), Installation 48055, Austin, Texas. Installation Restoration Program

    SciTech Connect (OSTI)

    Dennis, C.

    1993-08-01

    This report presents the results of the preliminary assessment (PA) conducted by Argonne National Laboratory at the Texas Army National Guard (ARNG) property in Austin, Texas. Preliminary assessments of federal facilities are being conducted to compile the information necessary for completing, preremedial activities and to provide a basis for establishing corrective actions in response to releases of hazardous substances. The principal objective of the PA is to characterize the site accurately and determine the need for further action by examining, site activities, quantities of hazardous substances present, and potential pathways by which contamination could affect public health and the environment. This PA satisfies, for the Bee Caves Armory property, the requirements of the Department of Defense Installation Restoration Program. Of concern is the potential for hazardous waste to be present on the property as a result of the former Nike Missile Base operations or in the form of original construction materials. Environmentally sensitive operations associated with the property from that period include (1) underground fuel storage, (2) hazardous materials storage/use, (3) disposal of hazardous waste and (4) release of hazardous waste water.

  8. Photomagnetic Switching of the Complex [Nd(dmf)[subscript 4](H[subscript 2]O)[subscript 3]([mu]-CN)Fe(CN)[subscript 5

    SciTech Connect (OSTI)

    Svendsen, Helle; Overgaard, Jacob; Chevallier, Marie; Collet, Eric; Iversen, Bo B.

    2009-10-21

    Single-crystal XRD experiments (see picture) reveal the excited-state structure of the photomagnetic heterobimetallic title complex. The system shows a decrease in all the iron-ligand bond lengths, suggesting that photoexcitation involves a ligand-to-metal charge transfer or a change in the superexchange coupling between the metal centers.

  9. Highly efficient greenish-blue platinum-based phosphorescent organic light-emitting diodes on a high triplet energy platform

    SciTech Connect (OSTI)

    Chang, Y. L. Gong, S. White, R.; Lu, Z. H.; Wang, X.; Wang, S.; Yang, C.

    2014-04-28

    We have demonstrated high-efficiency greenish-blue phosphorescent organic light-emitting diodes (PHOLEDs) based on a dimesitylboryl-functionalized C^N chelate Pt(II) phosphor, Pt(m-Bptrz)(t-Bu-pytrz-Me). Using a high triplet energy platform and optimized double emissive zone device architecture results in greenish-blue PHOLEDs that exhibit an external quantum efficiency of 24.0% and a power efficiency of 55.8?lm/W. This record high performance is comparable with that of the state-of-the-art Ir-based sky-blue organic light-emitting diodes.

  10. SF 6432-CN Standard Terms and Conditions for Fixed Price Commercial...

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

    Data, whichever is earlier. CLAUSE 208-CZ (12-93) COST ACCOUNTING STANDARDS CLAUSES MODIFIED COVERAGE I. DISCLOSURE AND CONSISTENCY OF COST ACCOUNTING PRACTICES (a) The...

  11. Materials Data on Be(CN)2 (SG:102) 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

  12. Materials Data on CuCN (SG:160) 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

  13. Materials Data on Zn(CN)2 (SG:102) 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 Al(CN)3 (SG:113) 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. Materials Data on Cd(CN)2 (SG:102) 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

  16. Materials Data on CuCN2 (SG:63) by Materials Project

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

    Kristin Persson

    2015-02-09

    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

  17. Materials Data on K2CN2 (SG:12) by Materials Project

    SciTech Connect (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

  18. Materials Data on Mg(CN)2 (SG:102) by Materials Project

    SciTech Connect (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

  19. Materials Data on Cd(CN)2 (SG:215) 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

  20. Materials Data on CsB(CN)4 (SG:88) 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

  1. Materials Data on AgB(CN)4 (SG:215) 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

  2. Materials Data on TlB(CN)4 (SG:88) 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

  3. Materials Data on CuB(CN)4 (SG:215) 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

  4. Materials Data on KTl(CN)4 (SG:88) 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

  5. Materials Data on K2Cd(CN)4 (SG:227) 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

  6. Materials Data on RbB(CN)4 (SG:88) 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

  7. Materials Data on K2Pd(CN)4 (SG:14) by Materials Project

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

    Kristin Persson

    2014-11-02

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

  8. Materials Data on LiB(CN)4 (SG:215) 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

  9. IP CN Crosby, ND Natural Gas Pipeline Imports From Canada (Dollars per

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

    Thousand Cubic Feet) Decade Year-0 Year-1 Year-2 Year-3 Year-4 Year-5 Year-6 Year-7 Year-8 Year-9 2010's -- 4.16 1.68

  10. Materials Data on ThCN (SG:12) 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

  11. IP CN Crosby, ND Natural Gas Pipeline Imports From Canada (Dollars...

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

    Year Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec 2014 4.29 4.25 3.82 2.98 2015 2.10 2.28 2.30 2.17 2.04 1.72 1.57 1.58 1.69 1.6...

  12. Materials Data on FeSn2(CN)6 (SG:147) by Materials Project

    SciTech Connect (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

  13. Materials Data on FePb2(CN)6 (SG:147) by Materials Project

    SciTech Connect (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. DOE-HDBK-1113-98, CN 1, Reaffirm; Radiological Safety Training for Uranium Facilities

    Office of Environmental Management (EM)

    REAFFIRMATION WITH ERRATA April 2005 DOE HANDBOOK RADIOLOGICAL SAFETY TRAINING FOR URANIUM FACILITIES U.S. Department of Energy FSC 6910 Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. DOE-HDBK-1113-98 ii This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to the public

  15. DOE-HDBK-1130-98-CN2; DOE Handbook Radiological Worker Training

    Office of Environmental Management (EM)

    30-98 October 1998 Change Notice No. 1 June 2001 Change Notice No. 2 December 2003 DOE HANDBOOK Radiological Worker Training U.S. Department of Energy AREA TRNG Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced directly from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to

  16. DOE-STD-1042-93 CN-1; Guide to Good Practices for Control Area Activities

    Office of Environmental Management (EM)

    2-93 June 1993 CHANGE NOTICE NO. 1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR CONTROL AREA ACTIVITIES U.S. Department of Energy AREA MISC Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to the public from the

  17. DOE-STD-1043-93 CN-1; Guide to Good Practices for Operator Aid Postings

    Office of Environmental Management (EM)

    3-93 June 1993 CHANGE NOTICE NO. 1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR OPERATOR AID POSTINGS U.S. Department of Energy AREA MISC Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to the public from the

  18. EA-287-B Emera Energy U.S. Sub No. 1 (CN).pdf

    Office of Environmental Management (EM)

  19. EA-356-A J.P. Morgan Commodities CN.pdf

    Office of Environmental Management (EM)

  20. DOE - Fossil Energy:

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

    of Equatorial Guinea BG LNG Services, LLC 2288 FE06-05-LNG 010606 Arab Republic of Egypt BG LNG Services, LLC 2287 FE06-04-LNG 010606 Trinidad and Tobago BG LNG Services,...

  1. Materials Data on CuP2H8CN2O5 (SG:15) 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

  2. Heat and corrosion resistant cast CN-12 type stainless steel with improved high temperature strength and ductility

    DOE Patents [OSTI]

    Mazias, Philip J. (Oak Ridge, TN); McGreevy, Tim (Morton, IL); Pollard,Michael James (East Peoria, IL); Siebenaler, Chad W. (Peoria, IL); Swindeman, Robert W. (Oak Ridge, TN)

    2007-08-14

    A cast stainless steel alloy and articles formed therefrom containing about 0.5 wt. % to about 10 wt. % manganese, 0.02 wt. % to 0.50 wt. % N, and less than 0.15 wt. % sulfur provides high temperature strength both in the matrix and at the grain boundaries without reducing ductility due to cracking along boundaries with continuous or nearly-continuous carbides. Alloys of the present invention also have increased nitrogen solubility thereby enhancing strength at all temperatures because nitride precipitates or nitrogen porosity during casting are not observed. The solubility of nitrogen is dramatically enhanced by the presence of manganese, which also retains or improves the solubility of carbon thereby providing additional solid solution strengthening due to the presence of manganese and nitrogen, and combined carbon. Such solution strengthening enhances the high temperature precipitation-strengthening benefits of fine dispersions of NbC. Such solid solution effects also enhance the stability of the austenite matrix from resistance to excess sigma phase or chrome carbide formation at higher service temperatures. The presence of sulfides is substantially eliminated.

  3. DOE-STD-1032-92 CN 1; Guide to Good Practices for Operations Organization and Administration

    Office of Environmental Management (EM)

    2-92 December 1992 CHANGE NOTICE NO.1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR OPERATIONS ORGANIZATION AND ADMINISTRATION U.S. Department of Energy AREA MISC Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to

  4. DOE-STD-1040-93 CN-1; Guide to Good Practices for Control of On-Sight Training

    Office of Environmental Management (EM)

    0-93 June 1993 CHANGE NOTICE NO. 1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR CONTROL OF ON-SHIFT TRAINING U.S. Department of Energy FSC 6910 Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to the public from

  5. DOE-STD-1041-93 CN-1; Guide to Good Practices for Shift Routines and Operating Practices

    Office of Environmental Management (EM)

    1-93 June 1998 Change Notice No. 1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR SHIFT ROUTINES AND OPERATING PRACTICES U.S. Department of Energy AREA MISC Washington, D.C. 20585 DISTRIBUTION STATEMENT A:Approved for public release; distribution unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to the public

  6. DOE-STD-1044-93 CN-1; Guide to Good Practices for Equipment and Piping Labeling

    Office of Environmental Management (EM)

    4-93 June 1993 CHANGE NOTICE NO. 1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR EQUIPMENT AND PIPING LABELING U.S. Department of Energy AREA FACR Washington, D.C. 20585 DISTRIBUTION STATEMENT A: Approved for public release; distribution unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823. Available to the public from

  7. DOE-STD-1045-93 CN-1; Guide to Good Practices for Notifications and Investigation of Abnormal Events

    Office of Environmental Management (EM)

    5-93 June 1993 CHANGE NOTICE NO. 1 December 1998 DOE STANDARD GUIDE TO GOOD PRACTICES FOR NOTIFICATIONS AND INVESTIGATION OF ABNORMAL EVENTS U.S. Department of Energy AREA MISC Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services, U.S. Department of Energy, (800) 473-4375, fax: (301) 903-9823.

  8. Synthesis, NMR spectra, and structure of rhodium hydride complexes with Rh-Sn bonds

    SciTech Connect (OSTI)

    Krut'ko, B.P.; Permin, A.B.; Petrosyan, V.S.; Reutov, O.A.

    1985-06-20

    The authors study the hydride complexes using Sn 119 and H 1 NMR spectroscopy. The spectra were taken in a pulse mode on a Varian FT-80A spectrometer equipped with a wideband system at 29.66 and 79.54 MHz. The Sn 119 and H 1 NMR spectral parameters for a solution of the complex (Bu/sub 4/N)/sub 3/ (HRh(SnCl/sub 3/)/sub 5/) in CD/sub 3/CN are shown, the spectra show that the (HRh(SnCl/sub 3/)/sub 5/)/sup 3 -/ anion has octahedral structure with four equatorial and one axial Rh-Sn bonds. New rhodium hydride complexes with general formula (R/sub 4/N)/sub 3/(HRh(SnCl/sub 3/)/sub 5/) were synthesized.

  9. 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.

  10. DOE-STD-1104-96 CN-1; Review and Approval of Nuclear Facility Safety Basis Documents (Documented Safety Analyses and Technical Safety Requirements)

    Office of Environmental Management (EM)

    DOE-STD-1104-96 February 1996 CHANGE NOTICE NO. 1 May 2002 DOE STANDARD REVIEW AND APPROVAL OF NUCLEAR FACILITY SAFETY BASIS DOCUMENTS (DOCUMENTED SAFETY ANALYSES AND TECHNICAL SAFETY REQUIREMENTS) U.S. Department of Energy AREA SAFT Washington, DC 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. TS This document has been reproduced directly from the best available copy. Available to DOE and DOE contractors from ES&H Technical Information Services,

  11. DOE-STD-3007-93 CN-1; DOE Standard Guidelines For Preparing Criticality Safety Evaluations at Department of Energy Non-Reactor Nuclear Facilities

    Office of Environmental Management (EM)

    7-93 November 1993 CHANGE NOTICE NO. 1 September 1998 DOE STANDARD GUIDELINES FOR PREPARING CRITICALITY SAFETY EVALUATIONS AT DEPARTMENT OF ENERGY NON-REACTOR NUCLEAR FACILITIES U.S. Department of Energy AREA SAFT Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document has been reproduced directly from the best available copy. Available to DOE and DOE contractors from the Office of Scientific and Technical Information, P.O. Box 62,

  12. Data Storage & File Systems | Argonne Leadership Computing Facility

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

    BG/Q File Systems Disk Quota Using HPSS Compiling & Linking Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Data Storage & File Systems BG/Q File Systems BG/Q File Systems: An overview of the BG/Q file systems available at ALCF. Disk

  13. Final Scientific/Technical Report Grant title: Use of ARM Measurements of Spectral Zenith Radiance for Better Understanding of 3D Cloud-Radiation Processes and Aerosol-Cloud Interaction This is a collaborative project with the NASA GSFC project of Dr. A. Marshak and W. Wiscombe (PIs). This report covers BU activities from February 2011 to June 2011 and BU "œno-cost extension" activities from June 2011 to June 2012. This report summarizes results that complement a final technical report submitted by the PIs in 2011.

    SciTech Connect (OSTI)

    Knyazikhin, Y

    2012-09-10

    Main results are summarized for work in these areas: spectrally-invariant approximation within atmospheric radiative transfer; spectral invariance of single scattering albedo for water droplets and ice crystals at weakly absorbing wavelengths; seasonal changes in leaf area of Amazon forests from leaf flushing and abscission; and Cloud droplet size and liquid water path retrievals from zenith radiance measurements.

  14. Alkane functionalization at ([mu]-Oxo)diiron(III) centers

    SciTech Connect (OSTI)

    Leising, R.A.; Kim, J.; Perez, M.A.; Que, L. Jr. )

    1993-10-20

    The reactivity of ([mu]-oxo)diferric complexes with [sup t]BuOOH (TBHP) for the functionalization of alkanes in CH[sub 3]CN has been investigated as part of our efforts to model dinuclear sites in nonheme iron enzymes. [Fe[sub 2](TPA)[sub 2]O(OAc)](CIO[sub 4])[sub 3] (1) (TPA = tris(2-pyridylmethyl)amine, OAc = acetate) is an efficient catalyst for cyclohexane oxidation, affording cyclohexanol (A, 9 equiv), cyclohexanone (K, 11 equiv), and (tert-butylperoxy)cyclohexane (P, 16 equiv) in 0.25 h at ambient temperature and pressure under an argon atmosphere. The catalyst is remarkably robust, as indicated by the [sup 1]H NMR and UV-vis spectra of the reaction mixture during the catalytic reaction and by its ability to maintain its turnover efficiency with subsequent additions of oxidant. The catalytic mechanism for TBHP utilization was explored by observing the effects of varying the tripodal ligands on the ([mu]-oxo)([mu]-carboxylato)diferric catalysts and varying the bridge on Fe[sub 2]O(TPA)[sub 2] catalysts. The (A + K)/P ratio increased as the ligands became more electron donating. Solvent also played an important role in determining the partitioning of products between A + K and P, with benzonitrile favoring hydroxylated products at the expense of P and pyridine having the opposite effect. 49 refs., 2 figs., 3 tabs.

  15. DOE Hydrogen and Fuel Cells Program Record #13007: Industry Deployed...

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

    (BuP) DOE Hydrogen and Fuel Cells Program Record 13007: Industry Deployed Fuel Cell Backup Power (BuP) This record from the DOE Hydrogen and Fuel Cells Program describes the ...

  16. gprof Profiling Tools | Argonne Leadership Computing Facility

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

    Tuning MPI on BG/Q Tuning and Analysis Utilities (TAU) HPCToolkit HPCTW mpiP gprof Profiling Tools Darshan PAPI BG/Q Performance Counters BGPM Openspeedshop Scalasca BG/Q DGEMM Performance Automatic Performance Collection (AutoPerf) Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] gprof Profiling Tools Contents Introduction Profiling on the

  17. Darshan | Argonne Leadership Computing Facility

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

    Performance Tools & APIs Tuning MPI on BG/Q Tuning and Analysis Utilities (TAU) HPCToolkit HPCTW mpiP gprof Profiling Tools Darshan PAPI BG/Q Performance Counters BGPM Openspeedshop Scalasca BG/Q DGEMM Performance Automatic Performance Collection (AutoPerf) Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Darshan References Darshan

  18. EIS-0002: Allocation of Petroleum Feedstock, Baltimore Gas & Electric Co., Sollers Point SNG Plant, Sollers Point, Baltimore County, MD

    Broader source: Energy.gov [DOE]

    The Economic Regulatory Administration (ERA) developed this EIS to evaluate the social, economic and environmental impacts which may occur within the Baltimore Gas and Electric Company (BG&E) service area as a result of the ERA' s proposed decision to allocate up to 2,186,000 barrels per year of naphtha feedstock to BG&E to operate BG&E's existing synthetic natural gas facility located on Sollers Point in Baltimore County, Maryland.

  19. Eco Sustainable Solutions Ltd | Open Energy Information

    Open Energy Info (EERE)

    Sustainable Solutions Ltd Jump to: navigation, search Name: Eco Sustainable Solutions Ltd Place: Dorset, United Kingdom Zip: BH23 6BG Sector: Biomass Product: Focused on organics...

  20. Advance Patent Waiver W(A)2008-042

    Broader source: Energy.gov [DOE]

    This is a request by Novozymes Inc. for a DOE waiver of domestic and foreign patent rights under agreement DE-FC36-0BG01BOBO

  1. Preparation of NaGdS{sub 2} via thermolysis of Gd[S{sub 2}CN(C{sub 4}H{sub 8})]{sub 3}-phen complexes and sodium diethyldithiocarbamate mixtures

    SciTech Connect (OSTI)

    Luo, Xixian, E-mail: Luoxixiandl@126.com [Physics Department, Dalian Maritime University, Dalian, Liaoning 116026 (China); Ma, Lubin; Xing, Mingming; Fu, Yao; Zhou, Xiaolin; Sun, Min [Physics Department, Dalian Maritime University, Dalian, Liaoning 116026 (China)

    2013-05-15

    Highlights: ? We adopt a new and simple thermolysis method to synthesise NaGdS{sub 2} compounds. ? The obtained NaGdS{sub 2} presents a microrod morphology with a length diameter ratio of 2.1. ? NaGdS{sub 2} has excellent transmission over a very wide range of wavelengths (>430 nm). ? The route may be used for the synthesis of other AREX{sub 2}-based materials or nanocrystals. - Abstract: A novel, simple thermolysis method is adopted to prepare alkali metal rare earth ternary sulphide NaGdS{sub 2} using Gd(S{sub 2}CNEt{sub 2}){sub 3-}phen complexes and NaS{sub 2}CNEt{sub 2}3H{sub 2}O mixtures as precursors in a nitrogen atmosphere at 6001000 C. The obtained NaGdS{sub 2} presents a microrod morphology with an average diameter of 112 nm, average length of 236 nm, and length diameter ratio of 2.1. Furthermore, the as-prepared NaGdS{sub 2} has excellent transmission over a very wide range of wavelengths (>430 nm) and may be an ideal IR window material.

  2. Electrodynamics of the organic superconductorsinebreak [kappa]-(BEDT-TTF)[sub 2]Cu(NCS)[sub 2] and [kappa]-(BEDT-TTF)[sub 2]Cu[N(CN)[sub 2

    SciTech Connect (OSTI)

    Dressel, M.; Klein, O.; Gruener, G. ); Carlson, K.D.; Wang, H.H.; Williams, J.M. )

    1994-11-01

    We have performed measurements of the surface impedance in the normal and superconducting states of the title compounds in the millimeter wave-frequency range (1--3 cm[sup [minus]1]), and have evaluated the complex conductivity for different crystallographic orientations. Above the transition temperature, the materials behave like metals with a scattering rate of approximately 20 cm[sup [minus]1]. In the superconducting state the electrodynamics is in good agreement with calculations based on a BCS ground state: while the penetration depth and the coherence length are anisotropic, the superconducting energy gap shows no indications of line nodes.

  3. DOE - Fossil Energy:

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

    Can Ocean State Power I 2103 FE05-27-NG 042505 Can Ocean State Power I 2105 FE05-114-LNG 120905 TrinTabogo BG LNG Services, LLC 2199 FE05-115-LNG 120905 Various Sources BG...

  4. Everest Refrigeration: Order (2015-SE-42001) | Department of Energy

    Office of Environmental Management (EM)

    Order (2015-SE-42001) Everest Refrigeration: Order (2015-SE-42001) June 9, 2015 DOE ordered Bu Sung America Corporation (dba Everest Refrigeration) to pay a $12,080 civil penalty after finding Bu Sung had manufactured and distributed in commerce in the U.S. at least 64 units of noncompliant commercial refrigerator basic model ESGR3. The Order adopted a Compromise Agreement, which reflected settlement terms between DOE and Bu Sung. PDF icon Everest Refrigeration: Order (2015-SE-42001) More

  5. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    ... The Role of Additive in Diketopyrrolopyrrole-based Small Molecular Bulk Heterojunction Solar Cells Wang, Hongyu ; Liu, Feng ; Bu, Laju ; Gao, Jun ; Wang, Cheng ; Wei, Wei ; ...

  6. Alternative Energy Finance | Open Energy Information

    Open Energy Info (EERE)

    Finance Jump to: navigation, search Name: Alternative Energy Finance Place: London, United Kingdom Zip: NW11 8BU Sector: Renewable Energy Product: String representation...

  7. Envirocapital | Open Energy Information

    Open Energy Info (EERE)

    Envirocapital Jump to: navigation, search Name: Envirocapital Place: London, United Kingdom Zip: EC4M 8BU Sector: Renewable Energy Product: Provides corporate finance advice to the...

  8. Mr. John E. Kieling, Bureau Chief Hazardous Waste Bureau

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

    Division New Mexico Environment Department 2905 Rodeo Park Drive East, Building 1 Santa Fe, NM 87508-6303 New Mexico Environment Department Harold Runnels Bu ildi ng 1190...

  9. Lattice Quantum Chromodynamics

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

    Lattice Quantum Chromodynamics Lattice Quantum Chromodynamics QCD-BU.jpg Key Challenges: Although the QCD theory has been extensively tested at at high energies, at low energies or...

  10. A=18F (1983AJ01)

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

    1979DA15, 1980GO01, 1980KU05, 1980MA18, 1981EL1D, 1981ER03, 1981GR06, 1982KI02). Cluster, collective and deformed models: (1977BU22, 1978BU03, 1978PI1E, 1978SA15,...

  11. A=18O (1983AJ01)

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

    1979DA15, 1979WU06, 1980GO01, 1980KU05, 1980MA18, 1981EL1D, 1982KI02, 1982OL01). Cluster, collective and deformed models: (1977BU22, 1978BU03, 1978CH26, 1978PI1E,...

  12. Shell Future Fuels and CO2 | Open Energy Information

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    Shell Future Fuels and CO2 Jump to: navigation, search Name: Shell Future Fuels and CO2 Place: Glasgow, Scotland, United Kingdom Zip: G1 9BG Sector: Hydro, Hydrogen Product:...

  13. P

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

    etascale C ompu6ng This w ork p erformed u nder t he a uspices o f t he U .S. D epartment o f E nergy b y Lawrence L ivermore N a6onal L aboratory u nder C ontract D E--- AC52---07NA27344. Donald F rederick, L ivermore C ompu6ng, L awrence L ivermore Na6onal L aboratory LLNL---PRES---508651 IBM B lue G ene A rchitecture LLNL---PRES---508651 Outline * Overview o f B lueGene * BG Philosophy * The B G F amily * BG h ardware - System O verview - CPU - Node - Interconnect * BG S ystem S oVware * BG S

  14. DOE - Fossil Energy:

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    071108 Trinidad and Tobago BG LNG Services, LLC 2527 FE08-136-NG 111908 Mex Energia Chihuahua, S.A., de C.V. 2592 08-152-LNG 122308 Qatar Total Gas & Power North...

  15. Bulgaria: Energy Resources | Open Energy Information

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    Country Profile Name Bulgaria Population 7,364,570 GDP 57,596,000,000 Energy Consumption 0.83 Quadrillion Btu 2-letter ISO code BG 3-letter ISO code BGR Numeric ISO...

  16. DOE - Fossil Energy: 2011 Long Term Applications

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    Impt Expt Country Application Link Company Dkt. Index Ord. No. 11-09-LNG 012511 I Egypt BG LNG Services, LLC Dkt. Index 2917 11-51-LNG 042111 E Re-export Freeport LNG...

  17. Optimizing for Blue Gene/Q Hal Finkel

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

    for Blue Gene/Q Hal Finkel hfinkel@anl.gov 2015-05-19 Optimizing for Blue Gene/Q ✔ Relevant information on the BG/Q ✔ How you can optimize your code for the BG/Q ✔ Q&A You want to know how to make me compute quickly... Optimizing for Blue Gene/Q This is a BG/Q node This is not Optimizing for Blue Gene/Q This is a BG/Q node Mira has 49152 of these functioning as compute nodes! What programs do... ✔ Read data from memory ✔ Compute using that data ✔ Write results back to memory ✔

  18. Wind Power Renewables | Open Energy Information

    Open Energy Info (EERE)

    Wind Power Renewables Place: Norfolk, United Kingdom Zip: NR29 5BG Sector: Wind energy Product: Wind project developer Coordinates: 36.846825, -76.285069 Show Map Loading...

  19. Renewable Diesel from Algal Lipis: An Integrated Baseline for...

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

    ... Original RA modeling output: mean annual biofuel production (Lha-year) under current ... of unit farms required to meet the 5 BG biofuel production target under: (a) the baseline ...

  20. untitled

    Office of Scientific and Technical Information (OSTI)

    ... DE-SC0005464 (ER46763). SWC and BG are funded by the Gordon and Betty Moore Foundation's EPiQS Initiative through Grant GBMF4413 to the Rutgers Center for Emergent Materials. We ...

