National Library of Energy BETA

Sample records for 6 4 2

  1. 4X6" Rotary Bayonet LN2 Test Fill

    SciTech Connect (OSTI)

    Fitzpatrick, J.B.; /Fermilab

    1988-08-02

    This engineering note describes a test fill of the 4-inch x 6-inch rotary bayonet test fixture with LN{sub 2}. This test verifies the operation of valves on the fixture, and checks for proper construction/insulation. Further cold testing is imminent (with rotation and moment loading of the bayonet) after proper construction is verified and the test fixture is accepted. While this test fixture is a pressure vessel (4-inch), it does not require special safety treatment because it is under 6-inch in diameter. Flow capacity calculations were done to insure that the relief valve chosen would be capable of handling fire/loss of vacuum conditions. The D-Zero Safety Committee Chairman was notified of this testing.

  2. " East North Central",16.1,16.4,18.4,19.5,22.2,23.6

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

    More Persons",21.4,23.3,25.9,23.1,28.6,33.2 "Household Composition" " Households With Children","NA","NA",22.5,22.8,24.8,29.2 " Age of Oldest Child" " Under 7 Years","NA","NA",20.6...

  3. Transfer between the cesium 6 {sup 2}P{sub 1/2} and 6 {sup 2}P{sub 3/2} levels induced by collisions with H{sub 2}, HD, D{sub 2}, CH{sub 4}, C{sub 2}H{sub 6}, CF{sub 4}, and C{sub 2}F{sub 6}

    SciTech Connect (OSTI)

    Pitz, Greg A.; Fox, Charles D.; Perram, Glen P.

    2011-09-15

    The cross sections of spin-orbit energy exchange between the cesium 6 {sup 2}P{sub 1/2}{r_reversible}6 {sup 2}P{sub 3/2} states induced by collisions with N{sub 2}, H{sub 2}, HD, D{sub 2}, CH{sub 4}, C{sub 2}H{sub 6}, CF{sub 4}, and C{sub 2}F{sub 6} were obtained for pressures less than 100 Torr at room temperature by means of steady-state laser-induced fluorescence techniques. The spin-orbit energy exchange rate with N{sub 2}, H{sub 2}, HD, D{sub 2}, CH{sub 4}, C{sub 2}H{sub 6}, CF{sub 4}, and C{sub 2}F{sub 6}, have been measured as {sigma}{sub 21}(6 {sup 2}P{sub 3/2}{yields}6 {sup 2}P{sub 1/2})= 16.3, 34.1, 30.0, 22.7, 21.4, 65.6, 64.8, and 137 A{sup 2} and {sigma}{sub 12}(6 {sup 2}P{sub 1/2}{yields}6 {sup 2}P{sub 3/2})= 1.8, 4.4, 4.1, 3.0, 2.9, 13.3, 9.7, and 16.3 A{sup 2}, respectively. Correlations of the spin-orbit transfer probabilities with rotational-energy defect and vibrational-energy defect have been shown.

  4. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.2.4

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.2.4 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  5. Propellant Containing 3, 6bis(1h-1,2,3,4-Tetrazol-5-Ylamino)-1,2,4,5- Tetrazine Or Salt Thereof

    DOE Patents [OSTI]

    Hiskey, Michael A.; Chavez, David E.; Naud, Darren

    2003-12-02

    The compound 3,6-bis(1H-1,2,3,4-tetrazol-5-ylamino)-1,2,4,5-tetrazine and its salts are provided together with a propellant composition including an oxidizer, a binder and 3,6-bis(1H-1,2,3,4-tetrazol-5-ylamino)-1,2,4,5-tetrazine or its salts.

  6. A study of radiolytic stability of 25,27-bis(2-propyloxy) calix[4]-26,28-crown-6 (iPR-C[4]C-6)

    SciTech Connect (OSTI)

    Jianchen, Wang; Chongli, Song

    2008-07-01

    The radiolytic stability of 25,27-bis(2-propyloxy)calix[4] arene -26,28-crown-6 (iPr-C[4]C-6) was studied. {sup 60}co was used as a radiation source. Its dose rate was 437 Gy/min., and the total absorbed dose of the iPr-C[4]C-6 was from 10{sup 4} to 10{sup 6} Gy. The iPr-C[4]C-6 solid and 0.025 mol/L iPr-C[4]C-6/n-octanol which were pre-equilibrated with 0.01 mol/L and 3 mol/L nitric acid, respectively, were given different doses, and their extraction performance was researched. Their degradation mechanism was investigated by mass spectrometry (MS) and infrared spectroscopy (IR). The results show that radiolytic stability of the iPr-C[4]C-6 solid and 0.025 mol/L iPr-C[4]C-6/n-octanol are good when their absorbed dose is less than 10{sup 6} Gy. The extracting system of iPr-C[4]C-6/n-octanol is promising for separating cesium from high-level liquid waste(HLLW)

  7. Vicarious nucleophilic substitution using 4-amino-1,2,4-triazole, hydroxylamine or O-alkylhydroxylamine to prepare 1,3-diamino-2,4,6-trinitrobenzene or 1,3,5-triamino-2,4,6-trinitrobenzene

    DOE Patents [OSTI]

    Mitchell, Alexander R.; Pagoria, Philip F.; Schmidt, Robert D.

    1997-01-01

    The present invention relates to a process to produce 1,3-diamino-2,4,6-trinitrobenzene (DATB) or 1,3,5-triamino-2,4,6,-trinitrobenzene (TATB) by: (a) reacting at ambient pressure and a temperature of between about 0.degree. and 50.degree. C. for between about 0.1 and 24 hr, a trinitroaromatic compound of structure V: ##STR1## wherein X, Y, and Z are each independently selected from the group consisting of --H and --NH.sub.2, with the proviso that at least 1 or 2 of X, Y, and Z are hydrogen; with an effective amount of 1-amino-1,2,4-triazole, hydroxylamine or O-alkylhydroxamine to produce DATB or TATB; in the presence of a strong base selected from sodium butoxide, potassium butoxide, potassium propoxide, sodium propoxide, sodium ethoxide, potassium ethoxide, sodium methoxide, potassium methoxide, and combinations thereof; in a solvent selected from the group consisting of methanol, ethanol, propanol, butanol, dimethylsulphoxide, N-methylpyrrolidone, hexamethylphosphoramide, dimethylformide, dimethylacetamide and mixtures thereof, provided that when alcohols are present or when hydroxylamine or its O-alkyl derivatives replace ATA primarily DATB is formed; and (b) isolating the DATB or TATB produced. DATB and TATB are important and useful specialty explosives and intermediates for other materials.

  8. Vicarious nucleophilic substitution using 4-amino-1,2,4-triazole, hydroxylamine or O-alkylhydroxylamine to prepare 1,3-diamino-2,4,6-trinitrobenzene or 1,3,5-triamino-2,4,6-trinitrobenzene

    DOE Patents [OSTI]

    Mitchell, A.R.; Pagoria, P.F.; Schmidt, R.D.

    1997-05-27

    The present invention relates to a process to produce 1,3-diamino-2,4,6-trinitrobenzene (DATB) or 1,3,5-triamino-2,4,6,trinitrobenzene (TATB) by: (a) reacting at ambient pressure and a temperature of between about 0 and 50 C for between about 0.1 and 24 hr, a trinitroaromatic compound of the structure shown where X, Y, and Z are each independently selected from the group consisting of -H and -NH{sub 2}, with the proviso that at least 1 or 2 of X, Y, and Z are hydrogen; with an effective amount of 1-amino-1,2,4-triazole, hydroxylamine or O-alkylhydroxamine to produce DATB or TATB; in the presence of a strong base selected from sodium butoxide, potassium butoxide, potassium propoxide, sodium propoxide, sodium ethoxide, potassium ethoxide, sodium methoxide, potassium methoxide, and combinations thereof; in a solvent selected from the group consisting of methanol, ethanol, propanol, butanol, dimethylsulphoxide, N-methylpyrrolidone, hexamethylphosphoramide, dimethylformide, dimethylacetamide and mixtures thereof, provided that when alcohols are present or when hydroxylamine or its O-alkyl derivatives replace ATA primarily DATB is formed; and (b) isolating the DATB or TATB produced. DATB and TATB are important and useful specialty explosives and intermediates for other materials.