  1. Microsoft PowerPoint - Lv_2016_UserProjectHighlight_PNAS [Read-Only]

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

    Theoretical calculations predict that the gas-sensing performance of graphene could be remarkably enhanced by incorporating dopants into its lattice. However, experimental progress on boron- doped graphene (BG) has been limited by the lack of high-quality samples. Here, we achieved the controlled growth of large-area, high-crystallinity BG sheets and shed light on their electronic features associated with boron dopants at the atomic scale. It is demonstrated that boron doping in graphene leads

  2. How to Queue a Job | Argonne Leadership Computing Facility

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

    Reservations Cobalt Job Control How to Queue a Job Running Jobs FAQs Queuing and Running on BG/Q Systems Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] How to Queue a Job Using the Job Resource Manager on BG/Q: Commands, Options and Examples This document provides

  3. Research Highlight

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

    at the TOA (left panel) and at the surface (right panel) as a function of CN concentration. Figure 2. Cloud frequency of occurrence for three ranges of CN concentration: (a)...

  4. 14C

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

    Thermal Neutron Capture Evaluated Data Measurements 1975SM02: 13C(n, ); measured atomic mass. 1981MUZU: 13C(n, ), E thermal; measured (capture), ratio. 14C level deduced...

  5. 13C

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

    C Thermal Neutron Capture Evaluated Data Measurements 1967RA24: 12C(n, ), E thermal; measured E; deduced Q. 1968SP01: 12C(n, ), E thermal; measured E, I; deduced Q....

  6. A faux hawk fullerene with PCBM-like properties

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

    San, Long K.; Bukovsky, Eric V.; Larson, Bryon W.; Whitaker, James B.; Deng, Shihu; Kopidakis, Nikos; Rumbles, Garry; Popov, Alexey A.; Chen, Yu-Sheng; Wang, Xue B.; et al

    2014-12-16

    Reaction of C60, C6F5CF2I, and SnH(n-Bu)3 produced, among other unidentified fullerene derivatives, the two new compounds 1,9-C60(CF2C6F5)H (1) and 1,9-C60(cyclo-CF2(2-C6F4)) (2). The highest isolated yield of 1 was 35% based on C60. Depending on the reaction conditions, the relative amounts of 1 and 2 generated in situ were as high as 85% and 71%, respectively, based on HPLC peak integration and summing over all fullerene species present other than unreacted C60. Compound 1 is thermally stable in 1,2-dichlorobenzene (oDCB) at 160 °C but was rapidly converted to 2 upon addition of Sn2(n-Bu)6 at this temperature. In contrast, complete conversion ofmore » 1 to 2 occurred within minutes, or hours, at 25 °C in 90/10 (v/v) PhCN/C6D6 by addition of stoichiometric, or sub-stoichiometric, amounts of proton sponge (PS) or cobaltocene (CoCp2). DFT calculations indicate that when 1 is deprotonated, the anion C60(CF2C6F5)- can undergo facile intramolecular SNAr annulation to form 2 with concomitant loss of F-. To our knowledge this is the first observation of a fullerene-cage carbanion acting as an SNAr nucleophile towards an aromatic C–F bond. The gas-phase electron affinity (EA) of 2 was determined to be 2.805(10) eV by low-temperature PES, higher by 0.12(1) eV than the EA of C60 and higher by 0.18(1) eV than the EA of phenyl-C61-butyric acid methyl ester (PCBM). In contrast, the relative E1/2(0/-) values of 2 and C60, -0.01(1) and 0.00(1) V, respectively, are virtually the same (on this scale, and under the same conditions, the E1/2(0/-) of PCBM is -0.09 V). Time-resolved microwave conductivity charge-carrier yield x mobility values for organic photovoltaic active-layer-type blends of 2 and poly-3-hexylthiophene (P3HT) were comparable to those for equimolar blends of PCBM and P3HT. The structure of solvent-free crystals of 2 was determined by single-crystal X-ray diffraction. The number of nearest-neighbor fullerene–fullerene interactions with centroid∙∙∙centroid (⊙∙∙∙⊙) distances of ≤ 10.34 Å is significantly greater, and the average ⊙∙∙∙⊙ distance is shorter, for 2 (10 nearest neighbors; ave. ⊙∙∙∙⊙ distance = 10.09 Å) than for solvent-free crystals of PCBM (7 nearest neighbors; ave. ⊙∙∙∙⊙ distance = 10.17 Å). Finally, the thermal stability of 2 was found to be far greater than that of PCBM.« less

  7. A faux hawk fullerene with PCBM-like properties

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

    San, Long K.; Bukovsky, Eric V.; Larson, Bryon W.; Whitaker, James B.; Deng, S. H.M.; Kopidakis, Nikos; Rumbles, Garry; Popov, Alexey A.; Chen, Yu-Sheng; Wang, Xue-Bin; et al

    2014-12-16

    Reaction of C60, C6F5CF2I, and SnH(n-Bu)3 produced, among other unidentified fullerene derivatives, the two new compounds 1,9-C60(CF2C6F5)H (1) and 1,9-C60(cyclo-CF2(2-C6F4)) (2). The highest isolated yield of 1 was 35% based on C60. Depending on the reaction conditions, the relative amounts of 1 and 2 generated in situ were as high as 85% and 71%, respectively, based on HPLC peak integration and summing over all fullerene species present other than unreacted C60. Compound 1 is thermally stable in 1,2-dichlorobenzene (oDCB) at 160 °C but was rapidly converted to 2 upon addition of Sn2(n-Bu)6 at this temperature. In contrast, complete conversion ofmore » 1 to 2 occurred within minutes, or hours, at 25 °C in 90/10 (v/v) PhCN/C6D6 by addition of stoichiometric, or sub-stoichiometric, amounts of proton sponge (PS) or cobaltocene (CoCp2). DFT calculations indicate that when 1 is deprotonated, the anion C60(CF2C6F5)- can undergo facile intramolecular SNAr annulation to form 2 with concomitant loss of F-. To our knowledge this is the first observation of a fullerene-cage carbanion acting as an SNAr nucleophile towards an aromatic C–F bond. The gas-phase electron affinity (EA) of 2 was determined to be 2.805(10) eV by low-temperature PES, higher by 0.12(1) eV than the EA of C60 and higher by 0.18(1) eV than the EA of phenyl-C61-butyric acid methyl ester (PCBM). In contrast, the relative E1/2(0/-) values of 2 and C60, -0.01(1) and 0.00(1) V, respectively, are virtually the same (on this scale, and under the same conditions, the E1/2(0/-) of PCBM is -0.09 V). Time-resolved microwave conductivity charge-carrier yield × mobility values for organic photovoltaic active-layer-type blends of 2 and poly-3-hexylthiophene (P3HT) were comparable to those for equimolar blends of PCBM and P3HT. The structure of solvent-free crystals of 2 was determined by single-crystal X-ray diffraction. The number of nearest-neighbor fullerene–fullerene interactions with centroid···centroid (⊙···⊙) distances of ≤10.34 Å is significantly greater, and the average ⊙···⊙ distance is shorter, for 2 (10 nearest neighbors; ave. ⊙···⊙ distance = 10.09 Å) than for solvent-free crystals of PCBM (7 nearest neighbors; ave. ⊙···⊙ distance = 10.17 Å). Finally, the thermal stability of 2 was found to be far greater than that of PCBM.« less

  8. A faux hawk fullerene with PCBM-like properties

    SciTech Connect (OSTI)

    San, Long K.; Bukovsky, Eric V.; Larson, Bryon W.; Whitaker, James B.; Deng, Shihu; Kopidakis, Nikos; Rumbles, Garry; Popov, Alexey A.; Chen, Yu-Sheng; Wang, Xue B.; Boltalina, Olga V.; Strauss, Steven H.

    2014-12-16

    Reaction of C60, C6F5CF2I, and SnH(n-Bu)3 produced, among other unidentified fullerene derivatives, the two new compounds 1,9-C60(CF2C6F5)H (1) and 1,9-C60(cyclo-CF2(2-C6F4)) (2). The highest isolated yield of 1 was 35% based on C60. Depending on the reaction conditions, the relative amounts of 1 and 2 generated in situ were as high as 85% and 71%, respectively, based on HPLC peak integration and summing over all fullerene species present other than unreacted C60. Compound 1 is thermally stable in 1,2-dichlorobenzene (oDCB) at 160 C but was rapidly converted to 2 upon addition of Sn2(n-Bu)6 at this temperature. In contrast, complete conversion of 1 to 2 occurred within minutes, or hours, at 25 C in 90/10 (v/v) PhCN/C6D6 by addition of stoichiometric, or sub-stoichiometric, amounts of proton sponge (PS) or cobaltocene (CoCp2). DFT calculations indicate that when 1 is deprotonated, the anion C60(CF2C6F5)- can undergo facile intramolecular SNAr annulation to form 2 with concomitant loss of F-. To our knowledge this is the first observation of a fullerene-cage carbanion acting as an SNAr nucleophile towards an aromatic CF bond. The gas-phase electron affinity (EA) of 2 was determined to be 2.805(10) eV by low-temperature PES, higher by 0.12(1) eV than the EA of C60 and higher by 0.18(1) eV than the EA of phenyl-C61-butyric acid methyl ester (PCBM). In contrast, the relative E1/2(0/-) values of 2 and C60, -0.01(1) and 0.00(1) V, respectively, are virtually the same (on this scale, and under the same conditions, the E1/2(0/-) of PCBM is -0.09 V). Time-resolved microwave conductivity charge-carrier yield x mobility values for organic photovoltaic active-layer-type blends of 2 and poly-3-hexylthiophene (P3HT) were comparable to those for equimolar blends of PCBM and P3HT. The structure of solvent-free crystals of 2 was determined by single-crystal X-ray diffraction. The number of nearest-neighbor fullerenefullerene interactions with centroid???centroid (?????) distances of ? 10.34 is significantly greater, and the average ????? distance is shorter, for 2 (10 nearest neighbors; ave. ????? distance = 10.09 ) than for solvent-free crystals of PCBM (7 nearest neighbors; ave. ????? distance = 10.17 ). Finally, the thermal stability of 2 was found to be far greater than that of PCBM.

  9. A faux hawk fullerene with PCBM-like properties

    SciTech Connect (OSTI)

    San, Long K.; Bukovsky, Eric V.; Larson, Bryon W.; Whitaker, James B.; Deng, S. H.M.; Kopidakis, Nikos; Rumbles, Garry; Popov, Alexey A.; Chen, Yu-Sheng; Wang, Xue-Bin; Boltalina, Olga V.; Strauss, Steven H.

    2014-12-16

    Reaction of C60, C6F5CF2I, and SnH(n-Bu)3 produced, among other unidentified fullerene derivatives, the two new compounds 1,9-C60(CF2C6F5)H (1) and 1,9-C60(cyclo-CF2(2-C6F4)) (2). The highest isolated yield of 1 was 35% based on C60. Depending on the reaction conditions, the relative amounts of 1 and 2 generated in situ were as high as 85% and 71%, respectively, based on HPLC peak integration and summing over all fullerene species present other than unreacted C60. Compound 1 is thermally stable in 1,2-dichlorobenzene (oDCB) at 160 C but was rapidly converted to 2 upon addition of Sn2(n-Bu)6 at this temperature. In contrast, complete conversion of 1 to 2 occurred within minutes, or hours, at 25 C in 90/10 (v/v) PhCN/C6D6 by addition of stoichiometric, or sub-stoichiometric, amounts of proton sponge (PS) or cobaltocene (CoCp2). DFT calculations indicate that when 1 is deprotonated, the anion C60(CF2C6F5)- can undergo facile intramolecular SNAr annulation to form 2 with concomitant loss of F-. To our knowledge this is the first observation of a fullerene-cage carbanion acting as an SNAr nucleophile towards an aromatic CF bond. The gas-phase electron affinity (EA) of 2 was determined to be 2.805(10) eV by low-temperature PES, higher by 0.12(1) eV than the EA of C60 and higher by 0.18(1) eV than the EA of phenyl-C61-butyric acid methyl ester (PCBM). In contrast, the relative E1/2(0/-) values of 2 and C60, -0.01(1) and 0.00(1) V, respectively, are virtually the same (on this scale, and under the same conditions, the E1/2(0/-) of PCBM is -0.09 V). Time-resolved microwave conductivity charge-carrier yield mobility values for organic photovoltaic active-layer-type blends of 2 and poly-3-hexylthiophene (P3HT) were comparable to those for equimolar blends of PCBM and P3HT. The structure of solvent-free crystals of 2 was determined by single-crystal X-ray diffraction. The number of nearest-neighbor fullerenefullerene interactions with centroidcentroid (??) distances of ?10.34 is significantly greater, and the average ?? distance is shorter, for 2 (10 nearest neighbors; ave. ?? distance = 10.09 ) than for solvent-free crystals of PCBM (7 nearest neighbors; ave. ?? distance = 10.17 ). Finally, the thermal stability of 2 was found to be far greater than that of PCBM.

  10. Iron Complexes Bearing Diphosphine Ligands with Positioned Pendant Amines as Electrocatalysts for the Oxidation of H2

    SciTech Connect (OSTI)

    Liu, Tianbiao L.; Liao, Qian; O'Hagan, Molly J.; Hulley, Elliott; DuBois, Daniel L.; Bullock, R. Morris

    2015-06-22

    The synthesis and spectroscopic characterization of CpC5F4NFe(PtBu2NBn2)Cl, [3-Cl] (where C5F4N is the tetrafluorpyridyl substituent and PtBu2NBn2 = 1,5-di(tert-butyl)-3,7-di(benzyl)-1,5-diaza-3,7-diphosphacyclooctane) are reported. Complex 3-Cl and previously reported [CpC5F4NFe(PtBu2NtBu2)Cl], 4-Cl, are precursors to intermediates in the catalytic oxidation of H2, including CpC5F4NFe(PtBu2NBn2)H (3-H), CpC5F4NFe(PtBu2NtBu2)H (4-H), [CpC5F4NFe(PtBu2NBn2)]BArF4 ([3](BArF4), [CpC5F4NFe(PtBu2NtBu2)]BArF4 ([4](BArF4), [CpC5F4NFe(PtBu2NBn2)(H2)]BArF4 ([3-H2]BArF4), and [CpC5F4NFe(PtBu2NtBu2H)H]BArF4 ([4-FeH(NH)]BArF4). All of these complexes were characterized by spectroscopic and electrochemical studies; 3-Cl, 3-H and 4-Cl were also characterized by single crystal diffraction studies. 3-H and 4-H are electrocatalysts for H2 (1.0 atm) oxidation in the presence of a excess of the amine base N-methylpyrrolidine, with turnover frequencies at 22 °C of 2.5 s-1 and 0.5 s-1, and overpotentials at Ecat/2 of 235 mV and 95 mV, respectively. Studies of individual chemical and/or electrochemical reactions of the various intermediates provide important insights into the factors governing the overall catalytic activity for H2 oxidation, and provide important insights into the role of the pendant base of the [FeFe] hydrogenase active site. This work was supported by the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for the U.S. Department of Energy.

  11. Island Gas | Open Energy Information

    Open Energy Info (EERE)

    United Kingdom Zip: W1J 7BU Sector: Renewable Energy Product: UK-based coal bed methane company, Island Gas was the subject of a reverse takeover by KP Renewables in...

  12. MHK Projects/Makah Bay Offshore Wave Pilot Project | Open Energy...

    Open Energy Info (EERE)

    mooringanchoring and electrical connection system; (2) a 3.7-statute-mile-long, direct current (DC) submarine transmission cable connecting from one of the AquaBuOY's...

  13. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    Guo, Shaojun (3) Su, Dong (2) Bu, Lingzheng (1) Chen, Gen (1) Ding, Jiabao (1) Guo, Jun ... F. Fidler ; He, Kai ; Su, Dong ; Chen, Gen ; Lin, Qianglu ; Pietryga, Jeffrey M. ; ...

  14. Class 1 Permit Modification Notification

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

    Waste Bureau New Mexico Environment Department 2905 Rodeo Park Drive East, Bu il ding 1 Santa Fe, New Mexico 87505-6303 JUL 0 5 2011 Subject: Notification of a Class 1 Permit...

  15. West Central Soy | Open Energy Information

    Open Energy Info (EERE)

    Soy Jump to: navigation, search Name: West Central Soy Place: Iowa Product: Biodiesel producer based in Iowa, Owned bu a soy farmer coop References: West Central Soy1 This...

  16. Center for Nanophase Materials Sciences (CNMS) - Publications

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

    M.; Decker, S. .R; Bu, L. T.; Zhao, X. C.; McCabe, C.; Wohlert, J.; Bergenstrahle, M.; Brady, J. W.; Adney, W. S.; Himmel, M. E.; Crowley, M. F., ":The O-Glycosylated Linker from...

  17. Everest Refrigeration: Noncompliance Determination (2015-SE-42001) |

    Office of Environmental Management (EM)

    Department of Energy Noncompliance Determination (2015-SE-42001) Everest Refrigeration: Noncompliance Determination (2015-SE-42001) April 24, 2015 DOE issued a Notice of Noncompliance Determination to Bu Sung America Corporation (dba Everest Refrigeration) finding that commercial refrigeration equipment model number ESGR3 does not comport with the energy conservation standards. DOE determined the product was noncompliant based on DOE testing. Bu Sung must immediately notify each person (or

  18. Homoleptic Ce(III) and Ce(IV) Nitroxide Complexes: Significant Stabilization of the 4+ Oxidation State

    SciTech Connect (OSTI)

    Bogart, Justin A.; Lewis, Andrew J.; Medling, Scott A.; Piro, Nicholas A.; Carroll, Patrick J.; Booth, Corwin H.; Schelter, Eric J.

    2014-06-25

    Electrochemical experiments performed on the complex Ce-IV[2-((BuNO)-Bu-t)py](4), where [2-((BuNO)-Bu-t)py](-) = N-tert-butyl-N-2-pyridylnitroxide, indicate a 2.51 V stabilization of the 4+ oxidation state of Ce compared to [(Bu4N)-Bu-n](2)[Ce(NO3)(6)] in acetonitrile and a 2.95 V stabilization compared to the standard potential for the ion under aqueous conditions. Density functional theory calculations suggest that this preference for the higher oxidation state is a result of the tetrakis(nitroxide) ligand framework at the Ce cation, which allows for effective electron donation into, and partial covalent overlap with, vacant 4f orbitals with delta symmetry. The results speak to the behavior of CeO2 and related solid solutions in oxygen uptake and transport applications, in particular an inherent local character of bonding that stabilizes the 4+ oxidation state. The results indicate a cerium(IV) complex that has been stabilized to an unprecedented degree through tuning of its ligand-field environment.

  19. Spectral Resolution for Five-Element, Filtered, X-Ray Detector (XRD) Arrays Using the Methods of Backus and Gilbert

    SciTech Connect (OSTI)

    FEHL,DAVID LEE; BIGGS,F.; CHANDLER,GORDON A.; STYGAR,WILLIAM A.

    2000-01-17

    The generalized method of Backus and Gilbert (BG) is described and applied to the inverse problem of obtaining spectra from a 5-channel, filtered array of x-ray detectors (XRD's). This diagnostic is routinely fielded on the Z facility at Sandia National Laboratories to study soft x-ray photons ({le}2300 eV), emitted by high density Z-pinch plasmas. The BG method defines spectral resolution limits on the system of response functions that are in good agreement with the unfold method currently in use. The resolution so defined is independent of the source spectrum. For noise-free, simulated data the BG approximating function is also in reasonable agreement with the source spectrum (150 eV black-body) and the unfold. This function may be used as an initial trial function for iterative methods or a regularization model.

  20. ARM_Mayor_Poster_FINAL5.ai

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

    Raman-shifted Eye-safe Aerosol Lidar (REAL) Shane Mayor, Scott Spuler, Bruce Morley National Center for Atmospheric Research (NCAR) Boulder, Colorado 3 March 2006 00:16:12 UTC 2 km 4 km T-REX: March-April 2006 T-REX The NCAR REAL is available for use. Please contact shane@ucar.edu or go to www.lidar.ucar.edu 1km 2km 1km 2km Dry BG Wet MS2 BACKSCATTER INTENSITY DEPOLARIZATION RATIO Dry BG Wet MS2 1.54-microns wavelength, rapid-scanning, eye-safe, aerosol lidar CHATS: March-June 2007 Independence,

  1. BlueGene/L Applications: Parallelism on a Massive Scale (Journal Article) |

    Office of Scientific and Technical Information (OSTI)

    SciTech Connect Journal Article: BlueGene/L Applications: Parallelism on a Massive Scale Citation Details In-Document Search Title: BlueGene/L Applications: Parallelism on a Massive Scale BlueGene/L (BG/L), developed through a partnership between IBM and Lawrence Livermore National Laboratory (LLNL), is currently the world's largest system both in terms of scale with 131,072 processors and absolute performance with a peak rate of 367 TFlop/s. BG/L has led the Top500 list the last four times

  2. GE Opens New Global R&D Center in Brazil - GE Global Research

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

    Opens New Global R&D Center in Brazil; Working with Petrobras and BG Group to develop advanced technologies for oil and gas processing on the seabed 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) GE Opens New Global R&D Center in Brazil; Working with Petrobras and BG Group to develop advanced technologies for

  3. bgclang Compiler | Argonne Leadership Computing Facility

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

    Projects bgclang Compiler Cobalt Scheduler GLEAN Petrel Swift bgclang Compiler bgclang, a compiler toolchain based on the LLVM/Clang compiler infrastructure, but customized for the IBM Blue Gene/Q (BG/Q) supercomputer, is a successful experiment in creating an alternative, high-quality compiler toolchain for non-commodity HPC hardware. By enhancing LLVM (http://llvm.org/) with support for the BG/Q's QPX vector instruction set, bgclang inherits from LLVM/Clang a high-quality auto-vectorizing

  4. Application to Export Electric Energy OE Docket No. 326-A Citigroup...

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

    Application from Citigroup Energy Canada ULC to export electric energy to Canada. Federal Register Notice. EA-326-A Citigroup CN0.pdf More Documents & Publications Application to...

  5. 1

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

    the Estimation of Clear-Sky Upwelling Shortwave and Longwave C.N. Long Pacific Northwest National Laboratory Richland, Washington Introduction Previous work (Long and Ackerman...

  6. Application to Export Electric Energy OE Docket No. EA-389 Great...

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

    Applicaiton from Great Bay Energy to export electric energy to Canada. Federal Register Notice. EA-389 Great Bay Energy (CN).pdf More Documents & Publications Application to Export...

  7. ARM - Publications: Science Team Meeting Documents

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

    Institute (DRI) instantaneous cloud condensation nuclei (CCN) spectrometer and a 3010 TSI CN counter were mounted on the Battelle G-1 aircraft for the ARM-IOP in...

  8. SANDIA CORPORATION

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

    feedback, and improves communication. Any contract awarded by Sandia is a candidate for evaluation under this program. CN22 - PRICING OF CONTRACT AND SUBCONTRACT MODIFICATIONS...

  9. Application to Export Electric Energy OE Docket No. EA-249-C...

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

    EA-249-C Exelon Generation CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-249-C Exelon Generation Company, LLC: Federal Register...

  10. Application to Export Electric Energy OE Docket No. EA-196-D...

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

    export electric energy to Canada. Federal Register Notice. EA-196-D Minnesota Power (CN).pdf More Documents & Publications Application to Export Electric Energy OE Docket No....

  11. Application to Export Electric Energy OE Docket No. EA-327-A...

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

    to export electric energy to Canada. Federal Register Notice. EA-327A DC Energy CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No....

  12. Application to Export Electric Energy OE Docket No. EA-349-A...

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

    export electric energy to Canada. Federal Register Notice. EA-349-A Bruce Power Inc (CN).pdf More Documents & Publications Application to Export Electric Energy OE Docket No....

  13. Slide 1

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

    Counter (870 g) N CN ; D p > 10 nm TRH probe (50 g) Temperature & RH 1 inch CAD Modeling of Payload Instrument batteries Battery DAQ aethelometer PAR pyranometer...

  14. ARM - Publications: Science Team Meeting Documents: Determination...

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

    of this indirect effect detection is provided by downwelling longwave flux measurements from the NSA pyrgeometers, which show consistently larger fluxes in the high CN...

  15. NETL F 451.1/1-1, Categorical Exclusion Designation Form

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

    high-temperature synthesis followed by pressureless sintering for the fabrication of ceramic materials. Jason C. Hissam Digitally signed by Jason C. Hissam DN: cnJason C....

  16. Application to Export Electric Energy OE Docket No. EA-257-D...

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

    Services to export electric energy to Canada. Federal Register Notice. EA-257-D Emera Energy Svc (CN).pdf More Documents & Publications Application to Export Electric Energy OE...

  17. ARM - Publications: Science Team Meeting Documents

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

    cloud optical depth required to determine the observed surface flux. Aerosol number concentration at the SGP site was determined from the observed CN number concentration as well...

  18. Microsoft Word - Talks 20120822

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

    and Transport Model for Ultra-relativistic Heavy Ion Reactions Dr. Yun Cheng Central China Normal University, China yuncheng@phy.ccnu.edu.cn Abstract: Combining the hydrodynamic...

  19. EA-260-E CP Energy Marketing (US) Inc. | Department of Energy

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

    Order authorizing CP Energy Marketing to export electric energy to Canada. EA-260-E CP Energy Marketing (CN).pdf More Documents & Publications Application to Export Electric Energy...

  20. Molecular and Electronic Structure of Cyclic Trinuclear Gold(I) Carbeniate Complexes: Insights for Structure/Luminescence/Conductivity Relationships

    SciTech Connect (OSTI)

    McDougaldJr, Roy N; Chilukuri, Bhaskar; Jia, Huiping; Perez, Michael R; Rabaa, Hassan; Wang, Xiaoping; Nesterov, Vladimir; Cundari, Thomas R.; Gnade, Bruce E; Omary, Mohammad A

    2014-01-01

    An experimental and computational study of correlations between solid-state structure and optical/electronic properties of cyclotrimeric gold(I) carbeniates, [Au-3(RN=COR')(3)] (R, R' = H, Me, Bu-n, or (c)Pe), is reported. Synthesis and structural and photophysical characterization of novel complexes [Au-3(MeN=(COBu)-Bu-n)(3)], [Au-3((BuN)-Bu-n=COMe)(3)], [Au-3((BuN)-Bu-n=(COBu)-Bu-n)(3)], and [Au-3((c)PeN=COMe)(3)] are presented. Changes in R and R' lead to distinctive variations in solid-state stacking, luminescence spectra, and conductive properties. Solid-state emission and excitation spectra for each complex display a remarkable dependence on the solid-state packing of the cyclotrimers. The electronic structure of [Au-3(RN=COR')(3)] was investigated via molecular and solid-state simulations. Calculations on [Au-3(HN=COH)(3)] models indicate that the infinitely extended chain of eclipsed structures with equidistant Au-Au intertrimer aurophilic bonding can have lower band gaps, smaller Stokes shifts, and reduced reorganization energies (lambda). The action of one cyclotrimer as a molecular nanowire is demonstrated via fabrication of an organic field effect transistor and shown to produce a p-type field effect. Hole transport for the same cyclotrimer-doped within a poly(9-vinylcarbazole) host-produced a colossal increase in current density from similar to 1 to similar to 1000 mA/cm(2). Computations and experiments thus delineate the complex relationships between solid-state morphologies, electronic structures, and optoelectronic properties of gold(I) carbeniates.

  1. Green synthesis of boron doped graphene and its application as high performance anode material in Li ion battery

    SciTech Connect (OSTI)

    Sahoo, Madhumita; Sreena, K.P.; Vinayan, B.P.; Ramaprabhu, S.

    2015-01-15

    Graphical abstract: Boron doped graphene (B-G), synthesized by simple hydrogen induced reduction technique using boric acid as boron precursor, have more uneven surface as a result of smaller bonding distance of boron compared to carbon, showed high capacity and high rate capability compared to pristine graphene as an anode material for Li ion battery application. - Abstract: The present work demonstrates a facile route for the large-scale, catalyst free, and green synthesis approach of boron doped graphene (B-G) and its use as high performance anode material for Li ion battery (LIB) application. Boron atoms were doped into graphene framework with an atomic percentage of 5.93% via hydrogen induced thermal reduction technique using graphite oxide and boric acid as precursors. Various characterization techniques were used to confirm the boron doping in graphene sheets. B-G as anode material shows a discharge capacity of 548 mAh g{sup ?1} at 100 mA g{sup ?1} after 30th cycles. At high current density value of 1 A g{sup ?1}, B-G as anode material enhances the specific capacity by about 1.7 times compared to pristine graphene. The present study shows a simplistic way of boron doping in graphene leading to an enhanced Li ion adsorption due to the change in electronic states.

  2. Comparative mapping in the beige-satin region of mouse chromosome 13

    SciTech Connect (OSTI)

    Perou, C.M.; Pryor, R.; Kaplan, J.

    1997-01-15

    The proximal end of mouse chromosome (Chr) 13 contains regions conserved on human chromosomes 1q42-q44, 6p23-p21, and 7p22-p13. This region also contains mutations that may be models for human disease, including beige (human Chediak-Higashi syndrome). An interspecific backcross of SB/Le and Mus spretus mice was used to generate a molecular genetic linkage map of mouse chromosome 13 with an emphasis on the proximal region including beige (bg) and satin (sa). This map provides the gene order of the two phenotypic markers bg and sa relative to restriction fragment length polymorphisms and simple sequence length polymorphisms in 131 backcross animals. In parallel, we have created a physical map of the region using Nidogen (Nid) as a molecular starting point for cloning a YAC contig that was used to identify the beige gene. The physical map provides the fine-structure order of genes and anonymous DNA fragments that was not resolved by the genetic linkage mapping. The results show that the bg region of mouse Chr 13 is highly conserved on human Chr 1q42-q44 and provide a starting point for a complete functional analysis of the entire bg-sa interval. 37 refs., 4 figs., 1 tab.

  3. --No Title--

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

    PORDP3 57- 58 B-9Bg Percent out-patient health care HCOUTP3 60- 61 B-9Bh Percent ... 90- 93 COMMA9. B-9Bo Percent in-patient health care HCINP3 95- 96 B-10o Licensed bed ...

  4. 2011-2012 SECTION I: NUCLEAR STRUCTURE, FUNDAMENTAL INTERACTIONS...

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

    A. Tumino Highly excited high spin states in 22Ne V.Z. Goldberg, S.Yu. Torilov, M. Brenner, K.A. Gridnev, S.V. Khlebnikov, M. Mutterer, B.G. Novatski, Yu.G. Sobolev, W.H....

  5. "!#$&%'( )1032546...

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

    )&24;103254637987@'A )&24;B&18;DCFEHGPIRQSIT&21;&24;&19;UWVYX 5a b&22;c 4Ad&16;&17;ef&17;&21;&24;Bg&16;d&16;hpiqVsrp&24;gth iuhgs&17;&21;&18;vh&20;&22;&21;&25;&24;w Fxyd c efh...

  6. Early-lanthanide(III) acetonitrile–solvento adducts with iodide and noncoordinating anions

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

    Brown, Jessie L.; Davis, Benjamin L.; Scott, Brian L.; Gaunt, Andrew J.

    2015-12-25

    Dissolution of LnI3 (Ln = La, Ce) in acetonitrile (MeCN) results in the highly soluble solvates LnI3(MeCN)5 [Ln = La (1), Ce (2)] in good yield. The ionic complex [La(MeCN)9][LaI6] (4), containing a rare homoleptic La3+ cation and anion, was also isolated as a minor product. Extending this chemistry to NdI3 results in the consistent formation of the complex ionic structure [Nd(MeCN)9]2[NdI5(MeCN)][NdI6][I] (3), which contains an unprecedented pentaiodide lanthanoid anion. Also described is the synthesis, isolation, and structural characterization of several homoleptic early-lanthanide MeCN solvates with noncoordinating anions, namely, [Ln(MeCN)9][AlCl4]3 [Ln = La (5), Ce (6), Nd (7)]. Notably, complexmore » 6 is the first homoleptic cerium MeCN solvate reported to date. All reported complexes were structurally characterized by X-ray crystallography, as well as by IR spectroscopy and CHN elemental analysis. Furthermore, complexes 1–3 were also characterized by thermogravimetric analysis coupled with mass spectrometry to further elucidate their bulk composition in the solid-state.« less

  7. Transition metal complexes of oxazolinylboranes and cyclopentadienyl-bis(oxazolinyl)borates: Catalysts for asymmetric olefin hydroamination and acceptorless alcohol decarbonylation

    SciTech Connect (OSTI)

    Manna, Kuntal [Ames Laboratory

    2012-12-17

    The research presented and discussed in this dissertation involves the synthesis of transition metal complexes of oxazolinylboranes and cyclopentadienyl-bis(oxazolinyl)borates, and their application in catalytic enantioselective olefin hydroamination and acceptorless alcohol decarbonylation. Neutral oxazolinylboranes are excellent synthetic intermediates for preparing new borate ligands and also developing organometallic complexes. Achiral and optically active bis(oxazolinyl)phenylboranes are synthesized by reaction of 2-lithio-2-oxazolide and 0.50 equiv of dichlorophenylborane. These bis(oxazolinyl)phenylboranes are oligomeric species in solid state resulting from the coordination of an oxazoline to the boron center of another borane monomer. The treatment of chiral bis(oxazolinyl)phenylboranes with sodium cyclopentadienide provide optically active cyclopentadienyl-bis(oxazolinyl)borates H[PhB(C{sub 5}H{sub 5})(Ox{sup R}){sub 2}] [Ox{sup R} = Ox{sup 4S-iPr,Me2}, Ox{sup 4R-iPr,Me2}, Ox{sup 4S-tBu]}. These optically active proligands react with an equivalent of M(NMe{sub 2}){sub 4} (M = Ti, Zr, Hf) to afford corresponding cyclopentadienyl-bis(oxazolinyl)borato group 4 complexes {PhB(C{sub 5}H{sub 4})(Ox{sup R}){sub 2}}M(NMe{sub 2}){sub 2} in high yields. These group 4 compounds catalyze cyclization of aminoalkenes at room temperature or below, providing pyrrolidine, piperidine, and azepane with enantiomeric excesses up to 99%. Our mechanistic investigations suggest a non-insertive mechanism involving concerted C?N/C?H bond formation in the turnover limiting step of the catalytic cycle. Among cyclopentadienyl-bis(oxazolinyl)borato group 4 catalysts, the zirconium complex {PhB(C{sub 5}H{sub 4})(Ox{sup 4S-iPr,Me2}){sub 2}}Zr(NMe{sub 2}){sub 2} ({S-2}Zr(NMe{sub 2}){sub 2}) displays highest activity and enantioselectivity. Interestingly, {S-2}Zr(NMe{sub 2}){sub 2} also desymmetrizes olefin moieties of achiral non-conjugated aminodienes and aminodiynes during cyclization. The cyclization of aminodienes catalyzed by {S-2}Zr(NMe{sub 2}){sub 2} affords diastereomeric mixture of cis and trans cylic amines with high diasteromeric ratios and excellent enantiomeric excesses. Similarly, the desymmetrization of alkyne moieties in {S-2}Zr(NMe{sub 2}){sub 2}-catalyzed cyclization of aminodiynes provides corresponding cyclic imines bearing quaternary stereocenters with enantiomeric excesses up to 93%. These stereoselective desymmetrization reactions are significantly affected by concentration of the substrate, temperature, and the presence of a noncyclizable primary amine. In addition, both the diastereomeric ratios and enantiomeric excesses of the products are markedly enhanced by N-deuteration of the substrates. Notably, the cationic zirconium-monoamide complex [{S-2}Zr(NMe{sub 2})][B(C{sub 6}F{sub 5}){sub 4}] obtained from neutral {S-2}Zr(NMe{sub 2}){sub 2} cyclizes primary aminopentenes providing pyrrolidines with S-configuration; whereas {S-2}Zr(NMe{sub 2}){sub 2} provides R-configured pyrrolidines. The yttrium complex {S-2}YCH{sub 2}SiMe{sub 3} also affords S-configured pyrrolidines by cyclization of aminopentenes, however the enantiomeric excesses of products are low. An alternative optically active yttrium complex {PhB(C{sub 5}H{sub 4})(Ox{sup 4S-tBu}){sub 2}}YCH{sub 2}SiMe{sub 3} ({S-3}YCH{sub 2}SiMe{sub 3}) is synthesized, which displays highly enantioselective in the cyclization of aminoalkenes at room temperature affording S-configured cyclic amines with enantiomeric excesses up to 96%. A noninsertive mechanism involving a six-membered transition state by a concerted C?N bond formation and N?H bond cleavage is proposed for {S-3}YCH{sub 2}SiMe{sub 3} system based on the kinetic, spectroscopic, and stereochemical features. In the end, a series of bis- and tris(oxazolinyl)borato iridium and rhodium complexes are synthesized with bis(oxazolinyl)phenylborane [PhB(Ox{sup Me2}){sub 2}]{sub n}, tris(oxazolinyl)borane [B(Ox{sup Me2}){sub 3}]n, and tris(4,4-dimethyl-2-oxazolinyl)phenylborate [To{sup M}]{sup ?}. All these new an

  8. Recovery Efficiency, False Negative Rate, and Limit of Detection Performance of a Validated Macrofoam-Swab Sampling Method with Low Surface Concentrations of Two Bacillus anthracis Surrogates

    SciTech Connect (OSTI)

    Piepel, Gregory F.; Hutchison, Janine R.; Deatherage Kaiser, Brooke L; Amidan, Brett G.; Sydor, Michael A.; Barrett, Christopher A.

    2015-03-31

    The performance of a macrofoam-swab sampling method was evaluated using Bacillus anthracis Sterne (BAS) and Bacillus atrophaeus Nakamura (BG) spores applied at nine low target amounts (2-500 spores) to positive-control plates and test coupons (2 in. × 2 in.) of four surface materials (glass, stainless steel, vinyl tile, and plastic). Test results from cultured samples were used to evaluate the effects of surrogate, surface concentration, and surface material on recovery efficiency (RE), false negative rate (FNR), and limit of detection. For RE, surrogate and surface material had statistically significant effects, but concentration did not. Mean REs were the lowest for vinyl tile (50.8% with BAS, 40.2% with BG) and the highest for glass (92.8% with BAS, 71.4% with BG). FNR values ranged from 0 to 0.833 for BAS and 0 to 0.806 for BG, with values increasing as concentration decreased in the range tested (0.078 to 19.375 CFU/cm2, where CFU denotes ‘colony forming units’). Surface material also had a statistically significant effect. A FNR-concentration curve was fit for each combination of surrogate and surface material. For both surrogates, the FNR curves tended to be the lowest for glass and highest for vinyl title. The FNR curves for BG tended to be higher than for BAS at lower concentrations, especially for glass. Results using a modified Rapid Viability-Polymerase Chain Reaction (mRV-PCR) analysis method were also obtained. The mRV-PCR results and comparisons to the culture results will be discussed in a subsequent report.

  9. Nuclear Data Sheets for A = 50

    SciTech Connect (OSTI)

    Elekes, Zoltan; Timar, Janos; Singh, Balraj

    2011-01-15

    The experimental nuclear spectroscopic data for known nuclides of mass number 50 (Cl,Ar,K,Ca,Sc,Ti,V, Cr,Mn,Fe,Co,Ni) have been evaluated and presented together with Adopted properties for levels and {gamma} rays. This evaluation has been carried out about 15 years after the previous one by Thomas Burrows (1995Bu29). Except for {sup 50}Sc and {sup 50}V, extensive new data have become available for all the other nuclides in the intervening years. The data for {sup 50}Sc and {sup 50}V have also been checked again in detail and several changes made. No data are yet available for excited states in {sup 50}Cl, {sup 50}Ar and {sup 50}Ni. This work supersedes earlier evaluations (1995Bu29, 1990Bu18, 1984Al29, 1976Au07) of A=50 nuclides.

  10. The interactions of azure B, a metabolite of methylene blue, with acetylcholinesterase and butyrylcholinesterase

    SciTech Connect (OSTI)

    Petzer, Anl; Harvey, Brian H.; Petzer, Jacobus P.

    2014-02-01

    Methylene blue (MB) is reported to possess diverse pharmacological actions and is attracting increasing attention for the treatment of neurodegenerative disorders such as Alzheimer's disease. Among the pharmacological actions of MB, is the significant inhibition of acetylcholinesterase (AChE) and butyrylcholinesterase (BuChE). These activities may, at least in part, underlie MB's beneficial effects in Alzheimer's disease. MB is metabolized to yield N-demethylated products of which azure B, the monodemethyl metabolite, is the predominant species. Azure B has been shown to be pharmacologically active and also possesses a variety of biological actions. Azure B therefore may contribute to the pharmacological profile of MB. Based on these considerations, the present study investigates the possibility that azure B may, similar to MB, act as an inhibitor of human AChE and BuChE. The results document that azure B inhibits AChE and BuChE with IC{sub 50} values of 0.486 ?M and 1.99 ?M, respectively. The results further show that azure B inhibits AChE and BuChE reversibly, and that the modes of inhibition are most likely competitive. Although the AChE and BuChE inhibitory activities of azure B are twofold and fivefold, respectively, less potent than those recorded for MB [IC{sub 50}(AChE) = 0.214 ?M; IC{sub 50}(BuChE) = 0.389 ?M] under identical conditions, azure B may be a contributor to MB's in vivo activation of the cholinergic system and beneficial effects in Alzheimer's disease. - Highlights: Methylene blue (MB) is a known inhibitor of AChE and BuChE. Azure B, the major metabolite of MB, also is an inhibitor of AChE and BuChE. Azure B may be a contributor to MB's in vivo activation of the cholinergic system. Azure B may contribute to MB's potential in Alzheimer's disease therapy.

  11. Spectroelectrochemical Sensor for Pertechnetate Applicable to Hanford and Other DOE Sites

    SciTech Connect (OSTI)

    Heineman, William R; Seliskar, Carl J; Bryan, Samuel A

    2012-09-18

    The general aim of our work funded by DOE is the design and implementation of a new sensor technology that offers unprecedented levels of specificity needed for analysis of the complex chemical mixtures found at DOE sites nationwide. The specific goal of this project was the development of a sensor for technetium (Tc) that is applicable to characterizing and monitoring the vadose zone and associated subsurface water at the Hanford Site and other DOE sites. The concept for the spectroelectrochemical sensor is innovative and represents a breakthrough in sensor technology. The sensor combines three modes of selectivity (electrochemistry, spectroscopy, and selective partitioning) into a single sensor to substantially improve selectivity. The sensor consists of a basic spectroelectrochemical configuration that we have developed under our previous DOE grants: a waveguide with an optically transparent electrode (OTE) that is coated with a thin chemically-selective film that preconcnetrates the analyte. The key to adapting this generic sensor to detect TcO4- and Tc complexes lies in the development of chemically-selective films that preconcentrate the analyte and, when necessary, chemically convert it into a complex with electrochemical and spectroscopic properties appropriate for sensing. Significant accomplishments were made in the general areas of synthesis and characterization of polymer films that efficiently preconcentrate the analyte, development and characterization of sensors and associated instrumentation, and synthesis and characterization of relevant Re and Tc complexes. Two new polymer films for the preconcentration step in the sensor were developed: partially sulfonated polystyrene-block-poly(ethylene-ran-butylene)-block-polystyrene (SSEBS) and phosphine containing polymer films. The latter was a directed polymer film synthesis that combined the proper electrostatic properties to attract TcO4- and also incorporated a suitable ligand for covalently trapping a lower oxidation state Tc complex within the film for spectroelectrochemical detection. Spectroelectrochemical sensors were developed and demonstrated, first using [Re(dmpe)3]+ (dmpe = 1,2-bis(dimethylphosphino)ethane) as a model compound with the non-radioactive Re surrogate for radioactive Tc. A fluorescence based spectroelectrochemical sensor for [Tc(dmpe)3]+/2+was then developed using SSEBS as the preconcentrating film. Portable instrumentation for the fluorescence spectroelectrochemical sensor was fabricated and tested. The effects of components in Hanford subsurface water on sensor performance with a detailed evaluation of the effect of total ionic strength on sensitivity demonstrated the ability to use the spectroelectrochemical sensor on representative water samples. A variety Re and Tc complexes were synthesized and characterized to explore the best ligands to use for detection of Tc. A lower oxidation-state Tc-complex [Tc(dmpe)3]+ (dmpe = 1,2-bis(dimethylphosphino)ethane) was synthesized to use as a model compound for developing Tc sensors. [Tc(dmpe)3]+/2+ exhibited the important properties of solution fluorescence at ambient temperatures and reversible electrochemistry. A range of low oxidation state dioxo Re- and Tc-complexes of formulae [ReO2(py)4]+, [ReO2(CN)4]-, [ReO2(P-P)2]+ and [ReO2(S-S)2]+ (py = pyridine) were synthesized. An exhaustive study of the spectroscopy and electrochemistry of Re(diimine)(CO)3(halide) complexes was performed. These complexes served as models for the Tc(diimine)(CO)3(halide) complexes that were readily formed from Tc(CO)x(halides)6-x complexes which are themselves constituents of tank waste samples from Hanford. Of particular interest were new Tc complexes with the +5 and +6 oxidation states. Tetrabutylammonium salt of tetrachlorooxotechnetate(V), (nBu4N)[TcOCl4] (I) was synthesized and the structure determined. [TcO2(CN)4]3- , [TcO2(en)2]2+ , [TcO2(im)4]+, and [TcO2(py)4]+ (en = ethylenediamine; im = imidazole; py = pyridine) complexes were synthesized and solution and solid state 99Tc NMR spectra were acquired giving

  12. False Negative Rates of a Macrofoam-Swab Sampling Method with Low Surface Concentrations of Two Bacillus anthracis Surrogates via Real-Time PCR

    SciTech Connect (OSTI)

    Hutchison, Janine R.; Piepel, Gregory F.; Amidan, Brett G.; Sydor, Michael A.; Deatherage Kaiser, Brooke L

    2015-05-01

    Surface sampling for Bacillus anthracis spores has traditionally relied on detection via bacterial cultivation methods. Although effective, this approach does not provide the level of organism specificity that can be gained through molecular techniques. False negative rates (FNR) and limits of detection (LOD) were determined for two B. anthracis surrogates with modified rapid viability-polymerase chain reaction (mRV-PCR) following macrofoam-swab sampling. This study was conducted in parallel with a previously reported study that analyzed spores using a plate-culture method. B. anthracis Sterne (BAS) or B. atrophaeus Nakamura (BG) spores were deposited onto four surface materials (glass, stainless steel, vinyl tile, and plastic) at nine target concentrations (2 to 500 spores/coupon; 0.078 to 19.375 colony-forming units [CFU] per cm²). Mean FNR values for mRV-PCR analysis ranged from 0 to 0.917 for BAS and 0 to 0.875 for BG and increased as spore concentration decreased (over the concentrations investigated) for each surface material. FNRs based on mRV-PCR data were not statistically different for BAS and BG, but were significantly lower for glass than for vinyl tile. FNRs also tended to be lower for the mRV-PCR method compared to the culture method. The mRV-PCR LOD₉₅ was lowest for glass (0.429 CFU/cm² with BAS and 0.341 CFU/cm² with BG) and highest for vinyl tile (0.919 CFU/cm² with BAS and 0.917 CFU/cm² with BG). These mRV-PCR LOD₉₅ values were lower than the culture values (BAS: 0.678 to 1.023 CFU/cm² and BG: 0.820 to 1.489 CFU/cm²). The FNR and LOD₉₅ values reported in this work provide guidance for environmental sampling of Bacillus spores at low concentrations.

  13. Synthesis of alpha-amino acids

    DOE Patents [OSTI]

    Davis, Jr., Jefferson W. (San Francisco, CA)

    1983-01-01

    A method for synthesizing alpha amino acids proceding through novel intermediates of the formulas: R.sub.1 R.sub.2 C(OSOCl)CN, R.sub.1 R.sub.2 C(Cl)CN and [R.sub.1 R.sub.2 C(CN)O].sub.2 SO wherein R.sub.1 and R.sub.2 are each selected from hydrogen monovalent substituted and unsubstituted hydrocarbon radicals of 1 to 10 carbon atoms. The use of these intermediates allows the synthesis steps to be exothermic and results in an overall synthesis method which is faster than the snythesis methods of the prior art.

  14. Synthesis of alpha-amino acids

    DOE Patents [OSTI]

    Davis, Jr., Jefferson W. (San Francisco, CA)

    1983-01-01

    A method for synthesizing alpha amino acids proceding through novel intermediates of the formulas: R.sub.1 R.sub.2 C(OSOCl)CN, R.sub.1 R.sub.2 C(Cl)CN and [R.sub.1 R.sub.2 C(CN)O].sub.2 SO wherein R.sub.1 and R.sub.2 are each selected from hydrogen monovalent substituted and unsubstituted hydrocarbon radicals of 1 to 12 carbon atoms. The use of these intermediates allows the synthesis steps to be exothermic and results in an overall synthesis method which is faster than the synthesis methods of the prior art.

  15. Synthesis of alpha-amino acids

    DOE Patents [OSTI]

    Davis, Jr., Jefferson W. (San Francisco, CA)

    1983-01-01

    A method for synthesizing alpha amino acids proceeding through novel intermediates of the formulas: R.sub.1 R.sub.2 C(OSOCl)CN, R.sub.1 R.sub.2 C(Cl)CN and [R.sub.1 R.sub.2 C(CN)O].sub.2 SO wherein R.sub.1 and R.sub.2 are each selected from hydrogen monovalent substituted and unsubstituted hydrocarbon radicals of 1 to 12 carbon atoms. The use of these intermediates allows the synthesis steps to be exothermic and results in an overall synthesis method which is faster than the synthesis methods of the prior art.

  16. Synthesis of amino acids

    DOE Patents [OSTI]

    Davis, J.W. Jr.

    1979-09-21

    A method is described for synthesizing amino acids preceding through novel intermediates of the formulas: R/sub 1/R/sub 2/C(OSOC1)CN, R/sub 1/R/sub 2/C(C1)CN and (R/sub 1/R/sub 2/C(CN)O)/sub 2/SO wherein R/sub 1/ and R/sub 2/ are each selected from hydrogen and monovalent hydrocarbon radicals of 1 to 10 carbon atoms. The use of these intermediates allows the synthesis steps to be exothermic and results in an overall synthesis method which is faster than the synthesis methods of the prior art.

  17. HIGH PRESSURE COAL COMBUSTION KINETICS PROJECT

    SciTech Connect (OSTI)

    Stefano Orsino

    2003-07-25

    NEA completed the CFD simulations for all NBFZ tests. SRI resumed work on HPBO experiments and conducted preliminary tests using the UCONN impactor. UCONN prepared several samples of char for cross-sectional analysis by SEM and characterization is underway. BU completed the NBFZ char characterization program. CBK model had been implemented into Fluent.

  18. A=19C (72AJ02)

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

    72AJ02) (Not illustrated) 19C may have been observed in the 3 GeV proton bombardment of a 197Au target: if so it is particle stable (RA70). Its mass excess must then be < 37.9 MeV (18C + n). See also (ZE60A, BU71E

  19. A=20N (72AJ02)

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

    72AJ02) (Not illustrated) 20N has been observed in the bombardment of 232Th by 122 MeV 18O ions (AR69E, AR70D) and in the 3 GeV proton bombardment of 197Au (RA70): it is particle stable. See also (ZE60A, BA61F, BU71E

  20. Lanthanide(III) di- and tetra-nuclear complexes supported by a chelating tripodal tris(amidate) ligand

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

    Brown, Jessie L.; Jones, Matthew B.; Gaunt, Andrew J.; Scott, Brian L.; MacBeth, Cora E.; Gordon, John C.