  9. Vicarious nucleophilic substitution to prepare 1,3-diamino-2,4,6-trinitrobenzene or 1,3,5-triamino-2,4,6-trinitrobenzene

    DOE Patents [OSTI]

    Mitchell, Alexander R. (Livermore, CA); Pagoria, Philip F. (Livermore, CA); Schmidt, Robert D. (Livermore, CA)

    1996-01-01

    The present invention relates to a process to produce 1,3-diamino-2,4,6-trinitrobenzene (DATB) or 1,3,5-triamino-2,4,6,-trinitrobenzene (TATB) by: (a) reacting at ambient pressure and a temperature of between about 0.degree. and 50.degree. C. for between about 0.1 and 24 hr, a trinitroaromatic compound of structure V: ##STR1## wherein X, Y, and Z are each independently selected from --H, or --NH.sub.2, with the proviso that at least 1 or 2 of X, Y, and Z are hydrogen, with an amount effective to produce DATB or TATB of 1,1,1-trialkylhydrazinium halide wherein alkyl is selected from methyl, ethyl, propyl or butyl and halide is selected from chloride, bromide or iodide. in the presence of a strong base selected from sodium butoxide, potassium butoxide, potassium propoxide, sodium propoxide, sodium ethoxide, potassium ethoxide, sodium methoxide, potassium methoxide, and combinations thereof; in a solvent selected from the group consisting of methanol, ethanol, propanol, butanol, dimethylsulphoxide, N-methylpyrrolidone, hexamethylphosphoramide, dimethylformide, dimethylacetamide and mixtures thereof, provided that when alcohols are present primarily DATB and picramide is formed; and (b) isolating the DATB or TATB produced. DATB and TATB are useful specialty explosives. TATB is also used for the preparation of benzenehexamine, a starting material for the synthesis of novel materials (optical imaging devices, liquid crystals, ferromagnetic compounds).

  10. Vicarious nucleophilic substitution to prepare 1,3-diamino-2,4,6-trinitrobenzene or 1,3,5-triamino-2,4,6-trinitrobenzene

    DOE Patents [OSTI]

    Mitchell, A.R.; Pagoria, P.F.; Schmidt, R.D.

    1996-10-29

    The present invention relates to a process to produce 1,3-diamino-2,4,6-trinitrobenzene (DATB) or 1,3,5-triamino-2,4,6,trinitrobenzene (TATB) by: (a) reacting at ambient pressure and a temperature of between about 0 and 50 C for between about 0.1 and 24 hr, a trinitroaromatic compound of the structure shown within where X, Y, and Z are each independently selected from --H, or --NH{sub 2}, with the proviso that at least 1 or 2 of X, Y, and Z are hydrogen, with an amount effective to produce DATB or TATB, or 1,1,1-trialkylhydrazinium halide wherein alkyl is selected from methyl, ethyl, propyl or butyl and halide is selected from chloride, bromide or iodide, in the presence of a strong base selected from sodium butoxide, potassium butoxide, potassium propoxide, sodium propoxide, sodium ethoxide, potassium ethoxide, sodium methoxide, potassium methoxide, and combinations thereof; in a solvent selected from the group consisting of methanol, ethanol, propanol, butanol, dimethylsulfoxide, N-methylpyrrolidone, hexamethylphosphoramide, dimethylformide, dimethylacetamide and mixtures thereof, provided that when alcohols are present primarily DATB and picramide is formed; and (b) isolating the DATB or TATB produced. DATB and TATB are useful specialty explosives. TATB is also used for the preparation of benzenehexamine, a starting material for the synthesis of novel materials (optical imaging devices, liquid crystals, ferromagnetic compounds).