    2015-04-06

    Syntheses, structural, and spectroscopic characterization of multinuclear tris(amidate) lanthanide complexes is described. Addition of K3[N(o-PhNC(O)tBu)3] to LnX3 (LnX3 = LaBr3, CeI3, and NdCl3) in N,N-dimethylformamide (DMF) results in the generation of dinuclear complexes, [Ln(N(o-PhNC(O)tBu)3)(DMF)]2(μ-DMF) (Ln = La (1), Ce (2), Nd(3)), in good yields. Syntheses of tetranuclear complexes, [Ln(N(o-PhNC(O)tBu)3)]4 (Ln = Ce (4), Nd(5)), resulted from protonolysis of Ln[N(SiMe3)2]3 (Ln = Ce, Nd) with N(o-PhNCH(O)tBu)3. As a result, in the solid-state, complexes 1–5 exhibit coordination modes of the tripodal tris(amidate) ligand that are unique to the 4f elements and have not been previously observed in transition metal systems.

  1. A=15N (70AJ04)

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

    70AJ04) (See Energy Level Diagrams for 15N) GENERAL: See Table 15.4 Table of Energy Levels (in PDF or PS) here. Model calculations:(HA57B, BR59M, FE59E, TA60L, BA61N, BU63D,...

  2. A=10B (66LA04)

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

    66LA04) (See Energy Level Diagrams for 10B) GENERAL: See (BA59F, BR59M, TA60L, TR61, IN62, BU63D, KU63B, ME63A, MO63C, OL63B, VL63A, WA63C, AM64, BA64V, FR64D, GR64C, MA64HH,...

  3. Slide 1

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

    95 Wa ste Sit es Re me dia ted 9 23 ,00 0 To ns of So il Re mo ved Fin al Re me dia tio n of 61 8-1 0 & 618 -11 Bu ria l Gr ou nd s Co mp let e 40 0 A re a Fa st Flu...

  4. A=7Li (1988AJ01)

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

    See also (1984AJ01) and Table 7.2 Table of Energy Levels (in PDF or PS) here. Shell model: (1983BU1B, 1983KU17, 1983SH1D, 1983VA31, 1984CH24, 1984REZZ, 1984VA06,...

  5. A=19F (1983AJ01)

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

    1978DA1N, 1978MA2H, 1979DA15, 1980KU05, 1980MC1L, 1981ER03, 1981GR06, 1982KI02). Cluster, collective and rotational models: (1977BU22, 1977FO1E, 1978BR21, 1978CH26,...

  6. NOIJLVaiSINIWaV NOIlVlAldOdNI AOU3N3 Z661

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

    ... Pliufi aqi ui JHDDO 04 pajoadxa si 661 u pueuiap CDHO u qiMOJ aqj jo juaojad gg uBqi ajopM '(Z 31BU.J uoijduinssB ...

  7. Experimental Design for a Macrofoam-Swab Study Relating the Recovery Efficiency and False Negative Rate to Low Concentrations of Two Bacillus anthracis Surrogates on Four Surface Materials

    SciTech Connect (OSTI)

    Piepel, Gregory F.; Hutchison, Janine R.

    2014-12-05

    This report describes the experimental design for a laboratory study to quantify the recovery efficiencies and false negative rates of a validated, macrofoam-swab sampling method for low concentrations of Bacillus anthracis Sterne (BAS) and Bacillus atrophaeus (BG) spores on four surface materials (stainless steel, glass, vinyl tile, plastic light cover panel). Two analytical methods (culture and polymerase chain reaction) will be used. Only one previous study has investigated how the false negative rate depends on test factors. The surrogates BAS and BG have not been tested together in the same study previously. Hence, this study will provide for completing gaps in the available information on the performance of macrofoam-swab sampling at low concentrations.

  8. Experimental Design for a Macrofoam Swab Study Relating the Recovery Efficiency and False Negative Rate to Low Concentrations of Two Bacillus anthracis Surrogates on Four Surface Materials

    SciTech Connect (OSTI)

    Piepel, Gregory F.; Hutchison, Janine R.

    2014-04-16

    This report describes the experimental design for a laboratory study to quantify the recovery efficiencies and false negative rates of a validated, macrofoam swab sampling method for low concentrations of Bacillus anthracis Sterne (BAS) and Bacillus atrophaeus (BG) spores on four surface materials (stainless steel, glass, vinyl tile, plastic light cover panel). Two analytical methods (plating/counting and polymerase chain reaction) will be used. Only one previous study has investigated false negative as a function of affecting test factors. The surrogates BAS and BG have not been tested together in the same study previously. Hence, this study will provide for completing gaps in the available information on the performance of macrofoam swab sampling at low concentrations.

  9. Defining photometric peculiar type Ia supernovae

    SciTech Connect (OSTI)

    Gonzlez-Gaitn, S.; Pignata, G.; Frster, F.; Gutirrez, C. P.; Bufano, F.; Galbany, L.; Hamuy, M.; De Jaeger, T. [Millennium Institute of Astrophysics, Casilla 36-D, Santiago (Chile); Hsiao, E. Y.; Phillips, M. M. [Carnegie Observatories, Las Campanas Observatory, Casilla 601, La Serena (Chile); Folatelli, G. [Kavli Institute for the Physics and Mathematics of the Universe, the University of Tokyo, Kashiwa 277-8583 (Kavli IPMU, WPI) (Japan); Anderson, J. P., E-mail: sgonzale@das.uchile.cl [European Southern Observatory, Alonso de Crdova 3107, Casilla 19, Santiago (Chile)

    2014-11-10

    We present a new photometric identification technique for SN 1991bg-like type Ia supernovae (SNe Ia), i.e., objects with light curve characteristics such as later primary maxima and the absence of a secondary peak in redder filters. This method is capable of selecting this sub-group from the normal type Ia population. Furthermore, we find that recently identified peculiar sub-types such as SNe Iax and super-Chandrasekhar SNe Ia have photometric characteristics similar to 91bg-like SNe Ia, namely, the absence of secondary maxima and shoulders at longer wavelengths, and can also be classified with our technique. The similarity of these different SN Ia sub-groups perhaps suggests common physical conditions. This typing methodology permits the photometric identification of peculiar SNe Ia in large upcoming wide-field surveys either to study them further or to obtain a pure sample of normal SNe Ia for cosmological studies.

  10. Characterization of UMT2013 Performance on Advanced Architectures

    SciTech Connect (OSTI)

    Howell, Louis

    2014-12-31

    This paper presents part of a larger effort to make detailed assessments of several proxy applications on various advanced architectures, with the eventual goal of extending these assessments to codes of programmatic interest running more realistic simulations. The focus here is on UMT2013, a proxy implementation of deterministic transport for unstructured meshes. I present weak and strong MPI scaling results and studies of OpenMP efficiency on the Sequoia BG/Q system at LLNL, with comparison against similar tests on an Intel Sandy Bridge TLCC2 system. The hardware counters on BG/Q provide detailed information on many aspects of on-node performance, while information from the mpiP tool gives insight into the reasons for the differing scaling behavior on these two different architectures. Preliminary tests that exploit NVRAM as extended memory on an Ivy Bridge machine designed for Big Data applications are also included.

  11. Enhancement of second harmonic generation in NaNO{sub 2}-infiltrated opal photonic crystal using structural light focusing

    SciTech Connect (OSTI)

    Zaytsev, Kirill I. Yurchenko, Stanislav O.

    2014-08-04

    Experimental and numerical results for second harmonic generation (SHG) in photonic crystal (PC) based on NaNO{sub 2}-infiltrated opal matrix are presented. SHG is performed in reflection mode; thus, the direction of the SHG maximum is equal to the angle of mirror reflection. The PC was pumped with femtosecond optical pulses at different angles of incidence, allowing the dependence of the SHG efficiency on the location of the fundamental wavelength toward the PC band gap (BG) to be examined. The most efficient SHG was observed when pumping the BG of the PC. To interpret the experimental results, finite-difference time-domain numerical simulations of the light interaction with the PC were conducted. The observed effect of highly efficient SHG is associated with structural light focusing, and, as a consequence, with strong optical field localization within certain near-surface PC regions. Thus, SHG enhancement based on structural light focusing in PC was demonstrated.

  12. The bgclang Compiler | Argonne Leadership Computing Facility

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

    Mira/Cetus/Vesta System Overview Data Storage & File Systems Compiling & Linking Overview of How to Compile and Link Example Program and Makefile for BG/Q How to Manage Threading bgclang Compiler Compiling and Linking FAQ Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new

  13. ARM - Events Article

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

    January 5, 2012 [Events] EGU 2012 Call for Abstracts Bookmark and Share Abstracts are being accepted for Session BG2.8: Remote Sensing and Data Assimilation in the Biogeosciences, which will take place during the 2012 European Geosciences Union General Assembly in Vienna, Austria, April 22-27. This session aims to bring together scientists developing remote sensing techniques, products, and models leading to strategies with a higher (bio-geophysical) impact on the stability and sustainability of

  14. Performance Application Programming Interface

    Energy Science and Technology Software Center (OSTI)

    2005-10-31

    PAPI is a programming interface designed to provide the tool designer and application engineer with a consistent interface and methodology for use of the performance counter hardware found in most major microprocessors. PAPI enables software engineers to see, in near real time, the relation between software performance and processor events. This release covers the hardware dependent implementation of PAPI version 3 for the IBM BlueGene/L (BG/L) system.

  15. ARM - Publications: Science Team Meeting Documents

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

    Aerosol-Cloud-Radiation Interaction: A Comparison of GCM Results versus Surface Observations Liepert, B.G., Lamont-Doherty Earth Observatory of Columbia University; Lohmann, U., Dalhousie University, Halifax, Canada Ninth Atmospheric Radiation Measurement (ARM) Science Team Meeting The change in cloud properties due to increased anthropogenic emissions of aerosols and their precursor gases is referred to as "indirect aerosol effect." Estimates with general circulation models (GCMs)

  16. Queueing & Running Jobs | Argonne Leadership Computing Facility

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

    System Overview Data Storage & File Systems Compiling & Linking Queueing & Running Jobs Reservations Cobalt Job Control How to Queue a Job Running Jobs FAQs Queuing and Running on BG/Q Systems Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Queueing &

  17. Data Policy | Argonne Leadership Computing Facility

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

    Policies Accounts Policy Account Sponsorship & Retention Policy ALCC Quarterly Report Policy ALCF Acknowledgment Policy Data Policy INCITE Quarterly Report Policy Job Scheduling Policy on BG/Q Job Scheduling Policies on Cooley Pullback Policy Refund Policy Software Policy User Authentication Policy Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Data Policy Contents ALCF Data

  18. Disk Quota | Argonne Leadership Computing Facility

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

    BG/Q File Systems Disk Quota Using HPSS Compiling & Linking Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Disk Quota Mira, Cetus and Vesta Disk quotas are enabled on Mira, Cetus and Vesta home and project directories. The details of those

  19. Compiling and Linking FAQ | Argonne Leadership Computing Facility

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

    Overview of How to Compile and Link Example Program and Makefile for BG/Q How to Manage Threading bgclang Compiler Compiling and Linking FAQ Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Compiling and Linking FAQ Contents Where do I find

  20. INCITE Quarterly Report Policy | Argonne Leadership Computing Facility

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

    Cooley Policies Accounts Policy Account Sponsorship & Retention Policy ALCC Quarterly Report Policy ALCF Acknowledgment Policy Data Policy INCITE Quarterly Report Policy Job Scheduling Policy on BG/Q Job Scheduling Policies on Cooley Pullback Policy Refund Policy Software Policy User Authentication Policy Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] INCITE Quarterly Report Policy

  1. Blue Gene/Q Versus Blue Gene/P | Argonne Leadership Computing Facility

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

    System Overview Blue Gene/Q Versus Blue Gene/P BG/Q Drivers Status Machine Overview Machine Partitions Torus Network Data Storage & File Systems Compiling & Linking Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Blue Gene/Q Versus Blue

  2. Account Sponsorship & Retention Policy | Argonne Leadership Computing

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

    Facility Allocations Mira/Cetus/Vesta Cooley Policies Accounts Policy Account Sponsorship & Retention Policy ALCC Quarterly Report Policy ALCF Acknowledgment Policy Data Policy INCITE Quarterly Report Policy Job Scheduling Policy on BG/Q Job Scheduling Policies on Cooley Pullback Policy Refund Policy Software Policy User Authentication Policy Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback

  3. Compiling & Linking | Argonne Leadership Computing Facility

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

    System Overview Data Storage & File Systems Compiling & Linking Overview of How to Compile and Link Example Program and Makefile for BG/Q How to Manage Threading bgclang Compiler Compiling and Linking FAQ Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource.

  4. Effective Radius of Cloud Droplets by Ground-Based Remote Sensing: Relationships to Aerosol?

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

    Effective Radius of Cloud Droplets by Ground-Based Remote Sensing: Relationships to Aerosol? B.-G. Kim, S. E. Schwartz, and M. A. Miller Environmental Sciences Department Brookhaven National Laboratory Upton, New York Q.-L. Min Atmospheric Science Research Center State University of New York Albany, New York Introduction Aerosol Indirect Effect Increases in anthropogenic sources of cloud condensation nuclei can increase cloud albedo by increasing the concentration and reducing the size of cloud

  5. Policies | Argonne Leadership Computing Facility

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

    Accounts Policy Account Sponsorship & Retention Policy ALCC Quarterly Report Policy ALCF Acknowledgment Policy Data Policy INCITE Quarterly Report Policy Job Scheduling Policy on BG/Q Job Scheduling Policies on Cooley Pullback Policy Refund Policy Software Policy User Authentication Policy Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] Policies Official policies and procedures of the ALCF.

  6. How to Manage Threading | Argonne Leadership Computing Facility

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

    Overview of How to Compile and Link Example Program and Makefile for BG/Q How to Manage Threading bgclang Compiler Compiling and Linking FAQ Queueing & Running Jobs Data Transfer Debugging & Profiling Performance Tools & APIs Software & Libraries IBM References Cooley Policies Documentation Feedback Please provide feedback to help guide us as we continue to build documentation for our new computing resource. [Feedback Form] How to Manage Threading Contents Performance

  7. Microsoft Word - V_1-10_Papers Published 2015.docx

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

    4 - March 31, 2015 Determination of the asymptotic normalization coefficients for 14 C + n 15 C, the 14 C(n, ) 15 C reaction rate, and evaluation of a new method to determine...

  8. Extracellular Proteins Promote Zinc Sulfide Aggregation

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

    amino acids, thus confirming the NanoSIMS analysis. NanoSIMS secondary-ion images of an ultramicrotomed TEM section of biofilm. Nitrogen was detected as CN-, NO-,...

  9. ARM - Data Announcements Article

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

    EE Clothiaux, KL Gaustad, JC Golaz, SD Hall, MP Jensen, KL Johnson, Y Lin, CN Long, JH Mather, RA McCord, SA McFarlane, G Palanisamy, Y Shi, and DD Turner. 2010. "ARM Climate...

  10. K and Mn co-doped BaCd{sub 2}As{sub 2}: A hexagonal structured...

    Office of Scientific and Technical Information (OSTI)

    Authors: Yang, Xiaojun ; Zhang, Pan ; Jiang, Hao ; Luo, Yongkang ; Chen, Qian ; Feng, Chunmu ; Tao, Qian ; Cao, Guanghan ; Xu, Zhu-An, E-mail: zhuan@zju.edu.cn 1 ; Li, Yuke ; ...

  11. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    ... Chinese Academy of Sciences, Beijing 100190 ; Huang, Long-Gang ; Pan, Nan ; Lei, Ming, E-mail: mlei@bupt.edu.cn Pulse interactions affect pulse qualities during the propagation. ...

  12. 38th Int. Conf. on Vacuum UV and X-ray Physics - VUVX2013

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

    38th Int. Conf. on Vacuum UV and X-ray Physics - VUVX2013 http://vuvx2013.ustc.edu.cn/dct/page/1 12-18 July, 2013; Hefei, China

  13. ,"U.S. Natural Gas Pipeline Imports From Canada (MMcf)"

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

    ,,"(202) 586-8800",,,"01292016 9:45:31 AM" "Back to Contents","Data 1: U.S. Natural Gas Pipeline Imports From Canada (MMcf)" "Sourcekey","N9102CN2" "Date","U.S. Natural Gas...

  14. 20C

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

    1989LE16, 1989LEZM, 1989MUZU: 20C(-n); measured T12, -delayed neutron emission probabilities. 1990LEZR: 20C; measured neutron spectra following -decay. 1990MU06:...

  15. Analysis of NaOH releases for Hanford tank farms

    SciTech Connect (OSTI)

    Ryan, G.W., Westinghouse Hanford

    1996-09-12

    The information contained in the canceled document is now located in the document: Consequence Analysis of a NaOH Solution Spray Release During Addition to Waste Tank, WHC-SD-WM-CN-065.

  16. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    Dirac cones in transition metal doped boron nitride Feng, Min ; Cao, Xuewei ; Shao, Bin ; Zuo, Xu, E-mail: xzuo@nankai.edu.cn The transition metal (TM) doped zinc blende boron ...

  17. Acoustic subwavelength imaging of subsurface objects with acoustic...

    Office of Scientific and Technical Information (OSTI)

    liuxiaojun@nju.edu.cn 1 ; State Key Laboratory of Acoustics, Institute of Acoustics, Chinese Academy of Sciences, Beijing 100190 2 ; Zhou, Chen ; Wei, Qi ; Wu, DaJian 1 +...

  18. Office of Enterprise Assessment Targeted Review of the Safety...

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

    Procedures Update Training ARP-300 R1 CN1, OP-102 R5 B-1 Letter from Johnny Moore to Thomas Mason, 1172014, FY 2014 Contractor Formal Assessment Program Schedule for...

  19. Method for metabolizing carbazole in petroleum

    DOE Patents [OSTI]

    Kayser, Kevin J.; Kilbane, II, John J.

    2005-09-13

    A method for selective cleavage of C--N bonds genes that encode for at least one enzyme suitable for conversion of carbazole to 2-aminobiphenyl-2,3-diol are combined with a gene encoding an amidase suitable for selectively cleaving a C--N bond in 2-aminobiphenyl-2,3-diol, forming an operon that encodes for cleavage of both C--N bonds of said carbazole. The operon is inserted into a host culture which, in turn, is contacted with the carbazole, resulting in selective cleavage of both C--N bonds of the carbazole. Also disclosed is a new microorganism that expresses a carbazole degradation trait constitutively and a method for degrading carbazole employing this microorganism.

  20. A comparison between characteristics of atmospheric-pressure...

    Office of Scientific and Technical Information (OSTI)

    Authors: Zhang, Cheng ; Shao, Tao, E-mail: st@mail.iee.ac.cn ; Wang, Ruixue ; Yan, Ping 1 ; Key Laboratory of Power Electronics and Electric Drive, Chinese Academy of Sciences, ...

  1. EA-342-A Royal Bank of Canada | Department of Energy

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

    -A Royal Bank of Canada EA-342-A Royal Bank of Canada Order authorizing Royal Bank of Canada to export electric energy to Canada. PDF icon EA-342-A RBC (CN).pdf More Documents &...

  2. EA-365-A Centre Lane Trading Limited | Department of Energy

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

    Centre Lane (CN).pdf More Documents & Publications EA-359-B Castleton Commodities Merchant Trading L.P. EA-342-A Royal Bank of Canada EA-367-A EDF Trading North America,LLC...

  3. EA-196-D Minnesota Power | Department of Energy

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

    Power (CN).pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-196-D Minnesota Power EA-409 Saracen Power LP EA-342-A Royal Bank of Canada...

  4. Application to Export Electric Energy OE Docket No. EA-249-C...

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

    EA-249-C Exelon CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-249-C Exelon Generation Company, LLC Application to Export Electric...

  5. Bioproducts to Enable Biofuels Workshop Summary Report

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

    ... for an existing petrochemical * The product is a novel molecule (i.e., not a direct ... Beau Hoffman Sr. Project Engineer CN-JV 1617 Cole Blvd Golden, CO 80401 ...

  6. Application to Export Electric Energy OE Docket No. EA-388 TEC...

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

    TEC Energy to export electric energy to Canada. Federal Register Notice. EA-388 TEC CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-388...

  7. J

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

    G.N. Knyazheva FLNR, J INR Interna5onal S ymposium Superheavy N uclei 2 015 Texas, U SA, M arch 2 015 Fusion p robability i n heavy i on i nduced reac4ons Fusion p robability SHE2015 2 σ ER = σ cap × P CN × W sur Fusion p robability SHE2015 3 σ ER = σ cap × P CN × W sur Compe55on b etween F usion a nd Quasifission * Z 1 Z 2 * Entrance c hannel m ass a symmetry α * Mean fi ssility p arameter X m =0.75X eff +0.25X CN P CN i s a f unc5on o f r eac5on e ntrance c hannel * ER a nd fi ssion c

  8. EA-380 Freeport Commodities | Department of Energy

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

    electric energy to Canada. EA-380 Freepoint CN.docx More Documents & Publications EA-379 FreePoint Commodities EA-196-A Minnesota Power, Sales EA-220-A NRG Power Marketing, Inc...

  9. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    a variety of techniques, including peat C:N ratios, 13C and 15N isotopic composition, Fourier Transform Infrared (FT IR), and 13C Nuclear Magnetic Resonance spectroscopy (13C...

  10. 2nd conference on Intense field- Short Wavelength Atomic and Molecular

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

    Processes - ISWAMP2 nd conference on Intense field- Short Wavelength Atomic and Molecular Processes - ISWAMP2 http://iswamp2.jlu.edu.cn/ July 20-22, 2013; Xi'an, China

  11. EA-404 Chubu TT Energy Management Inc. | Department of Energy

    Energy Savers [EERE]

    EA-404 Chubu TT Energy Management Inc. EA-404 Chubu TT Energy Management Inc. Order authorizing Chubu TT to export electric energy to Canada. EA-404 Chubu TT (CN).pdf More...

  12. EA-359-B Castleton Commodities Merchant Trading L.P. | Department...

    Energy Savers [EERE]

    (CN).pdf More Documents & Publications EA-359-A Castleton Commodities Merchant Trading L.P. EA-365-A Centre Lane Trading Limited EA-339-A Shell Energy North America (US),...

  13. Application to Export Electric Energy OE Docket No. EA-287-B...

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

    EESS US No. 1) to export electric energy to Canada. Federal Register Notice EA-287-B Emera Energy US No 1 (CN).pdf More Documents & Publications Application to Export Electric...

  14. Application to Export Electric Energy OE Docket No. EA-312-A...

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

    Emera Energy US No. 2 (CN).pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-287-B Emera Energy U.S. Subsidiary No. 1, Inc.: Federal...

  15. Application to Export Electric Energy OE Docket No. EA-393 Emera...

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

    EA-393 Emera Energy EESS-8 CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-391 Emera Energy Services Subsidiary No. 6 LLC: Federal...

  16. Application to Export Electric Energy OE Docket No. EA-392 Emera...

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

    EA-392 Emera Energy EESS-7 CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-391 Emera Energy Services Subsidiary No. 6 LLC: Federal...

  17. Application to Export Electric Energy OE Docket No. EA-97-D Portland...

    Office of Environmental Management (EM)

    Company Application to Export Electric Energy OE Docket No. EA-97-D Portland General Electric Company Application from PGE to export electric energy to Canada. EA-97-D PGE (CN).pdf...

  18. Application to Export Electric Energy OE Docket No. EA-321-A...

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

    Emera to export electric energy to Canada. Federal Register Notice. EA-321-A to EA-325-A Emera CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket...

  19. Application to Export Electric Energy OE Docket No. EA-410 CWP...

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

    CWP Energy to transmit electric energy to Canada. EA-410 CWP Energy (CN).pdf More Documents & Publications EA-410 CWP Energy Application to Export Electric Energy OE Docket No....

  20. Application to Export Electric Energy OE Docket No. EA-392 Emera...

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

    EA-392 Emera Energy Sub. 7 (CN).pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-391 Emera Energy Services Subsidiary No. 6 LLC...

  1. 1

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

    who require access must be United States citizens, or foreign nationals who are legal aliens or have the required authorization to perform work in the Unites States. CN38 -...

  2. Main Title 32pt

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

    Schockley-Read-Hall Auger- like Spontaneous Emission 2 Cn Bn A Bn INJ IQE + + Shockley-Read-Hall Spontaneous Emission Auger-like Target: 200 Acm 2 1 2 3 0.E+00 2.E-04...

  3. 1

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

    ... March 14-18, 2005 Mlawer, EJ, TR Shippert, CN Long, MA Miller, KL Johnson, DT Troyan, GG Mace, SA Clough, MH Zhang, SC Xie, RT Cederwall, JJ Yio, DR Doelling, DA Rutan, DD ...

  4. Research Highlight

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

    Journal Reference: Long CN, SA McFarlane, A Del Genio, P Minnis, TP Ackerman, J Mather, J Comstock, GG Mace, M Jensen, and C Jakob. 2013. "ARM research in the equatorial western ...

  5. ARM - 2012 AGU Presentations Featuring ARM Data

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

    ... Measurements Collected by the ARM Program GG Mace, S Cooper, DJ Posselt 3:10 pm, M-West ... G Bland, CN Flagg, SA Klein, P Kollias, GG Mace, M Reynolds, SE Schwartz, P Siebesma, ...

  6. LANSCE | Lujan Center | Publications

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

    ... Journal article, High Impact 17 NPDF 36 2009 GG Yapici, CN Tome, IJ Beyerlein, I Karaman, SC Vogel, C Liu, Plastic flow anisotropy of pure zirconium after severe plastic ...

  7. Microsoft Word - Talks 20120822

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

    and charge multiplicities Dr. Dai-Mei Zhou Institute of Particle Physics, Central China Normal University zhoudm@phy.ccnu.edu.cn Abstract: We use the non-statistical...

  8. TITLE AUTHORS SUBJECT SUBJECT RELATED DESCRIPTION PUBLISHER AVAILABILI...

    Office of Scientific and Technical Information (OSTI)

    with an exchangeable proton is eventually formed We have determined the bond dissociation free energy and pKa of the new O H bond in to be kcal mol and respectively in CH CN...

  9. A Holistic Framework for Environmental Flows Determination in...

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

    ... North American Journal of Fisheries Management 24:397-407. Moir H.J., C.N. Gibbins, C. Soulsby, A.F. ... J. D. Allan. (1995) Functional-organization of stream fish assemblages in ...

  10. September 2015 Most Viewed Documents for National Defense | OSTI...

    Office of Scientific and Technical Information (OSTI)

    of bridges Van Groningen, C.N.; Paddock, R.A. (1997) 63 The Effects of Nuclear Weapons Glasstone, Samuel (1964) 63 Comments on TNT Equivalence Cooper, P.W. (1994) 63 ...

  11. EA-257-D Emera Energy Services, Inc. | Department of Energy

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

    Svcs to export electric energy to Canada. EA-257-D Emera Energy Svcs (CN).pdf More Documents & Publications EA-257-D Emera Energy Services, Inc. Application to Export Electric...

  12. EA-97-D Portland General Electric Company | Department of Energy

    Office of Environmental Management (EM)

    D Portland General Electric Company EA-97-D Portland General Electric Company Order authorizing PGE to export electric energy to Canada. PDF icon EA-97-D PGE (CN).pdf More...

  13. EA-171-D Powerex Corp. | Department of Energy

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

    Order authorizing Powerex to export electric energy to Canada. EA-171-D Powerex CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-171-D...

  14. Development of high strength hydroxyapatite for bone tissue regeneration using nanobioactive glass composites

    SciTech Connect (OSTI)

    Shrivastava, Pragya; Dalai, Sridhar; Vijayalakshmi, S.; Sudera, Prerna; Sivam, Santosh Param; Sharma, Pratibha

    2013-02-05

    With an increasing demand of biocompatible bone substitutes for the treatment of bone diseases and bone tissue regeneration, bioactive glass composites are being tested to improvise the osteoconductive as well as osteoinductive properties. Nanobioactive glass (nBG) composites, having composition of SiO{sub 2} 70 mol%, CaO 26 mol % and P{sub 2}O{sub 5} 4 mol% were prepared by Freeze drying method using PEG-PPG-PEG co-polymer. Polymer addition improves the mechanical strength and porosity of the scaffold of nBG. Nano Bioactive glass composites upon implantation undergo specific reactions leading to the formation of crystalline hydroxyapatite (HA). This is tested in vitro using Simulated Body Fluid (SBF). This high strength hydroxyapatite (HA) layer acts as osteoconductive in cellular environment, by acting as mineral base of bones, onto which new bone cells proliferate leading to new bone formation. Strength of the nBG composites as well as HA is in the range of cortical and cancellous bone, thus proving significant for bone tissue regeneration substitutes.

  15. Research Highlight

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

    Increased Accuracy for Sky Imager Retrievals Download a printable PDF Submitter: Long, C. N., NOAA Global Monitoring Division/CIRES Area of Research: Cloud Distributions/Characterizations Working Group(s): Cloud Properties Journal Reference: Long CN. 2010. "Correcting for circumsolar and near-horizon errors in sky cover retrievals from sky images." The Open Atmospheric Science Journal, 4, doi:10.2174/1874282301004010045. Long CN, JM Sabburg, J Calbo, and D Pages. 2006. "Retrieving

  16. A=12O (1985AJ01)

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

    5AJ01) (See the Isobar Diagram for 12O) 12O has been observed in the 16O(α, 8He) reaction at Eα = 117.4 MeV (1978KE06) and in the 12C(π+, π-) reaction at Eπ = 164 MeV (1983BL08; see for angular distribution) and 180 MeV (1980BU15). The mass excess of 12O is 32.10 ± 0.12 MeV (1978KE06), 32.059 ± 0.048 MeV (1980BU15): we adopt 32.065 ± 0.045 MeV. 12O is thus unstable to decay into 10C + 2p by 1.79 MeV and into 11N* + p by 0.45 MeV [note that 11N* is probably not the ground state of 11N and

  17. A=7Be (1988AJ01)

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

    8AJ01) (See Energy Level Diagrams for 7Be) GENERAL: See also (1984AJ01) and Table 7.7 [Table of Energy Levels] (in PDF or PS) here. Nuclear models: (1983BU1B, 1983FU1D, 1983HO22, 1983PA06, 1984BA53, 1984KA06, 1984WA02, 1985FI1E, 1986FI07, 1986KR12, 1986VA13). Special states: (1982PO12, 1983BU1B, 1983HO22, 1984FI20, 1984WA02, 1985FI1E, 1986FI07, 1986VA13, 1986XU02, 1988KW02). Electromagnetic transitions, giant resonances: (1984KA06, 1985FI1E, 1986FI07, 1986ME13). Astrophysical questions:

  18. Evaluating ligands for use in polymer ligand film (PLF) for plutonium and uranium extraction

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

    Rim, Jung H.; Peterson, Dominic S.; Armenta, Claudine E.; Gonzales, Edward R.; Ünlü, Kenan

    2015-05-08

    We describe a new analyte extraction technique using Polymer Ligand Film (PLF). PLFs were synthesized to perform direct sorption of analytes onto its surface for direct counting using alpha spectroscopy. The main focus of the new technique is to shorten and simplify the procedure for chemically isolating radionuclides for determination through a radiometric technique. 4'(5')-di-t-butylcyclohexano 18-crown-6 (DtBuCH18C6) and 2-ethylhexylphosphonic acid (HEH[EHP]) were examined for plutonium extraction. Di(2-ethyl hexyl) phosphoric acid (HDEHP) were examined for plutonium and uranium extraction. DtBuCH18C6 and HEH[EHP] were not effective in plutonium extraction. HDEHP PLFs were effective for plutonium but not for uranium.

  19. Application of Gold Electrodes for the Study of Nickel Based Homogeneous Catalysts for Hydrogen Oxidation

    SciTech Connect (OSTI)

    Nepomnyashchii, Alexander B.; Liu, Fei; Roberts, John A.; Parkinson, Bruce A.

    2013-08-12

    Gold and glassy carbon working electrode materials are compared as suitable substrates for the hydrogen oxidation reaction with Ni(PCy2Nt-Bu2)2(BF4)2 used as a catalyst. Voltammetric responses showing electrocatalytic hydrogen oxidation mediated by the homogeneous electrocatalyst Ni(PCy2Nt-Bu2)2(BF4)2 are identical at glassy carbon and gold electrodes, which shows that gold electrode can be used for hydrogen oxidation reaction. This work is supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the US Department of Energy, Office of Science, Office of Basic Energy Sciences under FWP 56073.

  20. A=18C (72AJ02)

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

    72AJ02) (Not illuatrated) 18C is particle stable. Therefore its atomic mass excess, M - A, must be < 29.84 MeV [16C + 2n] (WA70E). 18C has been observed in the bombardment of 232Th by 122 MeV 18O ions (AR69E, AR70D) and in the 3 GeV proton bombardment of Au (RA70). See also (ZE60A, PO68B, BU71E

  1. Intermolecular C?H bond activation of benzene and pyridines by a vanadium(III) alkylidene including a stepwise conversion of benzene to a vanadium-benzyne complex

    SciTech Connect (OSTI)

    Andino, Jos G.; Kilgore, Uriah J.; Pink, Maren; Ozarowski, Andrew; Krzystek, J.; Telser, Joshua; Baik, Mu-Hyun; Mindiola, Daniel J.

    2012-01-20

    Breaking of the carbon-hydrogen bond of benzene and pyridine is observed with (PNP)V(CH{sub 2}tBu){sub 2} (1), and in the case of benzene, the formation of an intermediate benzyne complex (C) is proposed, and indirect proof of its intermediacy is provided by identification of (PNP)VO({eta}{sup 2}-C{sub 6}H{sub 4}) in combination with DFT calculations.

  2. Radioisotope thermoelectric generator transportation system safety analysis report for packaging. Volumes 1 and 2

    SciTech Connect (OSTI)

    Ferrell, P.C.

    1996-04-18

    This SARP describes the RTG Transportation System Package, a Type B(U) packaging system that is used to transport an RTG or similar payload. The payload, which is included in this SARP, is a generic, enveloping payload that specifically encompasses the General Purpose Heat Source (GPHS) RTG payload. The package consists of two independent containment systems mounted on a shock isolation transport skid and transported within an exclusive-use trailer.

  3. BandelierDirections2011

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

    a r k i n g M E R G E T o T o w n s it e D ia m o n d D ri v e To Sa n ta Fe T o J e m e z M ts . Co mm ut er Bu s Dr op Of f P a r k i n g M E R G E M E R G E T o T o w n s i t e...

  4. Hydro-Pac Inc., A High Pressure Company | Department of Energy

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

    Hydro-Pac Inc., A High Pressure Company Hydro-Pac Inc., A High Pressure Company This presentation was given at the DOE Hydrogen Compression, Storage, and Dispensing Workshop in March 2013. PDF icon csd_workshop_6_siefert.pdf More Documents & Publications 2013 Hydrogen Compression, Storage, and Dispensing Cost Reduction Workshop Final Report Haskel/BuTech/PPI Hydrogen Transmission and Distribution Workshop

  5. Class 1 Permit Modification Notification

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

    Waste Bureau New Mexico Environment Department 2905 Rodeo Park Drive East, Bu il ding 1 Santa Fe, New Mexico 87505-6303 JUL 0 5 2011 Subject: Notification of a Class 1 Permit Modification to the Hazardous Waste Facility Permit, Permit Number: NM4890139088-TSDF Dear Mr. Kieling : Enclosed is a Class 1 Permit Modification Notification 1 0: * Update Emergency Coordinator list We certify under penalty of law that this document and the enclosure were prepared under our direction or supervision in

  6. Mr. John E. Kieling, Bureau Chief Hazardous Waste Bureau

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

    Resource Protection Division New Mexico Environment Department 2905 Rodeo Park Drive East, Building 1 Santa Fe, NM 87508-6303 New Mexico Environment Department Harold Runnels Bu ildi ng 1190 Saint Francis Drive, PO Box 5496 Santa Fe, NM 87502-5469 Subject: Fifth Supplement to the Report of Implementation of the Waste Isolation Pilot Plant Facility Resource Conservation and Recovery Act Contingency Plan on April 11, 2014 Dear Mr. Kieling and Ms. Roberts: On April11 , 2014, the Department of

  7. The Role of Additive in Diketopyrrolopyrrole-based Small Molecular Bulk

    Office of Scientific and Technical Information (OSTI)

    Heterojunction Solar Cells (Journal Article) | SciTech Connect Journal Article: The Role of Additive in Diketopyrrolopyrrole-based Small Molecular Bulk Heterojunction Solar Cells Citation Details In-Document Search Title: The Role of Additive in Diketopyrrolopyrrole-based Small Molecular Bulk Heterojunction Solar Cells Authors: Wang, Hongyu ; Liu, Feng ; Bu, Laju ; Gao, Jun ; Wang, Cheng ; Wei, Wei ; Russell, Thomas P. Publication Date: 2013-08-29 OSTI Identifier: 1160446 DOE Contract

  8. Nuclear Data Sheets for A = 68

    SciTech Connect (OSTI)

    McCutchan, E. A.

    2012-07-01

    The experimental results from the various reaction and radioactive decay studies leading to nuclides in the A = 68 mass chain have been reviewed. Nuclides ranging from Cr (Z = 24) to Br (Z = 35) are included. For these nuclei, level and decay schemes, as well as tables of nuclear properties, are given. This work supersedes the previous evaluation of the data on these nuclides (2002Bu29).

  9. Microsoft PowerPoint - Lin_2014_CNMS_UserScienceHighlight_NatNano.pptx [Read-Only]

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

    show the fabrication of flexible metallic nanowires and their Y-junction structures from a semiconducting transition-metal dichalcogenide (TMDC) monolayer via electron irradiation in an aberration-corrected scanning transmission electron microscope. Bu using a combination of in- situ experiments and theoretical calculations, we were able to characterize the electrical properties and mechanical flexibility of the nanowires. TMDC materials have been considered as promising candidates for next

  10. Everest Refrigeration: Proposed Penalty (2015-SE-42001) | Department of

    Office of Environmental Management (EM)

    Energy Proposed Penalty (2015-SE-42001) Everest Refrigeration: Proposed Penalty (2015-SE-42001) June 3, 2015 DOE alleged in a Notice of Proposed Civil Penalty that Bu Sung America Corporation (dba Everest Refrigeration) manufactured and distributed noncompliant commercial refrigeration equipment model ESGR3 in the U.S. Federal law subjects manufacturers and private labelers to civil penalties if those parties distribute in the U.S. products that do not meet applicable energy conservation

  11. MEMORANDUM TO: FILE DATE

    Office of Legacy Management (LM)

    -.. 37qg: MEMORANDUM TO: FILE DATE =b-- FROM: ---L- _------__ u . SUBJECT: SITE ACl= ALTERNATE NAME: -_______-~-----------------NA~E:__( CITY:--~---------_-STATE:-~~ (2 OWNE!sI_SL f Past- L&cl= w ------------------- ----- Current- w buL.r - ------------ ownq cm-ltacted 0 yes @ "no; if yes, data cnntacte TYPE OF OPERATION -------------_~-~ q Research & Development 0 Production %.cale testing 0 Pilot Scale 0 Bench Scale Process 0 Theoretical Studies 0 Sample 84 Analysis 0 Production

  12. S?. LL-UIIS WLLM

    Office of Legacy Management (LM)

    No. 31 12/!1/87 IEmN wffi WE ST. Lulls m ST. cows awv m S?. LL-UIIS WLLM ftl M NV 9 HIC ltRElWXDwIDloIC6IC~ WVCf ., sm. m buTm1Iv IJm-n Fww. DECMPIISSI~ 1NltEEhU 1"O'S. llE SITEHGSS IKUKDtR6XNWi'. sllErimhtED1omDFMl rnlR!E mrm

  13. LOW-RESOLUTION SPECTROSCOPY FOR THE GLOBULAR CLUSTERS WITH SIGNS OF SUPERNOVA ENRICHMENT: M22, NGC 1851, AND NGC 288

    SciTech Connect (OSTI)

    Lim, Dongwook; Han, Sang-Il; Lee, Young-Wook; Roh, Dong-Goo [Center for Galaxy Evolution Research, Yonsei University, Seoul 120-749 (Korea, Republic of); Sohn, Young-Jong [Department of Astronomy, Yonsei University, Seoul 120-749 (Korea, Republic of); Chun, Sang-Hyun [Yonsei University Observatory, Seoul 120-749 (Korea, Republic of); Lee, Jae-Woo [Department of Astronomy and Space Science, Sejong University, Seoul 143-747 (Korea, Republic of); Johnson, Christian I., E-mail: ywlee2@yonsei.ac.kr [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, MS-15, Cambridge, MA 02138 (United States)

    2015-01-01

    There is increasing evidence for the presence of multiple red giant branches (RGBs) in the color-magnitude diagrams of massive globular clusters (GCs). In order to investigate the origin of this split on the RGB, we have performed new narrow-band Ca photometry and low-resolution spectroscopy for M22, NGC 1851, and NGC 288. We find significant differences (more than 4?) in calcium abundance from the spectroscopic HK' index for M22 and NGC 1851. We also find more than 8? differences in CN-band strength between the Ca-strong and Ca-weak subpopulations for these GCs. For NGC 288, however, a large difference is detected only in the CN strength. The calcium abundances of RGB stars in this GC are identical to within the errors. This is consistent with the conclusion from our new Ca photometry where the RGB splits are confirmed in M22 and NGC 1851, but not in NGC 288. We also find interesting differences in the CN-CH correlations among these GCs. While CN and CH are anti-correlated in NGC 288, they show a positive correlation in M22. NGC 1851, however, shows no difference in CH between the two groups of stars with different CN strengths. We suggest that all of these systematic differences would be best explained by how strongly Type II supernovae enrichment has contributed to the chemical evolution of these GCs.

  14. Effect of. cap alpha. -ketobutyrate on the metabolism of pyruvate and palmitate in isolated rat hepatocytes

    SciTech Connect (OSTI)

    Brass, E.P.

    1986-05-01

    Alpha-ketobutyrate (..cap alpha..KB), an intermediate in the catabolism of threonine and methionine, is decarboxylated to propionyl-CoA. The authors have reported that propionate (PROP) inhibits oxidative metabolism in rate hepatocytes. Based on these observations, the present study examined the effects of ..cap alpha..KB on pyruvate and palmitate metabolism in hepatocytes isolated from fed rats. Similar to PROP, ..cap alpha..KB (10mM) inhibited palmitate oxidation and this inhibition was diminished when 10mM carnitine (CN) was added (35 +/- 6% inhibition without CN, 22 +/- 8% with CN). ..cap alpha..KB inhibited the conversion of 3-/sup 14/C-pyruvate to glucose and CO/sub 2/. Inhibition of pyruvate metabolism by ..cap alpha..KB was concentration-dependent. At equal concentrations, ..cap alpha..KB inhibited pyruvate metabolism to a greater extent than PROP. Addition of CN partially reversed the effects of PROP on pyruvate metabolism, but not those of ..cap alpha..KB despite the generation of propionylcarnitine when ..cap alpha..KB and CN were included in the incubation. These results demonstrate that accumulation of ..cap alpha..KB can impair normal hepatocyte metabolism. While some of the effects of ..cap alpha..KB can be explained on the basis of propionyl-CoA formation, ..cap alpha..KB has effects on pyruvate metabolism not explainable by this mechanism.

  15. Extractant composition including crown ether and calixarene extractants

    DOE Patents [OSTI]

    Meikrantz, David H.; Todd, Terry A.; Riddle, Catherine L.; Law, Jack D.; Peterman, Dean R.; Mincher, Bruce J.; McGrath, Christopher A.; Baker, John D.

    2009-04-28

    An extractant composition comprising a mixed extractant solvent consisting of calix[4] arene-bis-(tert-octylbenzo)-crown-6 ("BOBCalixC6"), 4',4',(5')-di-(t-butyldicyclo-hexano)-18-crown-6 ("DtBu18C6"), and at least one modifier dissolved in a diluent. The DtBu18C6 may be present at from approximately 0.01M to approximately 0.4M, such as at from approximately 0.086 M to approximately 0.108 M. The modifier may be 1-(2,2,3,3-tetrafluoropropoxy)-3-(4-sec-butylphenoxy)-2-propanol ("Cs-7SB") and may be present at from approximately 0.01M to approximately 0.8M. In one embodiment, the mixed extractant solvent includes approximately 0.15M DtBu18C6, approximately 0.007M BOBCalixC6, and approximately 0.75M Cs-7SB modifier dissolved in an isoparaffinic hydrocarbon diluent. The extractant composition further comprises an aqueous phase. The mixed extractant solvent may be used to remove cesium and strontium from the aqueous phase.

  16. Cesium and strontium extraction using a mixed extractant solvent including crown ether and calixarene extractants

    DOE Patents [OSTI]

    Meikrantz, David H.; Todd, Terry A.; Riddle, Catherine L.; Law, Jack D.; Peterman, Dean R.; Mincher, Bruce J.; McGrath, Christopher A.; Baker, John D.

    2007-11-06

    A mixed extractant solvent including calix[4]arene-bis-(tert-octylbenzo)-crown-6 ("BOBCalixC6"), 4',4',(5')-di-(t-butyldicyclo-hexano)-18-crown-6 ("DtBu18C6"), and at least one modifier dissolved in a diluent. The mixed extractant solvent may be used to remove cesium and strontium from an acidic solution. The DtBu18C6 may be present from approximately 0.01 M to approximately 0.4M, such as from approximately 0.086 M to approximately 0.108 M. The modifier may be 1-(2,2,3,3-tetrafluoropropoxy)-3-(4-sec-butylphenoxy)-2-propanol ("Cs-7SB") and may be present from approximately 0.01M to approximately 0.8M. In one embodiment, the mixed extractant solvent includes approximately 0.15M DtBu18C6, approximately 0.007M BOBCalixC6, and approximately 0.75M Cs-7SB modifier dissolved in an isoparaffinic hydrocarbon diluent. The mixed extractant solvent may form an organic phase in an extraction system that also includes an aqueous phase. Methods of extracting cesium and strontium as well as strontium alone are also disclosed.

  17. Petascale Parallelization of the Gyrokinetic Toroidal Code

    SciTech Connect (OSTI)

    Ethier, Stephane; Adams, Mark; Carter, Jonathan; Oliker, Leonid

    2010-05-01

    The Gyrokinetic Toroidal Code (GTC) is a global, three-dimensional particle-in-cell application developed to study microturbulence in tokamak fusion devices. The global capability of GTC is unique, allowing researchers to systematically analyze important dynamics such as turbulence spreading. In this work we examine a new radial domain decomposition approach to allow scalability onto the latest generation of petascale systems. Extensive performance evaluation is conducted on three high performance computing systems: the IBM BG/P, the Cray XT4, and an Intel Xeon Cluster. Overall results show that the radial decomposition approach dramatically increases scalability, while reducing the memory footprint - allowing for fusion device simulations at an unprecedented scale. After a decade where high-end computing (HEC) was dominated by the rapid pace of improvements to processor frequencies, the performance of next-generation supercomputers is increasingly differentiated by varying interconnect designs and levels of integration. Understanding the tradeoffs of these system designs is a key step towards making effective petascale computing a reality. In this work, we examine a new parallelization scheme for the Gyrokinetic Toroidal Code (GTC) [?] micro-turbulence fusion application. Extensive scalability results and analysis are presented on three HEC systems: the IBM BlueGene/P (BG/P) at Argonne National Laboratory, the Cray XT4 at Lawrence Berkeley National Laboratory, and an Intel Xeon cluster at Lawrence Livermore National Laboratory. Overall results indicate that the new radial decomposition approach successfully attains unprecedented scalability to 131,072 BG/P cores by overcoming the memory limitations of the previous approach. The new version is well suited to utilize emerging petascale resources to access new regimes of physical phenomena.

  18. Synthesis of alpha-amino acids

    DOE Patents [OSTI]

    Davis, J.W. Jr.

    1983-01-25

    A method is described for synthesizing alpha amino acids proceeding through novel intermediates of the formulas: R[sub 1]R[sub 2]C(OSOCl)CN, R[sub 1]R[sub 2]C(Cl)CN and [R[sub 1]R[sub 2]C(CN)O][sub 2]SO wherein R[sub 1] and R[sub 2] are each selected from hydrogen monovalent substituted and unsubstituted hydrocarbon radicals of 1 to 10 carbon atoms. The use of these intermediates allows the synthesis steps to be exothermic and results in an overall synthesis method which is faster than the synthesis methods of the prior art. No Drawings

  19. Another Kazakh megaproject lined up

    SciTech Connect (OSTI)

    Not Available

    1992-07-13

    This paper reports that Agip SpA and British Gas plc (BG) have signed an exclusive protocol of intent with Kazakhstan for joint further development of supergiant Karachaganak oil and gas/condensate field and related work in the Uralsk region of the former Soviet republic. The deal ultimately could mean an outlay of $6 billion during a 10 year period of boost production in the field, on stream since 1986, by drilling wells and implementing advanced recovery techniques. Reserves currently are pegged at more than 20 tcf of gas and a combined 1.9-2 billion bbl of liquids, an estimate likely to rise.

  20. ARM - Publications: Science Team Meeting Documents

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

    Raman Lidar Characterization of the Vertical Variability of Aerosols and Water Vapor Over the SGP Ferrare, R.A. (a), Turner, D.D. (b,g), Brasseur, L.H. (c), Tooman, T.P. (d), Dubovik, O. (e), Goldsmith, J.E.M. (d), Ogren, J.A. (f), and Feltz, W. (g), NASA Langley Research Center (a), Pacific Northwest National Laboratory (b), Science Applications International Corporation/NASA/LaRC (c), Sandia National Laboratories (d), SSAI/NASA Goddard Space Flight Center (e), NOAA Climate Monitoring and

  1. Iron(II) catalysis in oxidation of hydrocarbons with ozone in acetonitrile

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

    Bataineh, Hajem; Pestovsky, Oleg; Bakac, Andreja

    2015-02-11

    Oxidation of alcohols, ethers, and sulfoxides by ozone in acetonitrile is catalyzed by submillimolar concentrations of Fe(CH3CN)62+. The catalyst provides both rate acceleration and greater selectivity toward the less oxidized products. For example, Fe(CH3CN)62+-catalyzed oxidation of benzyl alcohol yields benzaldehyde almost exclusively (>95%), whereas the uncatalyzed reaction generates a 1:1 mixture of benzaldehyde and benzoic acid. Similarly, aliphatic alcohols are oxidized to aldehydes/ketones, cyclobutanol to cyclobutanone, and diethyl ether to a 1:1 mixture of ethanol and acetaldehyde. The kinetics of oxidation of alcohols and diethyl ether are first-order in [Fe(CH3CN)62+] and [O3] and independent of [substrate] at concentrations greater thanmore » ~5 mM. In this regime, the rate constant for all of the alcohols is approximately the same, kcat = (8 ± 1) × 104 M–1 s–1, and that for (C2H5)2O is (5 ± 0.5) × 104 M–1 s–1. In the absence of substrate, Fe(CH3CN)62+ reacts with O3 with kFe = (9.3 ± 0.3) × 104 M–1 s–1. The similarity between the rate constants kFe and kcat strongly argues for Fe(CH3CN)62+/O3 reaction as rate-determining in catalytic oxidation. The active oxidant produced in Fe(CH3CN)62+/O3 reaction is suggested to be an Fe(IV) species in analogy with a related intermediate in aqueous solutions. As a result, this assignment is supported by the similarity in kinetic isotope effects and relative reactivities of the two species toward substrates.« less

  2. Prospective Randomized Double-Blind Pilot Study of Site-Specific Consensus Atlas Implementation for Rectal Cancer Target Volume Delineation in the Cooperative Group Setting

    SciTech Connect (OSTI)

    Fuller, Clifton D.; Nijkamp, Jasper; Duppen, Joop C.; Rasch, Coen R.N.; Thomas, Charles R.; Wang, Samuel J.; Okunieff, Paul; Jones, William E.; Baseman, Daniel; Patel, Shilpen; Demandante, Carlo G.N.; Harris, Anna M.; Smith, Benjamin D.; Katz, Alan W.; McGann, Camille

    2011-02-01

    Purpose: Variations in target volume delineation represent a significant hurdle in clinical trials involving conformal radiotherapy. We sought to determine the effect of a consensus guideline-based visual atlas on contouring the target volumes. Methods and Materials: A representative case was contoured (Scan 1) by 14 physician observers and a reference expert with and without target volume delineation instructions derived from a proposed rectal cancer clinical trial involving conformal radiotherapy. The gross tumor volume (GTV), and two clinical target volumes (CTVA, including the internal iliac, presacral, and perirectal nodes, and CTVB, which included the external iliac nodes) were contoured. The observers were randomly assigned to receipt (Group A) or nonreceipt (Group B) of a consensus guideline and atlas for anorectal cancers and then instructed to recontour the same case/images (Scan 2). Observer variation was analyzed volumetrically using the conformation number (CN, where CN = 1 equals total agreement). Results: Of 14 evaluable contour sets (1 expert and 7 Group A and 6 Group B observers), greater agreement was found for the GTV (mean CN, 0.75) than for the CTVs (mean CN, 0.46-0.65). Atlas exposure for Group A led to significantly increased interobserver agreement for CTVA (mean initial CN, 0.68, after atlas use, 0.76; p = .03) and increased agreement with the expert reference (initial mean CN, 0.58; after atlas use, 0.69; p = .02). For the GTV and CTVB, neither the interobserver nor the expert agreement was altered after atlas exposure. Conclusion: Consensus guideline atlas implementation resulted in a detectable difference in interobserver agreement and a greater approximation of expert volumes for the CTVA but not for the GTV or CTVB in the specified case. Visual atlas inclusion should be considered as a feature in future clinical trials incorporating conformal RT.