  11. Hidden Superlattice in Tl2(SC6H4S) and Tl2(SeC6H4Se) Solved from Powder X-ray Diffraction

    SciTech Connect (OSTI)

    K Stone; D Turner; M Singh; T Vaid; P Stephens

    2011-12-31

    The crystal structures of the isostructural title compounds poly[({mu}-benzene-1,4-dithiolato)dithallium], Tl{sub 2}(SC{sub 6}H{sub 4}S), and poly[({mu}-benzene-1,4-diselenolato)dithallium], Tl{sub 2}(SeC{sub 6}H{sub 4}Se), were solved by simulated annealing from high-resolution synchrotron X-ray powder diffraction. Rietveld refinements of an initial structure with one formula unit per triclinic cell gave satisfactory agreement with the data, but led to a structure with impossibly close non-bonded contacts. A disordered model was proposed to alleviate this problem, but an alternative supercell structure leads to slightly improved agreement with the data. The isostructural superlattice structures were confirmed for both compounds through additional data collection, with substantially better counting statistics, which revealed the presence of very weak superlattice peaks not previously seen. Overall, each structure contains Tl-S or Tl-Se two-dimensional networks, connected by phenylene bridges. The sulfur (or selenium) coordination sphere around each thallium is a highly distorted square pyramid or a 'see-saw' shape, depending upon how many Tl-S or Tl-Se interactions are considered to be bonds. In addition, the two compounds contain pairs of Tl{sup I} ions that interact through a closed-shell 'thallophilic' interaction: in the sulfur compound there are two inequivalent pairs of Tl atoms with Tl-Tl distances of 3.49 and 3.58 {angstrom}, while in the selenium compound those Tl-Tl interactions are at 3.54 and 3.63 {angstrom}.

  12. Process for manufacturing bis(2-methoxyethyl)-2,3,6,7-tetracyano-1,4,5,8,9,10-hexazaanthracene

    SciTech Connect (OSTI)

    Rasmussen, Paul George; Lawton, Richard Graham

    2014-06-03

    A process to manufacture substituted tetracyano-hexaazatricyclics with the substitutions occurring at the 9 and 10 hydrogens. The process begins with 2,3-dichloro-5,6-dicyanopyrazine, which is reacted to form the desired tetracyano-hexaazatricyclic. Different process embodiments enable different reaction paths to the desired tetracyano-hexaazatricyclic. Different tetracyano-hexaazatricyclic embodiments include bis(2-methoxyethyl)-2,3,6,7-tetracyano-1,4,5,8,9,10-hexazaanthracene and bis(2-methoxyethoxyethyl)-2,3,6,7-tetracyano-1,4,5,8,9,10-hexazaanthracen- e.

  13. Preparation of 3,3'-azobis(6-amino-1,2,4,5-tetrazine)

    DOE Patents [OSTI]

    Hiskey, Michael A.; Chavez, David E.; Naud, Darren

    2002-01-01

    The compound of the structure ##STR1## where a, b, c, d and e are 0 or 1 and a+b+c+d+e is from 0 to 5 is disclosed together with the species 3,3'-azobis(6-amino-1,2,4,5-tetrazine) and a process of preparing such compounds.

  14. Preparation of 1,3,5-triamo-2,4,6-trinitrobenzene of submicron particle size

    DOE Patents [OSTI]

    Rigdon, Lester P.; Moody, Gordon L.; McGuire, Raymond R.

    2001-05-01

    A method is disclosed for the preparation of very small particle size, relatively pure 1,3,5-triamino-2,4,6-trinitrobenzene (TATB). Particles of TATB prepared according to the disclosed method are of submicron size and have a surface area in the range from about 3.8 to 27 square meters per gram.

  15. Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene of submicron particle size

    DOE Patents [OSTI]

    Rigdon, Lester P.; Moody, Gordon L.; McGuire, Raymond R.

    2001-01-01

    A method is disclosed for the preparation of very small particle size, relatively pure 1,3,5-triamino-2,4,6-trinitrobenzene (TATB). Particles of TATB prepared according to the disclosed method are of submicron size and have a surface area in the range from about 3.8 to 27 square meters per gram.

  16. Molecular and crystal structures of 4'-hydroxy derivative of (3R,6R)-3-methyl-6-isopropyl-2-(4-phenylbenzylidene)cyclohexanone

    SciTech Connect (OSTI)

    Kutulya, L. A.; Kulishov, V. I.; Shishkina, S. V.; Tolochko, A. S.; Roshal', A. D.; Shishkin, O. V.

    2008-05-15

    The molecular and crystal structures of the 4-hydroxy derivative of (3R,6R)-3-methyl-6-isopropyl-2-(4-phenylbenzylidene)cyclohexanone are determined by X-ray diffraction analysis. Single crystals are orthorhombic, a = 9.147(2) A, b = 12.959(2) A, c = 15.695(5) A, V = 1860.4(7) A{sup 3}, Z = 4, and space group P2{sub 1}2{sub 1}2{sub 1}. The cyclohexanone ring in the crystal structure has an asymmetric chair conformation. The puckering parameters are as follows: the puckering amplitude S is 0.91, and the puckering angles {theta} and {psi} are equal to 20.2{sup o} and 10.4{sup o}, respectively. It is established that the enone fragment and the cyclohexanone ring in molecules are flattened considerably. In the crystal structure, the molecules are linked by the hydrogen bonds (bond length, 1.85 A). The structural features and the strength of the hydrogen bonds for the compound under investigation and its analogue with one benzene ring are compared using the X-ray diffraction and IR spectroscopic data.

  17. Spot test for 1,3,5-triamino-2,4,6-trinitrobenzene, TATB

    DOE Patents [OSTI]

    Harris, B.W.

    1984-11-29

    A simple, sensitive and specific spot test for 1,3,5-triamino-2,4,6-trinitrobenzene, TATB, is described. Upon the application of the composition of matter of the subject invention to samples containing in excess of 0.1 mg of this explosive, a bright orange color results. Interfering species such as TNT and Tetryl can be removed by first treating the sample with a solvent which does not dissolve the TATB, but readily dissolves these interfering explosives.

  18. Spot test for 1,3,5-triamino-2,4,6-trinitrobenzene, TATB

    DOE Patents [OSTI]

    Harris, Betty W.

    1986-01-01

    A simple, sensitive and specific spot test for 1,3,5-triamino-2,4,6-trinitrobenzene, TATB, is described. Upon the application of the composition of matter of the present invention to samples containing in excess of 0.1 mg of this explosive, a bright orange color results. Interfering species such as TNT and Tetryl can be removed by first treating the sample with a solvent which does not dissolve much of the TATB, but readily dissolves these explosives.

  19. Thermally stable compositions including 2,4,8,10-tetranitro-5H-pyrido[3',2':4,5][1,2,3]triazolo[1,2-a]benzotriazo- l-6-ium, inner salt

    DOE Patents [OSTI]

    Hiskey, Michael A.; Huynh, My Hang

    2010-01-26

    An explosive formulation including 2,4,8,10-tetranitro-5H-pyrido[3',2':4,5][1,2,3]triazolo[1,2-a]benzotriazo- l-6-ium, inner salt and a high temperature binder is disclosed together with a process of preparing 2,4,8,10-tetranitro-5H-pyrido[3',2':4,5][1,2,3]triazolo[1,2-a]benzotriazo- l-6-ium, inner salt.

  20. Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene from 3,5-dichloroanisole

    DOE Patents [OSTI]

    Ott, D.G.; Benziger, T.M.