  3. Wray Myers

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

    189 0189 0189 0189 0189 0189 0189 0189 0189 0189 0189 0189 0189 0189 0189 Wray Myers Digitally signed by Wray Myers DN: cn=Wray Myers, o=PPPL, ou=Director of Procurement, email=wmyers@pppl.com, c=US Date: 2015.04.16 15:51:21 -04'00' JOSHUA HAMMILL Digitally signed by JOSHUA HAMMILL DN: c=US, o=U.S. Government, ou=Department of Energy, cn=JOSHUA HAMMILL, 0.9.2342.19200300.100.1.1=89001002937576 Date: 2015.04.20 07:53:42 -04'00' 0189 0189 0189 0189 0189

  4. The reaction of cobaloximes with hydrogen: Products and thermodynamics

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

    Estes, Deven P.; Grills, David C.; Norton, Jack R.

    2014-11-26

    In this study, a cobalt hydride has been proposed as an intermediate in many reactions of the Co(dmgBF₂)₂L₂ system, but its observation has proven difficult. We have observed the UV–vis spectra of Co(dmgBF₂)₂L₂ (1) in CH₃CN under hydrogen pressures up to 70 atm. A Co(I) compound (6), with an exchangeable proton, is eventually formed. We have determined the bond dissociation free energy and pKa of the new O–H bond in 6 to be 50.5 kcal/mol and 13.4, respectively, in CH₃CN, matching previous reports.

  5. The reaction of cobaloximes with hydrogen: Products and thermodynamics

    SciTech Connect (OSTI)

    Estes, Deven P.; Grills, David C.; Norton, Jack R.

    2014-11-26

    In this study, a cobalt hydride has been proposed as an intermediate in many reactions of the Co(dmgBF?)?L? system, but its observation has proven difficult. We have observed the UVvis spectra of Co(dmgBF?)?L? (1) in CH?CN under hydrogen pressures up to 70 atm. A Co(I) compound (6), with an exchangeable proton, is eventually formed. We have determined the bond dissociation free energy and pKa of the new OH bond in 6 to be 50.5 kcal/mol and 13.4, respectively, in CH?CN, matching previous reports.

  6. Fullerene Cyanation Does Not Always Increase Electron Affinity: Experimental and Theoretical Study

    SciTech Connect (OSTI)

    Clikeman, Tyler T.; Deng, Shihu; Popov, Alexey A.; Wang, Xue B.; Strauss, Steven H.; Boltalina, Olga V.

    2015-01-01

    The electron affinities of C70 derivatives with trifluoromethyl, methyl and cyano groups were studied experimentally and theoretically using low-temperature photoelectron spectroscopy (LT PES) and density functional theory (DFT). The electronic effects of these functional groups were determined and found to be highly dependent on the addition patterns. Substitution of CF3 for CN for the same addition pattern increases the experimental electron affinity by 70 meV per substitution. The synthesis of a new fullerene derivative, C70(CF3)10(CN)2, is reported for the first time

  7. September 2015 Most Viewed Documents for National Defense | OSTI, US Dept

    Office of Scientific and Technical Information (OSTI)

    of Energy, Office of Scientific and Technical Information September 2015 Most Viewed Documents for National Defense SMART BRIDGE: A tool for estimating the military load classification of bridges using varying levels of information Van Groningen, C.N.; Paddock, R.A. (1997) 131 Vapor-liquid equilibria for nitric acid-water and plutonium nitrate-nitric acid-water solutions Maimoni, A. (1980) 91 Smart bridge: a tool for estimating the military load classification of bridges Van Groningen, C.N.;

  8. Methods for performing electrochemical nitration reactions

    DOE Patents [OSTI]

    Lister, Tedd Edward; Fox, Robert Vincent

    2010-05-11

    A method for the electrochemical synthesis of dinitro compounds is disclosed. The method comprises using an anode to oxidize an inactive chemical mediator, such as a ferrocyanide (Fe(CN).sub.6.sup.-4) ion, to an active chemical mediator or oxidizing agent, such as a ferricyanide (Fe(CN).sub.6.sup.-3) ion, in the presence of a differential voltage. The oxidizing agent reacts with a nitro compound and a nitrite ion to form a geminal dinitro compound. The anode may continuously oxidize ferrocyanide to regenerate active ferricyanide, thus keeping sufficient amounts of ferricyanide available for reaction..

  9. NETL F 451.1/1-1, Categorical Exclusion Designation Form

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

    16FE000007 TBD NETL: PGH, ALB, MGN TBD FE/Facility Operations/Eng. & Fac. Colleen Butcher Architectural and Engineering Designs Produce Architectural and Engineering Designs for the above-listed sites. COLLEEN BUTCHER Digitally signed by COLLEEN BUTCHER DN: c=US, o=U.S. Government, ou=Department of Energy, cn=COLLEEN BUTCHER, 0.9.2342.19200300.100.1.1=89001001125042 Date: 2015.12.31 07:04:06 -05'00' 12 31 2015 Fred E. Pozzuto Digitally signed by Fred E. Pozzuto DN: cn=Fred E. Pozzuto, o=DOE

  10. NETL F 451.1/1-1, Categorical Exclusion Designation Form

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

    PAN 0128 NETL RIC Pittsburgh, PA B84 R125 FE/RIC/GES/BW Team Yee Soong (RP) Addition of a Class 3B Laser to the High Pressure Water Tunnel Project A class 3B laser will be operated in B84 R125 to characterize liquid flow interactions within the lab's High-Pressure Water Tunnel. Yee Soong Digitally signed by Yee Soong DN: cn=Yee Soong, o=Predictive Geosciences, ou=ORD, email=soong@netl.doe.gov, c=US Date: 2016.01.12 13:25:48 -05'00' 01 12 2016 John Ganz Digitally signed by John Ganz DN: cn=John

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

    FILE TITLE: SEQUENTIAL MASTER FILE DATA SET NAME: CN6944.PRJ.F759.MASTERYY CN6944.PRJ.F759.BKUPYY (Backup) *** NOTE: where YY is the last 2 digits of the data's year. DCB Information: RECFM LRECL BLKSIZE DSORG SIZE FB 410 8200 PS 51 Tracks POSITION TYPE FIELD FROM THRU LENGTH (A/N) COMMENTS ----------------- ---- ---- ------ ----- ------------------------------ Census Region Code 1 2 2 N See below for values FIPS State Code 3 4 2 N Ownership Code 5 5 1 N See below for values Prime Mover Code 6 6

  12. Functional Area Qualification Standards | Department of Energy

    Office of Environmental Management (EM)

    Standards Functional Area Qualification Standards Qualification Standard Qualification Standard Number Approved Aviation Manager DOE-STD-1165-2003 (CN-1) 2009-12 Aviation Safety Officer DOE-STD-1164-2003 (CN-1) 2010-01 Chemical Processing DOE-STD-1176-2010 2010-02 Civil/Structural Engineering DOE-STD-1182-2014 2014-09 Confinement Ventilation and Process Gas Treatment DOE-STD-1168-2013 2013-10 Construction Management DOE-STD-1180-2004 2004-03 Criticality Safety DOE-STD-1173-2009 2009-04

  13. Second update The Gordon Bell Competetion entry gb110s2

    SciTech Connect (OSTI)

    Vranas, P; Soltz, R

    2006-11-12

    Since the update to our entry of October 20th we have just made a significant improvement. We understand that this is past the deadline for updates and very close to the conference date. However, Lawrence Livermore National Laboratory has just updated the BG/L system software on their full 64 BG/L supercomputer to IBM-BGL Release 3. As we discussed in our update of October 20 this release includes our custom L1 and SRAM access functions that allow us to achieve higher sustained performance. Just a few hours ago we got access to the full system and obtained the fastest sustained performance point. In the full 131,072 CPU-cores system QCD sustains 70.9 Teraflops for the Dirac operator and 67.9 teraflops for the full Conjugate Gradient inverter. This is about 20% faster than our last update. We attach the corresponding speedup figure. As you can tell the speedup is perfect. This figure is the same as Figure 1 of our October 20th update except that it now includes the 131,072 CPU-cores point.

  14. Bioactive glass coatings with hydroxyapatite and Bioglass (registered) particles on Ti-based implants. 1. Processing

    SciTech Connect (OSTI)

    Gomez-Vega, J.M.; Saiz, E.; Tomsia, A.P.; Marshall, G.W.; Marshall, S.J.

    1999-06-01

    Silicate-based glasses with thermal expansion coefficients that match those of Ti6Al4V were prepared and used to coat Ti6Al4V by a simple enameling technique. Bioglass (BG) (registered) or hydroxyapatite (HA) particles were embedded on the coatings in order to enhance their bioactivity. HA particles were partially embedded during heating and remained firmly embedded on the coating after cooling. There was no apparent reaction at the glass/HA interface at the temperatures used in this work (800-840 degrees C). In contrast, BG particles softened and some infiltration into the glass coating took place during heat treatment. In this case, particles with sizes over 45 (mu)m were required, otherwise the particles became hollow due to the infiltration and crystallization of the glass surface. The concentration of the particles on the coating was limited to 20% of surface coverage. Concentrations above this value resulted in cracked coatings due to excessive induced stress. Cracks did not prop agate along the interfaces when coatings were subjected to Vickers indentation tests, indicating that the particle/glass and glass/metal interfaces exhibited strong bonds. Enameling, producing excellent glass/metal adhesion with well-attached bioactive particles on the surface, is a promising method of forming reliable and lasting implants which can endure substantial chemical and mechanical stresses.

  15. Hydrogen adsorption in thin films of Prussian blue analogue

    SciTech Connect (OSTI)

    Yang, Dali [Los Alamos National Laboratory; Ding, Vivian [Los Alamos National Laboratory; Luo, Junhua [Los Alamos National Laboratory; Currier, Robert P [Los Alamos National Laboratory; Obrey, Steve [Los Alamos National Laboratory; Zhao, Yusheng [Los Alamos National Laboratory

    2008-01-01

    Quartz crystal microbalance with dissipation (QCM-D) measurement was used to investigate the kinetics of the molecular hydrogen adsorption into thin films of prussian blue analogues - Cu{sub 3}[Co(CN){sub 6}]{sub 2} at ambient conditions. Although the equilibrium adsorption seems to be independent of the thickness, the adsorption rate substantially decreases with the thickness of the films. In addition, the reversibility of H{sub 2} adsorption into the Cu{sub 3}[Co(CN){sub 6}]{sub 2} films was investigated. The results indicate that the Cu{sub 3}[Co(CN){sub 6}]{sub 2} maily interacts with H{sub 2} molecules physically. The highest H{sub 2} uptake by the Cu{sub 3}[Co(CN){sub 6}]{sub 2} films is obtained when the gas phase is stagnant inside the testing cell. However, the unusual high H{sub 2} uptake obtained from the QCM-D measurement makes us question how reliable this analytic methodology is.

  16. Self Adaptive Air Turbine for Wave Energy Conversion Using Shutter Valve and OWC Heoght Control System

    SciTech Connect (OSTI)

    Di Bella, Francis A

    2014-09-29

    An oscillating water column (OWC) is one of the most technically viable options for converting wave energy into useful electric power. The OWC system uses the wave energy to “push or pull” air through a high-speed turbine, as illustrated in Figure 1. The turbine is typically a bi-directional turbine, such as a Wells turbine or an advanced Dennis-Auld turbine, as developed by Oceanlinx Ltd. (Oceanlinx), a major developer of OWC systems and a major collaborator with Concepts NREC (CN) in Phase II of this STTR effort. Prior to awarding the STTR to CN, work was underway by CN and Oceanlinx to produce a mechanical linkage mechanism that can be cost-effectively manufactured, and can articulate turbine blades to improve wave energy capture. The articulation is controlled by monitoring the chamber pressure. Funding has been made available from the U.S. Department of Energy (DOE) to CN (DOE DE-FG-08GO18171) to co-share the development of a blade articulation mechanism for the purpose of increasing energy recovery. However, articulating the blades is only one of the many effective design improvements that can be made to the composite subsystems that constitute the turbine generator system.

  17. ARM TR-006

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

    7 The ARM Southern Great Plains Central Facility Best Estimate Radiative Flux CD April 2002 C. N. Long Pacific Northwest National Laboratory Richland, Washington Work supported by the U.S. Department of Energy, Office of Science, Office of Biological and Environmental Research C.N. Long, April 2002, ARM TR-007 i Contents 1 Introduction ........................................................................................................................ 1 2 The Best Estimate Flux VAP (March

  18. Consideration of a ultracold neutron source in two-dimensional cylindrical geometry by taking simulated boundaries

    SciTech Connect (OSTI)

    Gheisari, R.; Firoozabadi, M. M.; Mohammadi, H.

    2014-01-15

    A new idea to calculate ultracold neutron (UCN) production by using Monte Carlo simulation method to calculate the cold neutron (CN) flux and an analytical approach to calculate the UCN production from the simulated CN flux was given. A super-thermal source (UCN source) was modeled based on an arrangement of D{sub 2}O and solid D{sub 2} (sD{sub 2}). The D{sub 2}O was investigated as the neutron moderator, and sD{sub 2} as the converter. In order to determine the required parameters, a two-dimensional (2D) neutron balance equation written in Matlab was combined with the MCNPX simulation code. The 2D neutron-transport equation in cylindrical (? ? z) geometry was considered for 330 neutron energy groups in the sD{sub 2}. The 2D balance equation for UCN and CN was solved using simulated CN flux as boundary value. The UCN source dimensions were calculated for the development of the next UCN source. In the optimal condition, the UCN flux and the UCN production rate (averaged over the sD{sub 2} volume) equal to 6.79??10{sup 6} cm{sup ?2}s{sup ?1} and 2.20 10{sup 5} cm{sup ?3}s{sup ?1}, respectively.

  19. Correlation of photothermal conversion on the photo-induced deformation of amorphous carbon nitride films prepared by reactive sputtering

    SciTech Connect (OSTI)

    Harata, T.; Aono, M. Kitazawa, N.; Watanabe, Y.

    2014-08-04

    The photo-induced deformation of hydrogen-free amorphous carbon nitride (a-CN{sub x}) films was investigated under visible-light illumination. The films gave rise to photothermal conversion by irradiation. In this study, we investigated the effects of thermal energy generated by irradiation on the deformation of a-CN{sub x}/ultrathin substrate bimorph specimens. The films were prepared on both ultrathin Si and SiO{sub 2} substrates by reactive radio-frequency magnetron sputtering from a graphite target in the presence of pure nitrogen gas. The temperature of the film on the SiO{sub 2} substrate increased as the optical band-gap of the a-CN{sub x} was decreased. For the film on Si, the temperature remained constant. The deformation degree of the films on Si and SiO{sub 2} substrates were approximately the same. Thus, the deformation of a-CN{sub x} films primarily induced by photon energy directly.

  20. EA-209-C Cargill Power Markets LLC | Department of Energy

    Energy Savers [EERE]

    C Cargill Power Markets LLC EA-209-C Cargill Power Markets LLC Order authorizing Cargill Power Markets to export electric energy to Canada. PDF icon EA-209-C CPM CN.pdf More Documents & Publications EA-209-B Cargill Power Markets, LLC EA-171-D Powerex Corp. EA-264-C ENMAX Energy Marketing Inc.

  1. EA-216-C TransAlta Energy Marketing (U.S.)Inc. | Department of Energy

    Energy Savers [EERE]

    C TransAlta Energy Marketing (U.S.)Inc. EA-216-C TransAlta Energy Marketing (U.S.)Inc. Order authorizing TransAlta Energy Marketing (U.S.) Inc to export electric energy to Canada. PDF icon EA-216-C TEMUS CN.pdf More Documents & Publications EA-216-B TransAlta Energy Marketing (U.S) Inc

  2. EA-306-B MAG Energy Solutions, Inc. | Department of Energy

    Energy Savers [EERE]

    -B MAG Energy Solutions, Inc. EA-306-B MAG Energy Solutions, Inc. Order authorizing MAG Energy Solutions (MAG E.S.) to export electric energy to Canada. PDF icon EA-306-B MAG ES (CN).pdf More Documents & Publications EA-306-A MAG Energy Solutions, Inc. EA-388 TEC Energy Inc. EA-257-D Emera Energy Services

  3. EA-315-A BP Energy Co | Department of Energy

    Energy Savers [EERE]

    -A BP Energy Co EA-315-A BP Energy Co Order authorizing BP Energy Co to export electric energy to Canada. PDF icon EA-315-A BP Energy_CN_0.pdf More Documents & Publications Application to export electric energy OE Docket No. EA-315-A BP Energy EA-97-D Portland General Electric Company EA-249-C Exelon Generation Company, LLC

  4. EA-328-A RBC Energy Services LP | Department of Energy

    Energy Savers [EERE]

    -A RBC Energy Services LP EA-328-A RBC Energy Services LP Order authorizing RBC Energy to export electric energy to Canada. PDF icon EA-328-A RBC Energy CN.pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-328-A RBC Energy Services LP EA-328 RBC Energy Services L.P. EA-171-D Powerex Corp.

  5. EA-370 Vitol Inc. | Department of Energy

    Energy Savers [EERE]

    70 Vitol Inc. EA-370 Vitol Inc. Order authorizing Vitol Inc to export electric energy to Canada PDF icon EA-370 Vitol CN.pdf More Documents & Publications EA-375 Rainbow Energy Marketing Corporation EA-264-C ENMAX Energy Marketing Inc. EA-385 Dynasty Power

  6. EA-388 TEC Energy Inc. | Department of Energy

    Energy Savers [EERE]

    8 TEC Energy Inc. EA-388 TEC Energy Inc. Order authorizing TEC Energy to export electric energy to Canada. PDF icon EA-388 TEC (CN).pdf More Documents & Publications Application to Export Electric Energy OE Docket No. EA-388 TEC Energy Inc. EA-257-D Emera Energy Services, Inc. EA-414 Roctop Investments Inc.

  7. Porous Hexacyanometalates for CO2 capture applications

    SciTech Connect (OSTI)

    Motkuri, Radha K.; Thallapally, Praveen K.; McGrail, B. Peter

    2013-07-30

    Prussian blue analogues of M3[Fe(CN)6]2 x H2O (where M=Fe, Mn and Ni) were synthesized, characterized and tested for their gas sorption capabilities. The sorption studies reveal that, these Prussian blue materials preferentially sorb CO2 over N2 and CH4 at low pressure (1bar).

  8. Preparation of Non Oxide Ceramics in Thermal Plasma

    SciTech Connect (OSTI)

    Singh, S. K.

    2008-10-23

    Titanium carbonitride (TiCN) and ultrafine SiC have been prepared in extended arc thermal plasma reactors using graphite electrodes. The prepared materials have been characterized by a variety of analytical methods. It has been possible to produce the materials in a very short time period.

  9. DOE-HDBK-1131-2007

    Broader source: Energy.gov [DOE]

    General Employee Radiological Training Replaced by DOE-HDBK-1131-2007 (CN1) (Reaffirmed 2013) This handbook describes the DOE General Employee Radiological Training program. It is intended for use by DOE contractors for the development of facility-specific general employee radiological training.

  10. 2nd conference on Intense field- Short Wavelength Atomic and Molecular

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

    Processes - ISWAMP2 nd conference on Intense field- Short Wavelength Atomic and Molecular Processes - ISWAMP2 2nd conference on Intense field- Short Wavelength Atomic and Molecular Processes - ISWAMP2 Print http://iswamp2.jlu.edu.cn/ July 20-22, 2013; Xi'an, China

  11. Grand Challenges of Characterization & Modeling of Cellulose Nanomaterials

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

    Grand Challenges of Characterization & Modeling of Cellulose Nanomaterials Robert Moon Adjunct Assistant Professor Materials Engineering Purdue University Materials Research Engineer US Forest Service Forest Products Laboratory DOE- Sustainable Nanomaterials Workshop, 26 June, 2012 Cellulose Nanomaterials (CN) 2 * Influence: * Cellulose Source * Extraction Process * Two Particle Morphologies: * Rod: CNC, NCC, NCW, NCXLS * Fibrillar: CNF, NFC, MFC, BC, AC * Questions: * What to Characterize?

  12. Structures of Cryptococcus neoformans Protein Farnesyltransferase Reveal Strategies for Developing Inhibitors That Target Fungal Pathogens

    SciTech Connect (OSTI)

    Hast, Michael A.; Nichols, Connie B.; Armstrong, Stephanie M.; Kelly, Shannon M.; Hellinga, Homme W.; Alspaugh, J. Andrew; Beese, Lorena S.

    2012-09-17

    Cryptococcus neoformans is a fungal pathogen that causes life-threatening infections in immunocompromised individuals, including AIDS patients and transplant recipients. Few antifungals can treat C. neoformans infections, and drug resistance is increasing. Protein farnesyltransferase (FTase) catalyzes post-translational lipidation of key signal transduction proteins and is essential in C. neoformans. We present a multidisciplinary study validating C. neoformans FTase (CnFTase) as a drug target, showing that several anticancer FTase inhibitors with disparate scaffolds can inhibit C. neoformans and suggesting structure-based strategies for further optimization of these leads. Structural studies are an essential element for species-specific inhibitor development strategies by revealing similarities and differences between pathogen and host orthologs that can be exploited. We, therefore, present eight crystal structures of CnFTase that define the enzymatic reaction cycle, basis of ligand selection, and structurally divergent regions of the active site. Crystal structures of clinically important anticancer FTase inhibitors in complex with CnFTase reveal opportunities for optimization of selectivity for the fungal enzyme by modifying functional groups that interact with structurally diverse regions. A substrate-induced conformational change in CnFTase is observed as part of the reaction cycle, a feature that is mechanistically distinct from human FTase. Our combined structural and functional studies provide a framework for developing FTase inhibitors to treat invasive fungal infections.

  13. Inspection Report: IG-0762 | Department of Energy

    Office of Environmental Management (EM)

    62 Inspection Report: IG-0762 March 28, 2007 Internal Controls Over Computer Property at the Department's Counterintelligence Directorate The Office of Intelligence and Counterintelligence conducts AND OBJECTIVE technical analyses of foreign intelligence for the Department of Energy (DOE), including the National Nuclear Security Administration, and the United States Intelligence Community. The Counterintelligence Directorate (CN), which is part of the Office of Intelligence and

  14. Outcomes of Positron Emission Tomography-Staged Clinical N3 Breast Cancer Treated With Neoadjuvant Chemotherapy, Surgery, and Radiotherapy

    SciTech Connect (OSTI)

    Park, Hae Jin; Shin, Kyung Hwan; Cho, Kwan Ho; Park, In Hae; Lee, Keun Seok; Ro, Jungsil; Jung, So-Youn; Lee, Seeyoun; Kim, Seok Won; Kang, Han-Sung; Chie, Eui Kyu; Ha, Sung Whan

    2011-12-01

    Purpose: To evaluate the treatment outcome and efficacy of regional lymph node irradiation after neoadjuvant chemotherapy (NCT) and surgery in positron emission tomography (PET)-positive clinical N3 (cN3) breast cancer patients. Methods and Materials: A total of 55 patients with ipsilateral infraclavicular (ICL), internal mammary (IMN), or supraclavicular (SCL) lymph node involvement in the absence of distant metastases, as revealed by an initial PET scan, were retrospectively analyzed. The clinical nodal stage at diagnosis (2002 AJCC) was cN3a in 14 patients (26%), cN3b in 12 patients (22%), and cN3c in 29 patients (53%). All patients were treated with NCT, followed by mastectomy or breast-conserving surgery and subsequent radiotherapy (RT) with curative intent. Results: At the median follow-up of 38 months (range, 9-80 months), 20 patients (36%) had developed treatment failures, including distant metastases either alone or combined with locoregional recurrences that included one ipsilateral breast recurrence (IBR), six regional failures (RF), and one case of combined IBR and RF. Only 3 patients (5.5%) exhibited treatment failure at the initial PET-positive clinical N3 lymph node. The 5-year locoregional relapse-free survival, disease-free survival (DFS), and overall survival rates were 80%, 60%, and 79%, respectively. RT delivered to PET-positive IMN regions in cN3b patients and at higher doses ({>=}55 Gy) to SCL regions in cN3c patients was not associated with improved 5-year IMN/SCL relapse-free survival or DFS. Conclusion: NCT followed by surgery and RT, including the regional lymph nodes, resulted in excellent locoregional control for patients with PET-positive cN3 breast cancer. The primary treatment failure in this group was due to distant metastasis rather than RF. Neither higher-dose RT directed at PET-positive SCL nodes nor coverage of PET-positive IMN nodes was associated with additional gains in locoregional control or DFS.