    1991-03-05

    Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) from 3,5-dichloroanisole is described. Nitration of 3,5-dichloroanisole under relatively mild conditions gave 3,5-dichloro-2,4,6-trinitroanisole in high yield and purity. Ammonolysis of this latter compound gave the desired TATB. Another route to TATB was through the treatment of the 3,5-dichloro-2,4,6-trinitroanisole with thionyl chloride and dimethylformamide to yield 1,3,5-trichloro-2,4,6-trinitrobenzene. Ammonolysis of this product produced TATB. 8 figures.

  1. Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene from 3,5-dichloroanisole

    DOE Patents [OSTI]

    Ott, Donald G. (Los Alamos, NM); Benziger, Theodore M. (Santa Fe, NM)

    1991-01-01

    Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) from 3,5-dichloroanisole. Nitration of 3,5-dichloroanisole under relatively mild conditions gave 3,5-dichloro-2,4,6-trinitroanisole in high yield and purity. Ammonolysis of this latter compound gave the desired TATB. Another route to TATB was through the treatment of the 3,5-dichloro-2,4,6-trinitroanisole with thionyl chloride and dimethylformamide to yield 1,3,5-trichloro-2,4,6-trinitrobenzene. Ammonolysis of this product produced TATB.

  2. Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene from 3,5-dichloranisole

    DOE Patents [OSTI]

    Ott, Donald G. (Los Alamos, NM); Benziger, Theodore M. (Santa Fe, NM)

    1990-01-01

    Preparation of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) from 3,5-dichloroanisole. Nitration of 3,5-dichloroanisole under relatively mild conditions gave 3,5-dichloro-2,4,6-trinitroanisole in high yield and purity. Ammonolysis of this latter compound gave the desired TATB. Another route to TATB was through the treatment of the 3,5-dichloro-2,4,6-trinitroanisole with thionyl chloride and dimethylformamide to yield 1,3,5-trichloro-2,4,6-trinitrobenzene. Ammonolysis of this product produced TATB.

  3. Spectroscopic studies and structure of 3-methoxy-2 -[(2,4,4,6,6-pentachloro-1,3,5,2{lambda}{sup 5},4{lambda}{sup 5},6{lambda}{sup 5}-triazatriphosphin-2-yl)oxy] benzaldehyde

    SciTech Connect (OSTI)

    Oezay, H.; Yildiz, M.; Uenver, H.; Durlu, T. N.

    2013-01-15

    The compound called 3-methoxy-2- [(2,4,4,6,6-pentachloro-1,3,5,2{lambda}{sup 5},4{lambda}{sup 5},6{lambda}{sup 5}-triazatriphosphin-2-yl)oxy] benzaldehyde has been synthesized from the reaction of 2-hydroxy-3-methoxybenzaldehyde with hexachlorocyclotriphosphazene. It has been characterized by elemental analysis, MS, IR, {sup 1}H NMR, {sup 13}C NMR, {sup 31}P NMR and UV-visible spectroscopic techniques. The structure of the title compound has been determind by X-ray analysis. Crystals are orthorhombic, space group P2{sub 1}2{sub 1}2{sub 1}, Z = 4, a = 7.705(1), b = 12.624(1), c = 17.825(2) A, R{sub 1} = 0.0390 and wR{sub 2} = 0.1074 [I > 2{sigma}(I)], respectively.

  4. Degradation products of 2,4,6-Trinitrotoluene by a microbial consortia

    SciTech Connect (OSTI)

    Ortiz, O.; Parker, C.; Bender, J.