  15. Screening Hofmann Compounds as CO{sub 2} Sorbents: Nontraditional Synthetic Route to Over 40 Different Pore-Functionalized and Flexible Pillared Cyanonickelates

    SciTech Connect (OSTI)

    Culp, Jeffrey T.; Madden, Catherine; Kauffman, Kristi; Shi, Fan; Matranga, Christopher

    2013-04-15

    A simple reaction scheme based on the heterogeneous intercalation of pillaring ligands (HIPLs) provides a convenient method for systematically tuning pore size, pore functionality, and network flexibility in an extended series of pillared cyanonickelates (PICNICs), commonly referred to as Hofmann compounds. The versatility of the approach is demonstrated through the preparation of over 40 different PICNICs containing pillar ligands ranging from ?4 to ?15 in length and modified with a wide range of functional groups, including fluoro, aldehyde, alkylamine, alkyl, aryl, trifluoromethyl, ester, nitro, ether, and nonmetalated 4,4?-bipyrimidine. The HIPL method involves reaction of a suspension of preformed polymeric sheets of powdered anhydrous nickel cyanide with an appropriate pillar ligand in refluxing organic solvent, resulting in the conversion of the planar [Ni{sub 2}(CN){sub 4}]{sub n} networks into polycrystalline three-dimensional porous frameworks containing the organic pillar ligand. Preliminary investigations indicate that the HIPL reaction is also amenable to forming Co(L)Ni(CN){sub 4}, Fe(L)Ni(CN){sub 4}, and Fe(L)Pd(CN){sub 4} networks. The materials show variable adsorption behavior for CO{sub 2} depending on the pillar length and pillar functionalization. Several compounds show structurally flexible behavior during the adsorption and desorption of CO{sub 2}. Interestingly, the newly discovered flexible compounds include two flexible Fe(L)Ni(CN){sub 4} derivatives that are structurally related to previously reported porous spin-crossover compounds. The preparations of 20 pillar ligands based on ring-functionalized 4,4?-dipyridyls, 1,4-bis(4- pyridyl)benzenes, and N-(4-pyridyl)isonicotinamides are also described.

  16. Synthesis and characterization of model MgO supported catalyst with Pt-Mo interactions.

    SciTech Connect (OSTI)

    Alexeev, O.; Kawi, S.; Gates, B.C. [Univ. of California, Davis, CA (United States)] [Univ. of California, Davis, CA (United States); Shelef, M. [Ford Motor Co., Dearborn, MI (United States)] [Ford Motor Co., Dearborn, MI (United States)

    1996-01-04

    MgO supported platinum and platinum-molybdenum catalysts were prepared from organometallic precursors and charaterized structurally to determine how the nature of the bimetallic precursors and the treatment conditions affected the interaction between the two metals. Samples were prepared from [PtCl{sub 2}(PhCN){sub 2}], [PtCl{sub 2}(PhCN){sub 2}] + [Mo(CO){sub 6}], and [C@Pt[Mo(CO){sub 3}(C{sub 5}H{sub 5})]{sub 2}(PhCN){sub 2}] BC@ characterized by infrared and extended X-ray absorption fine structure (EXAFS) spectroscopies, tranmission electron microscopy, and chemisorption of H{sub 2}, CO, and O{sub 2}. The samples were treated in H{sub 2} at 400{degree}C prior to most of the characterizatons. Incorporation of Mo reduced the chemisorption of CO and of H{sub 2}. EXAFS spectra measured at the Pt L{sub III} edge and at the Mo K edge showed substantial Pt-Mo contributions with a Pt-Mo cordination number of about 2 and an average distance of 2.63 A for the sample prepared from [C@Pt[Mo(CO){sub 3}(C{sub 5}H{sub 5})]{sub 2}(PhCN){sub 2}] BC@. In constract, no significant Pt-Mo contribution was observed for the sample prepared from [PtCl{sub 2}(PhCN){sub 2}]+ [Mo(CO){sub 6}]. Electron micrographs and EXAFS results show that interaction between Pt and Mo ions in the former sample helped to maintain the platinum in a highly dispersed form, with supported platinum clusters being smaller than about 10 A. 53 refs., 9 figs., 9 tabs.

  17. Controlled Synthesis of Polyenes by Catalytic Methods. Progress Report, December 1, 1989 -- November 30, 1992

    DOE R&D Accomplishments [OSTI]

    Schrock, R. R.

    1992-01-01

    A more direct approach to polyenes by the direct polymerization of acetylenes has been achieved. We were able to show that polymerization of acetylene itself can be controlled with a well- characterized alkylidene catalyst, but only if a base such as quinuclidine is present in order to slow down the rate of propagation relative to initiation. (Quinuclidine may also stabilize vinylalkylidene intermediates formed in the reaction). Unfortunately, living polyenes were no more stable than isolated polyenes, and so this approach had its limitations. Direct polymerization of acetylene by Mo(CH-t-Bu)(NAr)(O-t-Bu){sub 2} was more successful, but inherent polyene instability was still a problem. The most important result of the past grant period is the finding that dipropargyl derivatives (HC=CCH{sub 2}XCH{sub 2}C=CH; X = CH{sub 2}, C(CO{sub 2}R){sub 2}, SiR{sub 2}, etc.), which have been reported to be cyclopolymerized by various classical catalysts by as yet unknown mechanisms, are polymerized by Mo(CH-t-Bu)(NAr)[OCMe(CF{sub 3}){sub 2}]{sub 2} in dimethoxyethane. We speculate that intramolecular formation of a five-membered ring in the product of {alpha} addition is fast enough to yield another terminal alkylidene on the time scale of the polymerization reaction, while a six-membered ring is formed in a reaction involving a more reaction terminal alkylidene. Either intermediate alkylidene, but most likely the terminal alkylidene, could react with additional monomer to lead to growth of a chain having dangling triple bonds that eventually could be employed to form crosslinks.

  18. HIGH PRESSURE COAL COMBUSTION KINETICS PROJECT

    SciTech Connect (OSTI)

    Chris Guenther, Ph.D.

    2003-01-28

    SRI has completed the NBFZ test program, made modification to the experimental furnace for the HPBO test. The NBFZ datasets provide the information NEA needs to simulate the combustion and fuel-N conversion with detailed chemical reaction mechanisms. BU has determined a linear swell of 1.55 corresponding to a volumetric increase of a factor of 3.7 and a decrease in char density by the same factor. These results are highly significant, and indicate significantly faster burnout at elevated pressure due to the low char density and large diameter.

  19. 18Ne

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

    Ne β+-Decay Evaluated Data Measurements 1954GO17: 18Ne. 1961BU05: 18Ne; measured not abstracted; deduced nuclear properties. 1961EC02: 18Ne; measured not abstracted; deduced nuclear properties. 1963FR10: 18Ne; measured not abstracted; deduced nuclear properties. 1965FR09: 18Ne; measured not abstracted; deduced nuclear properties. 1968GO05: 18Ne; measured Eγ, Iγ; deduced Iβ, log ft. 18F deduced levels, branching ratios. 1970AL11: 18Ne; measured T1/2; deduced log ft, β-branching. 1970AS06,

  20. A=9C (1984AJ01)

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

    4AJ01) (See the Isobar Diagram for 9C) GENERAL: (See also (1979AJ01) for other references in this category and for some reactions on which no new work has been done.) and Table 9.12 [Table of Energy Levels] (in PDF or PS) here. Model calculations: (1979LA06). Complex reactions involving 9C: (1981MO20). Reactions involing pions: (1979AS01, 1979NA1E, 1980BU15, 1983HU02). Other topics: (1979BE1H, 1979LA06, 1982NG01). Mass of 9C: The recent Q0 value for the 12C(3He, 6He)9C reaction (see reaction 3)

  1. BIG RU N INDIANA LAKESHORE RUN E LUMBER CIT Y WARSAW JOHNST

    Gasoline and Diesel Fuel Update (EIA)

    RU N INDIANA LAKESHORE RUN E LUMBER CIT Y WARSAW JOHNST OWN BU RNSIDE MILLSTONE FROSTBUR G JUN EAU PLU MVILLE CHERRY HILL KAN E BOSWELL MAR ION CENT ER CREEKSIDE SALTSBUR G POINT N BLAIR SVILL E COU NCIL RU N SIGEL LEWISVILLE BEAR C REEK AR MBRUST OHIOPYLE HALLT ON BR OOKVILLE MAR KTON NOL O RAT HMEL COR SICA MAR CHAND SMIC KSBU RG HOWE APOLLO SEVEN SPRIN GS YAT ESBORO MCNEES LUCIND A GEORGE PIN EY LEEPER TIMBLIN WILL ET FERGUSON CLIMAX PANIC DAVY HILL TIDIOUT E GRAMPIAN SLIGO ROC KVI LLE

  2. QER- Comment of Mike Gray

    Broader source: Energy.gov [DOE]

    The biggest issue with wind energy in ND is the Transmission System. There was a proposal recently by Clean Line Energy This type of forward thinking would allow wind energy to go forward.... The other huge issue is the blockade that the fossil fuel industry has placed on Master Limited Partnerships in 1978!! If the Master Limited Partner Parity Act is passed THAT WOULD BE A GAME CHANGER!! ( this is sponsored bu Senator Coons From DE) Call me directly..... You can also aske Heidi Heitkamp about me.... Mike Gray

  3. Carlsbad Field Office P. O. Box 3090 Carlsbad

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

    W aste Bu reau New Mexico Environment Department 2905 Rodeo Park Drive East, Buitding 1 San ta Fe. New Mexico 87505-6303 FEB 1 3 20j~ Subject: Notification of Cla ss 1 Permit Modification to the Hazardous Waste Facility Permit, Number: NM4890139088-TSDF De ar Mr. Kieling : Enclosed is the Class 1 Permit Modification Notification listed below: * Change in th e Department of Energy, Carlsbad Field Office Manager We certify under penalty of law that this document and th e enclos ure were prepared

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

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

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

  5. Vacuum Insulation for Window

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

    3M#Pres(ge#70# 3M#Pres(ge#90# Glass# on Vacuum I nsula4on for W indow 201 Bu uildin Te echnologie Offi ffic Pe ee Rev vie Pictures of NREL's transparent vacuum insulation for windows. The pictures show that the evacuated components are transparent while providing superior insulation in a flexible structure that can be retrofitted to installed windows. Image of vacuum capsules low-e coated films and glass, after multiple sprayed layers. Lin Simpson, lin.simpson@nrel.gov Na4ona Ren newabl En nerg

  6. Venture Capital Finance

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

    Venture Capital Finance DOE Biomass Conference July 2014 Priced Out of Oil ... Into What? Energy Source Commodity Price Sun: $0 / GJ Oil (6.2 GJ/bbl) $10/bbl = $1.6 / GJ (late 1990s) Coal: $3 - 6 / GJ Natural Gas (N America) $3 - 4 / GJ Biomass (15 GJ/dt) $60-100/dt = $4 - 6 / GJ Natural Gas (ex N America) $10 - 15 / GJ Oil (6.2 GJ/bbl) $100/bbl = $16 / GJ Corn $4-7/bu= $10 - 20 / GJ 2 * Higher oil prices create a disruptive opportunity for lower cost feedstocks * North American shale gas is a

  7. SUBJIHX:

    Office of Legacy Management (LM)

    : SUBJIHX: ?%w P ~.~i~~~~~ I' - 6*:&b d-h tQ @ i -" i" 1 s..?F?ew% ,~~~.~~~~,~ ,l Aesisrtmxt ?Xrarctmr for DATE Jitx;;r 6, I.955 l' lmPmfiQn, mv3.sion of R&w Materials 060. G, Marvin, Qirsctor for PrfXess Developnsnt 4: :.- p, J. Picario, stz.uction and n - f',_' h j::... ; Supply Branch, Division of Raw Materials -T 17 -L, 3c &j 0 DATA BE RESTORATION, ABANJIONMENT OR SELLING BU%3ING AND CERTAIN . " L) CURRIES ON FBCPEB'E OFU. S. PHOSPHO~C PRCDUCTS, EAST TAMPA, --

  8. TO. TO. , W. B; Harris, Chief, Industrial Hygiene'Branch DA , W. B; Harris, Chief, Industrial Hygiene'Branch DA

    Office of Legacy Management (LM)

    ~~~~;.Offi~~~~~~~~~~~ ,/-; l UNITED STh , :__ .~. :__ .~. , , TO. TO. , W. B; Harris, Chief, Industrial Hygiene'Branch DA , W. B; Harris, Chief, Industrial Hygiene'Branch DA Health and Safet Division pa& 1 Ps B.- Klevin :mL -y!yG hMBOL: HSH:PBK hMBOL: HSH:PBK : 1. Purpose of Visit >.. a. To study operations planned by~Bu.reau of Ea: factors for Be, II, thorium, zirconium, etc, i b. ,'To explain to Bureauof Mines' personnel tl in handling any of the aforementioned mate] 2. Scope of Work

  9. L AMENDMENT OF SOLICITATION/MODIFICATION OF CONTRACT

    National Nuclear Security Administration (NNSA)

    L _ AMENDMENT OF SOLICITATION/MODIFICATION OF CONTRACT 2. AMENDMENT/MODIFICATION NO. 3. EFFECTIVE DATE 25 7 See Block 16C 6 . 1SSUED BY CODE 0500 8 NNSA/ Oa kridge Site Office u.s. De pa rtment of Energ y NNSA/ Y-12 S it e Offic e P. O. Box 2 05 0 Bu ilding 97 0 4- 2 Oak Ridge TN 37831 8 . NAME AND ADDRESS OF CONTRACTOR (No., street, county. state and ZIP Code) ABCOCK & WILCOX TECHNICAL B A t t n: W ILLIE J. W I LSON PO BOX 2009 SERVICES Y- 12 , LLC ,1 . CONTRACT ID CODE I PAGE OF PAGES 1 I

  10. Strong near-infrared carbon in the Type Ia supernova iPTF13ebh

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

    Hsiao, E. Y.; Burns, C. R.; Contreras, C.; Höflich, P.; Sand, D.; Marion, G. H.; Phillips, M. M.; Stritzinger, M.; González-Gaitán, S.; Mason, R. E.; et al

    2015-05-22

    We present near-infrared (NIR) time-series spectroscopy, as well as complementary ultraviolet (UV), optical, and NIR data, of the Type Ia supernova (SN Ia) iPTF13ebh, which was discovered within two days from the estimated time of explosion. The first NIR spectrum was taken merely 2.3 days after explosion and may be the earliest NIR spectrum yet obtained of a SN Ia. The most striking features in the spectrum are several NIR C I lines, and the C Iλ1.0693 μm line is the strongest ever observed in a SN Ia. Interestingly, no strong optical C II counterparts were found, even though themore » optical spectroscopic time series began early and is densely cadenced. Except at the very early epochs, within a few days from the time of explosion, we show that the strong NIR C I compared to the weaker optical C II appears to be general in SNe Ia. iPTF13ebh is a fast decliner with Δm15(B) = 1.79 ± 0.01, and its absolute magnitude obeys the linear part of the width-luminosity relation. It is therefore categorized as a “transitional” event, on the fast-declining end of normal SNe Ia as opposed to subluminous/91bg-like objects. iPTF13ebh shows NIR spectroscopic properties that are distinct from both the normal and subluminous/91bg-like classes, bridging the observed characteristics of the two classes. These NIR observations suggest that composition and density of the inner core are similar to that of 91bg-like events, and that it has a deep-reaching carbon burning layer that is not observed in more slowly declining SNe Ia. Furthermore, there is also a substantial difference between the explosion times inferred from the early-time light curve and the velocity evolution of the Si II λ0.6355 μm line, implying a long dark phase of ~4 days.« less

  11. Strong near-infrared carbon in the Type Ia supernova iPTF13ebh

    SciTech Connect (OSTI)

    Hsiao, E. Y.; Burns, C. R.; Contreras, C.; Hflich, P.; Sand, D.; Marion, G. H.; Phillips, M. M.; Stritzinger, M.; Gonzlez-Gaitn, S.; Mason, R. E.; Folatelli, G.; Parent, E.; Gall, C.; Amanullah, R.; Anupama, G. C.; Arcavi, I.; Banerjee, D. P. K.; Beletsky, Y.; Blanc, G. A.; Bloom, J. S.; Brown, P. J.; Campillay, A.; Cao, Y.; De Cia, A.; Diamond, T.; Freedman, W. L.; Gonzalez, C.; Goobar, A.; Holmbo, S.; Howell, D. A.; Johansson, J.; Kasliwal, M. M.; Kirshner, R. P.; Krisciunas, K.; Kulkarni, S. R.; Maguire, K.; Milne, P. A.; Morrell, N.; Nugent, P. E.; Ofek, E. O.; Osip, D.; Palunas, P.; Perley, D. A.; Persson, S. E.; Piro, A. L.; Rabus, M.; Roth, M.; Schiefelbein, J. M.; Srivastav, S.; Sullivan, M.; Suntzeff, N. B.; Surace, J.; Wo?niak, P. R.; Yaron, O.

    2015-05-22

    We present near-infrared (NIR) time-series spectroscopy, as well as complementary ultraviolet (UV), optical, and NIR data, of the Type Ia supernova (SN Ia) iPTF13ebh, which was discovered within two days from the estimated time of explosion. The first NIR spectrum was taken merely 2.3 days after explosion and may be the earliest NIR spectrum yet obtained of a SN Ia. The most striking features in the spectrum are several NIR C I lines, and the C I?1.0693 ?m line is the strongest ever observed in a SN Ia. Interestingly, no strong optical C II counterparts were found, even though the optical spectroscopic time series began early and is densely cadenced. Except at the very early epochs, within a few days from the time of explosion, we show that the strong NIR C I compared to the weaker optical C II appears to be general in SNe Ia. iPTF13ebh is a fast decliner with ?m15(B) = 1.79 0.01, and its absolute magnitude obeys the linear part of the width-luminosity relation. It is therefore categorized as a transitional event, on the fast-declining end of normal SNe Ia as opposed to subluminous/91bg-like objects. iPTF13ebh shows NIR spectroscopic properties that are distinct from both the normal and subluminous/91bg-like classes, bridging the observed characteristics of the two classes. These NIR observations suggest that composition and density of the inner core are similar to that of 91bg-like events, and that it has a deep-reaching carbon burning layer that is not observed in more slowly declining SNe Ia. Furthermore, there is also a substantial difference between the explosion times inferred from the early-time light curve and the velocity evolution of the Si II ?0.6355 ?m line, implying a long dark phase of ~4 days.

  12. Fuel Effects on Combustion and Emissions of a Direct-Inection Diesel Engine Operating at Moderate to High Engine Speed and Load

    SciTech Connect (OSTI)

    Szybist, James P; Szymkowicz, Patrick G.; Northrop, William F

    2012-01-01

    It is advantageous to increase the specific power output of diesel engines and to operate them at higher load for a greater portion of a driving cycle to achieve better thermal efficiency and thus reduce vehicle fuel consumption. Such operation is limited by excessive smoke formation at retarded injection timing and high rates of cylinder pressure rise at more advanced timing. Given this window of operation, it is desired to understand the influence of fuel properties such that optimum combustion performance and emissions can be retained over the range of fuels commonly available in the marketplace. It has been shown in previous studies that varying cetane number (CN) of diesel fuel has little effect on ignition delay at high engine load due to the domination of high cylinder temperature on ignition kinetics. The work here experimentally confirms that finding but also shows that emissions and combustion performance vary according to fuel reactivity. Data are examined from a direct-injection single cylinder research engine for eight common diesel fuels including soy-based biodiesel blends at two high load operating points with no exhaust gas recirculation (EGR) and at a moderate load with four levels of EGR. It is shown in the work that at high engine load where combustion is controlled by mixing processes, CN and other fuel properties have little effect on engine performance, although lower CN fuels produce a small increase in noise, smoke and CO emissions. Biodiesel blends increase NOX emissions and decreases CO and smoke emissions at high load, but otherwise have little effect on performance. At moderate load, higher CN fuels are more tolerant to EGR due to their better chemical reactivity at retarded injection timing, but all fuels produce comparable thermal efficiency at advanced combustion phasing regardless of EGR. In contrast to the high load conditions, there was no increase in NOX emissions for biodiesel at the moderate load condition. It is concluded that although higher CN does not significantly alter ignition delay at moderate to high loads it has a dominant influence on the acceptable injection timing range. Apart from CN effects, fuel oxygen content plays an independent role in reducing some emissions. It is therefore recommended that compensation for fuel ignitability and oxygen content be included in combustion control strategies to optimize emissions and performance of future diesel engines.

  13. Iron(II) catalysis in oxidation of hydrocarbons with ozone in acetonitrile

    SciTech Connect (OSTI)

    Bataineh, Hajem; Pestovsky, Oleg; Bakac, Andreja

    2015-02-11

    Oxidation of alcohols, ethers, and sulfoxides by ozone in acetonitrile is catalyzed by submillimolar concentrations of Fe(CH3CN)62+. The catalyst provides both rate acceleration and greater selectivity toward the less oxidized products. For example, Fe(CH3CN)62+-catalyzed oxidation of benzyl alcohol yields benzaldehyde almost exclusively (>95%), whereas the uncatalyzed reaction generates a 1:1 mixture of benzaldehyde and benzoic acid. Similarly, aliphatic alcohols are oxidized to aldehydes/ketones, cyclobutanol to cyclobutanone, and diethyl ether to a 1:1 mixture of ethanol and acetaldehyde. The kinetics of oxidation of alcohols and diethyl ether are first-order in [Fe(CH3CN)62+] and [O3] and independent of [substrate] at concentrations greater than ~5 mM. In this regime, the rate constant for all of the alcohols is approximately the same, kcat = (8 1) 104 M1 s1, and that for (C2H5)2O is (5 0.5) 104 M1 s1. In the absence of substrate, Fe(CH3CN)62+ reacts with O3 with kFe = (9.3 0.3) 104 M1 s1. The similarity between the rate constants kFe and kcat strongly argues for Fe(CH3CN)62+/O3 reaction as rate-determining in catalytic oxidation. The active oxidant produced in Fe(CH3CN)62+/O3 reaction is suggested to be an Fe(IV) species in analogy with a related intermediate in aqueous solutions. As a result, this assignment is supported by the similarity in kinetic isotope effects and relative reactivities of the two species toward substrates.

  14. Observations of comet ISON (C/2012 S1) from Lowell observatory

    SciTech Connect (OSTI)

    Knight, Matthew M.; Schleicher, David G.

    2015-01-01

    We observed the dynamically new sungrazing comet ISON (C/2012 S1) extensively at Lowell Observatory throughout 2013 in order to characterize its behavior prior to perihelion. ISON had typical abundances for an Oort Cloud comet. Its dust production, as measured by Af?, remained nearly constant during the apparition but its CN gas production increased by ?50 . The minimum active area necessary to support observed water production rates exceeded the likely surface area of the nucleus and suggests a population of icy grains in the coma. Together with the flattening of the dust radial profile over time, this is consistant with ejection of a large quantity of slow moving dust and icy grains in the coma at large heliocentric distance. The dust morphology was dominated by the tail, but a faint sunward dust fan was detected in March, April, May, and September. We imaged multiple gas species in September, October, and November. All gas species were more extended than the dust coma, although only CN had sufficient signal-to-noise for detailed morphological study. Excess CN signal was observed in the sunward hemisphere in September and early October. In November the excess CN signal was in the tailward hemisphere and two faint CN features appeared approximately orthogonal to the tail with position angles varying by about 20 from night to night. Using numerical modeling, we best reproduced the orientation and shape of these features as well as the bulk brightness with a pole oriented approximately toward the Sun and a single source located within ?35 of the equator. Variations in position angle and relative brightness of the CN features from night to night suggest a rotation period shorter than 24 hr. The production rates and coma morphology suggest a nucleus that was active over nearly its entire sunward facing hemisphere in September and October but which underwent a significant mass loss event, potentially including fragmentation, shortly before November 1. Significant subsequent mass loss likely continued at the same site over subsequent days/weeks and may have catastrophically weakened the nucleus prior to perihelion.

  15. Solid-state chemistry of molecular metal oxide clusters. Bis(triphenylphosphine)rhodium(I) carbonyl derivatives

    SciTech Connect (OSTI)

    Siedle, A.R.; Gleason, W.B.; Newmark, R.A.; Skarjune, R.P.; Lyon, P.A.; Markell, C.G. ); Hodgson, K.O.; Roe, A.L. )

    1990-05-02

    Hydronium salts of the Keggin-type XM{sub 12}O{sub 40} molecular metal oxide cluster anions SiW{sub 12}O{sub 40}{sup 4{minus}}, SiMo{sub 12}O{sub 40}{sup 4{minus}}, PW{sub 12}O{sub 40}{sup 3{minus}}, PMo{sub 12}O{sub 40}{sup 3{minus}}, PMo{sub 12}O{sub 40}{sup 4{minus}}, and PVMo{sub 11}O{sub 40}{sup 4{minus}} react with ((Ph{sub 3}P){sub 3}Rh(CO))(HC(SO{sub 2}CF{sub 3}){sub 2}) in CH{sub 3}CN{minus}C{sub 2}H{sub 5}OH to form (trans-(Ph{sub 3}P){sub 2}Rh(CO)(CH{sub 3}CN)){sub n}XM{sub 12}O{sub 40}. These salts lose CH{sub 3}CN on heating to provide ((Ph{sub 3}P){sub 2}Rh(CO)){sub n}XM{sub 12}O{sub 40}, which may also be obtained directly from ((Ph{sub 3}P){sub 3}Rh(CO))(HC(SO{sub 2}cF{sub 3}){sub 2}) in pure ethanol. These oxometalates have been characterized by ir, NMR, and x-ray absorption spectroscopy and are considered to contain isolated, lattice-stabilized (Ph{sub 3}P){sub 2}Rh(CO)-(CH{sub 3}CN){sup +} and (Ph{sub 3}P){sub 2}Rh(CO){sup +} cations, with the latter being a three-coordinate, 14-electron Rh(I) species. The activity and selectivity of these compounds as catalysts for olefin isomerization and hydroformylation are described. Reaction of ((Ph{sub 3}P){sub 3}Rh(CO))(HC(SO{sub 2}CF{sub 3}){sub 2}) with CH{sub 3}CN produces (trans-(Ph{sub 3}P){sub 2}Rh(CO)(CH{sub 3}CN))(HC(SO{sub 2}CF{sub 3}){sub 2}). The crystal structure of the triclinic compound is reported. 41 refs., 4 figs., 8 tabs.