    1995-12-01

    Remediation of contaminated soils can be accomplished using microbial species. Of particular interest is the remediation of explosive contaminated soils. A microbial consortia has been developed which removes TNT by an unexplained mechanism. Our goal is to understand the degradation of TNT by this microbial mat. Constructed mats have been generated in our laboratory by enriching water with ensiled grass and adding specific microbial components for organic degradation. Microbial mats are natural mixed microbial communities dominated by cyanobacterias (blue-green algae). In this research, degradation products of TNT have been identified using GC/MS. Ninety-seven percent of TNT (1000 mg/L), was removed in < 1 day by floating mats placed over TNT-contaminated water in quiescent ponds. Metabolites of TNT, 2, 4-Dinitro-6 amminotoluene and 2-Nitro-4,6 diaminotoluene has been observed after 1 day of mat treatment. A mechanism is postulated for this degradation showing that two of the nitro groups of the TNT molecule are being reduced to amino groups systematically. Anoxic zones in the mat, containing sulfur-reducing bacteria, may account for the reduction of TNT. GC/MS shows significant decreases in metabolite concentrations in 4-7 days, indicating continued degradation of TNT. It has been found by toxicity assays that these metabolites appeared to be nontoxic and nonmutagenic. These results suggest that floating microbial mats may be useful for the decontamination of sites in the environment contaminated with TNT. Further studies using {sup 13}C TNT will focus on the fate of the carbon, to determine the intermediates products prior to transformations into hydrocarbons or utilization by the bacteria consortia.

  5. Fundamental Kinetics Database Utilizing Shock Tube Measurements (Volumes 1, 2, 3, 4, and Volume 6)

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

    Davidson, D. F.; Hanson, R. K

    The data from shock tube experiments generally takes three forms: ignition delay times, species concentration time-histories and reaction rate measurements. Volume 1 focuses on ignition delay time data measured and published by the Shock Tube Group in the Mechanical Engineering Department of Stanford University. The cut-off date for inclusion into this volume was January 2005. Volume 2 focuses on species concentration time-histories and was cut off December 2005. The two volumes are in PDF format and are accompanied by a zipped file of supporting data. Volume 3 was issued in 2009. Volume 4, Ignition delay times measurements came out in May, 2014, along with Reaction Rates Measurements, Vol 6. Volume 5 is not available at this time.

  6. Data:4bc8edda-d0e1-40ee-aac2-c2b32603a6b4 | Open Energy Information

    Open Energy Info (EERE)

    edda-d0e1-40ee-aac2-c2b32603a6b4 No revision has been approved for this page. It is currently under review by our subject matter experts. Jump to: navigation, search Loading... 1....

  7. Aerobic degradation of 2,4,6-trinitrotoluene by Enterobacter cloacae PB2 and by pentaerythritol tetranitrate reductase

    SciTech Connect (OSTI)

    French, C.E.; Bruce, N.C.; Nicklin, S.

    1998-08-01

    Enterobacter cloacae PB2 was originally isolated on the basis of its ability to utilize nitrate esters, such as pentaerythritol tetranitrate (PETN) and glycerol trinitrate, as the sole nitrogen source for growth. The enzyme responsible is an NADPH-dependent reductase designated PETN reductase. E. cloacae PB2 was found to be capable of slow aerobic growth with 2,4,6-trinitrotoluene (TNT) as the sole nitrogen source. Dinitrotoluenes were not produced and could not be used as nitrogen sources. Purified PETN reductase was found to reduce TNT to its hydride-Meisenheimer complex, which was further reduced to the dihydride-Meisenheimer complex. Purified PETN reductase and recombinant Escherichia coli expressing PETN reductase were able to liberate nitrogen as nitrite from TNT. The ability to remove nitrogen from TNT suggests that PB2 or recombinant organisms expressing PETN reductase may be useful for bioremediation of TNT-contaminated soil and water.

  8. Chemically induced Parkinson's disease: intermediates in the oxidation of 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine to the 1-methyl-4-phenyl-pyridinium ion

    SciTech Connect (OSTI)

    Chacon, J.N.; Chedekel, M.R.; Land, E.J.; Truscott, T.G.

    1987-04-29

    Various unstable intermediate oxidation states have been postulated in the metabolic activation of 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine to the 1-methyl-4-phenyl pyridinium ion. We now report the first direct observation of these free radical intermediates by pulse radiolysis and flash photolysis. Studies are described of various reactions of such species, in particular with dopamine whose autoxidation to dopamine quinone is reported to be potentiated by 1-methyl-4-phenyl-1,2,3, 6-tetrahydropyridine.