  16. 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.

  17. Simultaneous separation of cesium and strontium from spent nuclear fuel using the fission-product extraction process

    SciTech Connect (OSTI)

    Law, J.D.; Peterman, D.R.; Riddle, C.L.; Meikrantz, D.A.; Todd, T.A.

    2008-07-01

    The Fission-Product Extraction (FPEX) Process is being developed as part of the United States Department of Energy Global Nuclear Energy Partnership (GNEP) for the simultaneous separation of cesium and strontium from spent LWR fuel. Separation of the Cs and Sr will reduce the short-term heat load in a geological repository and, when combined with the separation of Am and Cm, could increase the capacity of the geological repository by a factor of approximately 100. The FPEX process is based on two highly-specific extractants: 4,4',(5')-di-(t-butyl-dicyclohexano)- 18-crown-6 (DtBuCH18C6) and calix[4]arene-bis-(t-octyl-benzo-crown-6 ) (BOBCalixC6). The DtBuCH18C6 extractant is selective for strontium, and the BOBCalixC6 extractant is selective for cesium. Results of flowsheet testing of the FPEX process with simulated and actual spent-nuclear-fuel feed solution in centrifugal contactors are detailed. Removal efficiencies, co-extraction of metals, and process hydrodynamic performance ar e discussed along with recommendations for future flowsheet testing with actual spent nuclear fuel. Recent advances in the evaluation of alternative calixarenes with increased solubility and stability are also detailed. (authors)

  18. Electron localization in a mixed-valence diniobium benzene complex

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

    Gianetti, Thomas L.; Nocton, Grégory; Minasian, Stefan G.; Kaltsoyannis, Nikolas; Kilcoyne, A. L. David; Kozimor, Stosh A.; Shuh, David K.; Tyliszczak, Tolek; Bergman, Robert G.; Arnold, John

    2014-11-11

    Reaction of the neutral diniobium benzene complex {[Nb(BDI)NtBu]2(μ-C6H6)} (BDI = N,N'-diisopropylbenzene-β-diketiminate) with Ag[B(C6F5)4] results in a single electron oxidation to produce a cationic diniobium arene complex, {[Nb(BDI)NtBu]2(μ-C6H6)}{B(C6F5)4}. Investigation of the solid state and solution phase structure using single-crystal X-ray diffraction, cyclic voltammetry, magnetic susceptibility, and multinuclear NMR spectroscopy indicates that the oxidation results in an asymmetric molecule with two chemically inequivalent Nb atoms. Further characterization using density functional theory (DFT) calculations, UV-visible, Nb L3,2-edge X-ray absorption near-edge structure (XANES), and EPR spectroscopies supports assignment of a diniobium complex, in which one Nb atom carries a single unpaired electron that ismore » not largely delocalized on the second Nb atom. During the oxidative transformation, one electron is removed from the δ-bonding HOMO, which causes a destabilization of the molecule and formation of an asymmetric product. Subsequent reactivity studies indicate that the oxidized product allows access to metal-based chemistry with substrates that did not exhibit reactivity with the starting neutral complex.« less

  19. Electron localization in a mixed-valence diniobium benzene complex

    SciTech Connect (OSTI)

    Gianetti, Thomas L.; Nocton, Grgory; Minasian, Stefan G.; Kaltsoyannis, Nikolas; Kilcoyne, A. L. David; Kozimor, Stosh A.; Shuh, David K.; Tyliszczak, Tolek; Bergman, Robert G.; Arnold, John

    2014-11-11

    Reaction of the neutral diniobium benzene complex {[Nb(BDI)NtBu]2(?-C6H6)} (BDI = N,N'-diisopropylbenzene-?-diketiminate) with Ag[B(C6F5)4] results in a single electron oxidation to produce a cationic diniobium arene complex, {[Nb(BDI)NtBu]2(?-C6H6)}{B(C6F5)4}. Investigation of the solid state and solution phase structure using single-crystal X-ray diffraction, cyclic voltammetry, magnetic susceptibility, and multinuclear NMR spectroscopy indicates that the oxidation results in an asymmetric molecule with two chemically inequivalent Nb atoms. Further characterization using density functional theory (DFT) calculations, UV-visible, Nb L3,2-edge X-ray absorption near-edge structure (XANES), and EPR spectroscopies supports assignment of a diniobium complex, in which one Nb atom carries a single unpaired electron that is not largely delocalized on the second Nb atom. During the oxidative transformation, one electron is removed from the ?-bonding HOMO, which causes a destabilization of the molecule and formation of an asymmetric product. Subsequent reactivity studies indicate that the oxidized product allows access to metal-based chemistry with substrates that did not exhibit reactivity with the starting neutral complex.

  20. Mixed N-Heterocyclic Carbene-Bis(oxazolinyl)borato Rhodium and Iridium Complexes in Photochemical and Thermal Oxidative Addition Reactions

    SciTech Connect (OSTI)

    Xu, Songchen; Manna, Kuntal; Ellern, Arkady; Sadow, Aaron D

    2014-12-08

    In order to facilitate oxidative addition chemistry of fac-coordinated rhodium(I) and iridium(I) compounds, carbenebis(oxazolinyl)phenylborate proligands have been synthesized and reacted with organometallic precursors. Two proligands, PhB(OxMe2)2(ImtBuH) (H[1]; OxMe2 = 4,4-dimethyl-2-oxazoline; ImtBuH = 1-tert-butylimidazole) and PhB(OxMe2)2(ImMesH) (H[2]; ImMesH = 1-mesitylimidazole), are deprotonated with potassium benzyl to generate K[1] and K[2], and these potassium compounds serve as reagents for the synthesis of a series of rhodium and iridium complexes. Cyclooctadiene and dicarbonyl compounds {PhB(OxMe2)2ImtBu}Rh(?4-C8H12) (3), {PhB(OxMe2)2ImMes}Rh(?4-C8H12) (4), {PhB(OxMe2)2ImMes}Rh(CO)2 (5), {PhB(OxMe2)2ImMes}Ir(?4-C8H12) (6), and {PhB(OxMe2)2ImMes}Ir(CO)2 (7) are synthesized along with ToMM(?4-C8H12) (M = Rh (8); M = Ir (9); ToM = tris(4,4-dimethyl-2-oxazolinyl)phenylborate). The spectroscopic and structural properties and reactivity of this series of compounds show electronic and steric effects of substituents on the imidazole (tert-butyl vs mesityl), effects of replacing an oxazoline in ToM with a carbene donor, and the influence of the donor ligand (CO vs C8H12). The reactions of K[2] and [M(?-Cl)(?2-C8H14)2]2 (M = Rh, Ir) provide {?4-PhB(OxMe2)2ImMes?CH2}Rh(?-H)(?-Cl)Rh(?2-C8H14)2 (10) and {PhB(OxMe2)2ImMes}IrH(?3-C8H13) (11). In the former compound, a spontaneous oxidative addition of a mesityl ortho-methyl to give a mixed-valent dirhodium species is observed, while the iridium compound forms a monometallic allyl hydride. Photochemical reactions of dicarbonyl compounds 5 and 7 result in CH bond oxidative addition providing the compounds {?4-PhB(OxMe2)2ImMes?CH2}RhH(CO) (12) and {PhB(OxMe2)2ImMes}IrH(Ph)CO (13). In 12, oxidative addition results in cyclometalation of the mesityl ortho-methyl similar to 10, whereas the iridium compound reacts with the benzene solvent to give a rare crystallographically characterized cis-[Ir](H)(Ph) complex. Alternatively, the rhodium carbonyl 5 or iridium isocyanide {PhB(OxMe2)2ImMes}Ir(CO)CNtBu (15) reacts with PhSiH3 in the dark to form the silyl compound {PhB(OxMe2)2ImMes}RhH(SiH2Ph)CO (14) or {PhB(OxMe2)2ImMes}IrH(SiH2Ph)CNtBu (17). These examples demonstrate the enhanced thermal reactivity of {PhB(OxMe2)2ImMes}-supported iridium and rhodium carbonyl compounds in comparison to tris(oxazolinyl)borate, tris(pyrazolyl)borate, and cyclopentadienyl-supported compounds.

  1. Structural, elastic, electronic, magnetic and vibrational properties of CuCoMnGa under pressure

    SciTech Connect (OSTI)

    ?yigr, Ahmet; U?ur, ?ule

    2014-10-06

    First principles calculations for the structural, electronic, elastic and phonon properties of the cubic quaternary heusler alloy CuCoMnGa on pressure have been reported by density functional theory (DFT) within generalized gradient approximation (GGA). The calculated values of the elastic constants were used for estimations of the Debye temperatures, the bulk modulus, the shear modulus, the young modulus E, the poisson's ratio ? and the B/G ratio. The elastic constants satisfy all of the mechanical stability criteria. The electronic structures of the ferromagnetic configuration for CuCoMnGa have a metallic character. The estimated magnetic moment per formula unit is 3.76 ?{sub B}. The phonon dispersion is studied using the supercell approach, and the stable nature at 0.2 GPa pressure is observed.

  2. Calculations of structural, elastic, electronic, magnetic and phonon properties of FeNiMnAl by the first principles

    SciTech Connect (OSTI)

    U?ur, ?ule; ?yigr, Ahmet

    2014-10-06

    The electronic, elastic and dynamical properties of the quaternary alloy FeNiMnAl have been investigated using a pseudopotential plane wave method within the generalized gradient approximation (GGA). We determined the lattice parameters and the bulk modulus B. In addition, the elastic properties such as elastic constans (C{sub 11}, C{sub 12} and C{sub 44}), the shear modulus G, the young modulus E, the poisson's ratio ? and the B/G ratio are also given. The FeNiMnAl Heusler alloy exhibit a ferromagnetic half-metallic behavior with the total magnetic moment of 4.02 ?{sub B}. The phonon dispersion of FeNiMnAl has been performed using the density functional theory and the direct method with 222 supercell.

  3. A=11Be (59AJ76)

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

    59AJ76) (Not illustrated) GENERAL: Mass of 11Be: From the decay energy, 11Be(β-)11B, and using the Wapstra mass (WA55C) for 11B, the mass excess of 11Be, M - A = 23.39 ± 0.15 MeV (WI59). The binding energies of a neutron, deuteron and triton in 11Be are, respectively, 0.54, 18.4 and 15.76 MeV. 1. 11Be(β-)11B Qm = 11.48 The decay proceeds to 11Bg.s. and to several excited states. For the ground-state transition, Eβ(max) = 11.48 ± 0.15 MeV; τ1/2 = 13.57 ± 0.15 sec, log ft = 6.77 (AL58E,

  4. A Communication-Optimal Framework for Contracting Distributed Tensors

    SciTech Connect (OSTI)

    Rajbhandari, Samyam; NIkam, Akshay; Lai, Pai-Wei; Stock, Kevin; Krishnamoorthy, Sriram; Sadayappan, Ponnuswamy

    2014-11-16

    Tensor contractions are extremely compute intensive generalized matrix multiplication operations encountered in many computational science fields, such as quantum chemistry and nuclear physics. Unlike distributed matrix multiplication, which has been extensively studied, limited work has been done in understanding distributed tensor contractions. In this paper, we characterize distributed tensor contraction algorithms on torus networks. We develop a framework with three fundamental communication operators to generate communication-efficient contraction algorithms for arbitrary tensor contractions. We show that for a given amount of memory per processor, our framework is communication optimal for all tensor contractions. We demonstrate performance and scalability of our framework on up to 262,144 cores of BG/Q supercomputer using five tensor contraction examples.

  5. Performance Tuning of Fock Matrix and Two-Electron Integral Calculations for NWChem on Leading HPC Platforms

    SciTech Connect (OSTI)

    Shan, Hongzhan; Austin, Brian M.; De Jong, Wibe A.; Oliker, Leonid; Wright, Nicholas J.; Apra, Edoardo

    2014-10-01

    Attaining performance in the evaluation of two-electron repulsion integrals and constructing the Fock matrix is of considerable importance to the computational chemistry community. Due to its numerical complexity improving the performance behavior across a variety of leading supercomputing platforms is an increasing challenge due to the significant diversity in high-performance computing architectures. In this paper, we present our successful tuning methodology for these important numerical methods on the Cray XE6, the Cray XC30, the IBM BG/Q, as well as the Intel Xeon Phi. Our optimization schemes leverage key architectural features including vectorization and simultaneous multithreading, and results in speedups of up to 2.5x compared with the original implementation.

  6. Theoretical studies of strongly correlated rare-earth intermetallics RIn? and RSn? (R=Sm, Eu, and Gd)

    SciTech Connect (OSTI)

    Shafiq, M.; Ahmad, Iftikhar E-mail: dr.iftikhar@uom.edu.pk; Jalali Asadabadi, S.

    2014-09-14

    In this paper, the structural, elastic, and electronic properties of RIn? and RSn? (R = Sm, Eu, Gd) compounds have been investigated using the full potential linearized augmented plane wave plus local orbital method within the density functional theory. The structural properties are investigated using the LDA, GGA, and the band correlated LDA+U and GGA+U schemes. The lattice parameters are in good agreement with the available experimental results and the divalent state of Eu is also verified. The spin-orbit coupling is included in order to predict the correct electronic properties and splitting of 4f states of the rare earth elements is also incorporated. We calculated Bulk modulus, shear modulus, Young's modulus, anisotropic ratio, Kleinman parameters, Poisson's ratio, Lame's co-efficient, sound velocities for shear and longitudinal waves, and Debye temperature. We also predict the Cauchy pressure and B/G ratio in order to explore the ductile and brittle behaviors of these compounds.

  7. Center for Nanophase Materials Sciences (CNMS) - CNMS User Research

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

    Covalently Bonded Three-Dimensional Carbon Nanotube Solids via Boron-Induced Nanojunctions D.P. Hashim,1 N.T. Narayanan,1 J.M. Romo-Herrera,2 D.A. Cullen,3 M.G. Hahm,1 P. Lezzi,4 J. R. Suttle,1 D. Kelkhoff,5 E. Munoz-Sandoval,6 S. Ganguli,7 A.K. Roy,7 D.J. Smith,8 R. Vajtai,1 B.G. Sumpter,3 V. Meunier,4 H. Terrones,3,9 M. Terrones,10 P.M. Ajayan1 1-Rice University, Houston, TX 2-Universidade de Vigo, Spain 3-Oak Ridge National Laboratory, Oak Ridge, TN. 4-Rensselaer Polytechnic Institute, Troy,

  8. OAiC RiDGE NATIONAL LABORAl-ORY LKCKKBSP HAITI MANA%ED AND OPERATED BY

    Office of Legacy Management (LM)

    OH42 -7 / i3-y OAiC RiDGE NATIONAL LABORAl-ORY LKCKKBSP HAITI MANA%ED AND OPERATED BY vxKHEEpyARluEwERoY fEsEARcHcxHtPoM~RN R3RmEuMYED~Am DEPMl' MEU?#bBgKiY . ORNL/TpvI-12968 Results of the Independent Radiological Verification Survey of the Remedial Action l?erformed at the Former Alba Craft Laboratory Site Oxford, Ohio (0x0001) K. R. Kleinhans M. E. Murray R. F. Carrier - This report has been reproduced directly from the best available copy. Available to DOE and DOE contractors from the Office

  9. OAK RIDGE OPERATIONS P. 0. HOX E OAK RID~F'

    Office of Legacy Management (LM)

    N ,-, :; j L.j U?.!IT~D ,C,-r,QTES . . EI~:ERC~Y m3mm-i A~I D~.G~-OWENT ~n~~r~~s-rn~\?-r(,~~ OAK RIDGE OPERATIONS P. 0. HOX E OAK RID~F' C, TEVKESf,FE 37830 September 12, 1977 t?; H. Kennedy, Division of Environmental Control Technology, HQ, GTN. !qS E-201 REPORT OF FINDINGS - WESTINGHOUSE, BL00:1FIELD, NEW JERSEY E.REI\ C' iLJC (;I, ,E, Cd&r:,:.? .:%' BG, - On r3ctaber 21, 1976, Howard Dickson, ORI',IL, and I visited Westinghouse located at 1 Westinghouse Plaza, Bloomfield, New Jersey, to

  10. Radionuclide Concentrations in Deer and Elk from Los Alamos National Laboratory: 1991-1998

    SciTech Connect (OSTI)

    D. H. Kraig; J. K. Ferenbaugh; J. R. Biggs; K. D. Bennett; M. A. Mullen; P. R. Fresquez

    1998-12-01

    Mule deer (Odocoileus hemionus) and Rocky Mountain elk (Cervus elaphus) forage in many areas at Los Alamos National Laboratory (LANL) that may contain radioactivity above natural and/or worldwide fallout levels. This paper summarizes radionuclide concentrations 3H, 90Sr, 137Cs, 238Pu, 239,240Pu, 241Am, and total uranium in muscle and bone tissue of deer and elk collected from LANL lands from 1991 through 1998. Also, the committed effective dose equivalent (CEDE) and the risk of excess cancer fatalities (RECF) to people who ingest muscle and bone from deer and elk collected from LANL lands were estimated. Most radionuclide concentrations in muscle and bone from individual deer and elk collected from LANL lands were either at less than detectable quantities (where the analytical result was smaller than two counting uncertainties) and/or within upper (95%) level background (BG) concentrations. As a group, most radionuclides in muscle and bone of deer and elk from LANL lands were not significantly higher (p<0.10) than in similar tissues from deer and elk collected from BG locations. Also, elk that had been radio collared and tracked for two years and spent an average time of 50% on LANL lands were not significantly different in most radionuclides from road kill elk that have been collected as part of the environmental surveillance program. Overall, the upper (95%) level net CEDES (the CEDE plus two sigma for each radioisotope minus background) at the most conservative ingestion rate (51 lbs of muscle and 13 lbs of bone) were as follows: deer muscle = 0.220, deer bone = 3.762, elk muscle = 0.117, and elk bone = 1.67 mrendy. AU CEDES were far below the International Commission on Radiological Protection guideline of 100 mrem/y, and the highest muscle plus bone CEDE (4.0 mrendy) corresponded to a RECF of 2E-06 which is far below the Environmental Protection Agency upper level guideline of 1E04.

  11. 1

    Office of Environmental Management (EM)

    J Hollis Digitally signed by Diana J Hollis DN: c=US, o=U.S. Government, ou=Department of Energy, ou=Los Alamos National Laboratory, ou=People, serialNumber=111125, cn=Diana J Hollis Date: 2015.05.14 14:15:49 -06'00' Diana J Hollis Digitally signed by Diana J Hollis DN: c=US, o=U.S. Government, ou=Department of Energy, ou=Los Alamos National Laboratory, ou=People, serialNumber=111125, cn=Diana J Hollis Date: 2015.05.14 14:17:23 -06'00' Save As LANL WAC PLAN-WASTEMGMT-002, R.3.8 History of

  12. Vibrational stark effects to identify ion pairing and determine reduction potentials in electrolyte-free environments

    SciTech Connect (OSTI)

    Mani, Tomoyasu; Grills, David C.; Miller, John R.

    2015-01-02

    A recently-developed instrument for time-resolved infrared detection following pulse radiolysis has been used to measure the ?(C?N) IR band of the radical anion of a CN-substituted fluorene in tetrahydrofuran. Specific vibrational frequencies can exhibit distinct frequency shifts due to ion-pairing, which can be explained in the framework of the vibrational Stark effect. Measurements of the ratio of free ions and ion-pairs in different electrolyte concentrations allowed us to obtain an association constant and free energy change for ion-pairing. As a result, this new method has the potential to probe the geometry of ion-pairing and allows the reduction potentials of molecules to be determined in the absence of electrolyte in an environment of low dielectric constant.

  13. Superhard composite materials including compounds of carbon and nitrogen deposited on metal and metal nitride carbide and carbonitride

    DOE Patents [OSTI]

    Wong, M.S.; Li, D.; Chung, Y.W.; Sproul, W.D.; Xi Chu; Barnett, S.A.

    1998-03-10

    A composite material having high hardness comprises a carbon nitrogen compound, such as CN{sub x} where x is greater than 0.1 and up to 1.33, deposited on a metal or metal compound selected to promote deposition of substantially crystalline CN{sub x}. The carbon nitrogen compound is deposited on a crystal plane of the metal or metal compound sufficiently lattice-matched with a crystal plane of the carbon nitrogen compound that the carbon nitrogen compound is substantially crystalline. A plurality of layers of the compounds can be formed in alternating sequence to provide a multi-layered, superlattice coating having a coating hardness in the range of 45--55 GPa, which corresponds to the hardness of a BN coating and approaches that of a diamond coating. 10 figs.

  14. Superhard composite materials including compounds of carbon and nitrogen deposited on metal and metal nitride, carbide and carbonitride

    DOE Patents [OSTI]

    Wong, M.S.; Li, D.; Chung, Y.W.; Sproul, W.D.; Chu, X.; Barnett, S.A.

    1998-07-07

    A composite material having high hardness comprises a carbon nitrogen compound, such as CN{sub x} where x is greater than 0.1 and up to 1.33, deposited on a metal or metal compound selected to promote deposition of substantially crystalline CN{sub x}. The carbon nitrogen compound is deposited on a crystal plane of the metal or metal compound sufficiently lattice-matched with a crystal plane of the carbon nitrogen compound that the carbon nitrogen compound is substantially crystalline. A plurality of layers of the compounds can be formed in alternating sequence to provide a multi-layered, superlattice coating having a coating hardness in the range of 45--55 GPa, which corresponds to the hardness of a BN coating and approaches that of a diamond coating. 10 figs.

  15. Superhard composite materials including compounds of carbon and nitrogen deposited on metal and metal nitride carbide and carbonitride

    DOE Patents [OSTI]

    Wong, Ming-Show (Northbrook, IL); Li, Dong (Evanston, IL); Chung, Yin-Wah (Wilmette, IL); Sproul, William D. (Palantine, IL); Chu, Xi (Evanston, IL); Barnett, Scott A. (Evanston, IL)

    1998-01-01

    A composite material having high hardness comprises a carbon nitrogen compound, such as CN.sub.x where x is greater than 0.1 and up to 1.33, deposited on a metal or metal compound selected to promote deposition of substantially crystalline CN.sub.x. The carbon nitrogen compound is deposited on a crystal plane of the metal or metal compound sufficiently lattice-matched with a crystal plane of the carbon nitrogen compound that the carbon nitrogen compound is substantially crystalline. A plurality of layers of the compounds can be formed in alternating sequence to provide a multi-layered, superlattice coating having a coating hardness in the range of 45-55 GPa, which corresponds to the hardness of a BN coating and approaches that of a diamond coating.

  16. Superhard composite materials including compounds of carbon and nitrogen deposited on metal and metal nitride, carbide and carbonitride

    DOE Patents [OSTI]

    Wong, Ming-Show (Northbrook, IL); Li, Dong (Evanston, IL); Chung, Yip-Wah (Wilmette, IL); Sproul, William D. (Palantine, IL); Chu, Xi (Evanston, IL); Barnett, Scott A. (Evanston, IL)

    1998-01-01

    A composite material having high hardness comprises a carbon nitrogen compound, such as CN.sub.x where x is greater than 0.1 and up to 1.33, deposited on a metal or metal compound selected to promote deposition of substantially crystalline CN.sub.x. The carbon nitrogen compound is deposited on a crystal plane of the metal or metal compound sufficiently lattice-matched with a crystal plane of the carbon nitrogen compound that the carbon nitrogen compound is substantially crystalline. A plurality of layers of the compounds can be formed in alternating sequence to provide a multi-layered, superlattice coating having a coating hardness in the range of 45-55 GPa, which corresponds to the hardness of a BN coating and approaches that of a diamond coating.

  17. The phase diagram and hardness of carbon nitrides

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

    Dong, Huafeng; Oganov, Artem R.; Zhu, Qiang; Qian, Guang-Rui

    2015-05-06

    Novel superhard materials, especially those with superior thermal and chemical stability, are needed to replace diamond. Carbon nitrides (C-N), which are likely to possess these characteristics and have even been expected to be harder than diamond, are excellent candidates. Here we report three new superhard and thermodynamically stable carbon nitride phases. Based on a systematic evolutionary structure searches, we report a complete phase diagram of the C-N system at 0–300 GPa and analyze the hardest metastable structures. Surprisingly, we find that at zero pressure, the earlier proposed graphitic-C3N4 structure (P6-bar m2) is dynamically unstable, and we find the lowest-energy structuremore » based on s-triazine unit and s-heptazine unit.« less

  18. ,"Price of U.S. Natural Gas Pipeline Imports From Canada (Dollars per Thousand Cubic Feet)"

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

    Monthly","12/2015" ,"Release Date:","2/29/2016" ,"Next Release Date:","3/31/2016" ,"Excel File Name:","n9102cn3m.xls" ,"Available from Web Page:","http://tonto.eia.gov/dnav/ng/hist/n9102cn3m.htm" ,"Source:","Energy Information Administration" ,"For Help, Contact:","infoctr@eia.doe.gov" ,,"(202) 586-8800",,,"2/26/2016 2:30:54 PM" "Back to

  19. ,"Price of U.S. Natural Gas Pipeline Imports From Canada (Dollars per Thousand Cubic Feet)"

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

    Annual",2015 ,"Release Date:","2/29/2016" ,"Next Release Date:","3/31/2016" ,"Excel File Name:","n9102cn3a.xls" ,"Available from Web Page:","http://tonto.eia.gov/dnav/ng/hist/n9102cn3a.htm" ,"Source:","Energy Information Administration" ,"For Help, Contact:","infoctr@eia.doe.gov" ,,"(202) 586-8800",,,"2/26/2016 2:30:54 PM" "Back to

  20. ,"U.S. Natural Gas Pipeline Imports From Canada (MMcf)"

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

    Annual",2015 ,"Release Date:","2/29/2016" ,"Next Release Date:","3/31/2016" ,"Excel File Name:","n9102cn2a.xls" ,"Available from Web Page:","http://tonto.eia.gov/dnav/ng/hist/n9102cn2a.htm" ,"Source:","Energy Information Administration" ,"For Help, Contact:","infoctr@eia.doe.gov" ,,"(202) 586-8800",,,"2/26/2016 2:30:53 PM" "Back to