  9. Photo-initiated reactions of 2,4,6 TCP on Degussa P25 formulation TiO{sub 2} : wavelength sensitive decomposition.

    SciTech Connect (OSTI)

    Hurum, D. C.; Gray, K. A.; Rajh, T.; Thurnauer, M. C.; Chemistry; Northwestern Univ.

    2004-10-21

    The photoinitiated oxidative reactions of 2,4,6 trichlorophenol (2,4,6 TCP) and 2,4,5 trichlorophenol (2,4,5 TCP) are studied on the titania photocatalyst Degussa P25. On this catalyst 2,4,6 TCP is used to confirm two distinct oxidative mechanisms that are triggered at different light-excitation wavelengths. A charge-transfer mechanism occurs at sub-bandgap energies of the photocatalyst leading to a phenoxyl radical product and an oxidative mechanism occurs at the bandgap leading to a semiquinone radical product. The wavelength dependence of these two mechanisms is discussed.

  10. Role of SrMoO{sub 4} in Sr{sub 2}MgMoO{sub 6} synthesis

    SciTech Connect (OSTI)

    Vasala, S.; Yamauchi, H.; Karppinen, M.

    2011-05-15

    Here we investigate the elemental and phase compositions during the solid-state synthesis of the promising SOFC-anode material, Sr{sub 2}MgMoO{sub 6}, and demonstrate that molybdenum does not notably evaporate under the normal synthesis conditions with temperatures up to 1200 {sup o}C due to the formation of SrMoO{sub 4} as an intermediate product at low temperatures, below 600 {sup o}C. However, partial decomposition of the Sr{sub 2}MgMoO{sub 6} phase becomes evident at the higher temperatures ({approx}1500 {sup o}C). The effect of SrMoO{sub 4} on the electrical conductivity of Sr{sub 2}MgMoO{sub 6} is evaluated by preparing a series of Sr{sub 2}MgMoO{sub 6} samples with different amounts of additional SrMoO{sub 4}. Under the reducing operation conditions of an SOFC anode the insulating SrMoO{sub 4} phase is apparently reduced to the highly conductive SrMoO{sub 3} phase. Percolation takes place with 20-30 wt% of SrMoO{sub 4} in a Sr{sub 2}MgMoO{sub 6} matrix, with a notable increase in electrical conductivity after reduction. Conductivity values of 14, 60 and 160 S/cm are determined at 800 {sup o}C in 5% H{sub 2}/Ar for the Sr{sub 2}MgMoO{sub 6} samples with 30, 40 and 50 wt% of added SrMoO{sub 4}, respectively. -- Graphical abstract: SrMoO{sub 4} is formed at low temperatures during the synthesis of Sr{sub 2}MgMoO{sub 6}, which prevents the volatilization of Mo from typical precursor mixtures of this promising SOFC anode material. SrMoO{sub 4} is insulating and it is often found as an impurity in Sr{sub 2}MgMoO{sub 6} samples. It is however readily reduced to highly conducting SrMoO{sub 3}. Composites of Sr{sub 2}MgMoO{sub 6} and SrMoO{sub 3} show increased electrical conductivities compared to pure Sr{sub 2}MgMoO{sub 6} under the reductive operation conditions of an SOFC anode. Display Omitted Highlights: {yields} Sr{sub 2}MgMoO{sub 6} is a promising SOFC anode material. {yields} During the Sr{sub 2}MgMoO{sub 6} synthesis SrMoO{sub 4} is formed at low temperatures. {yields} Formation of SrMoO{sub 4} effectively prevents volatilization of Mo at high temperatures. {yields} Insulating SrMoO{sub 4} reduces to highly conductive SrMoO{sub 3} under SOFC-anode conditions. {yields} Composites of Sr{sub 2}MgMoO{sub 6} and SrMoO{sub 3} show high electrical conductivities.

  11. Resonant Spin Excitation in the High Temperature Superconductor Ba0.6K0.4Fe2As2

    SciTech Connect (OSTI)

    Christianson, Andrew D; Goremychkin, E. A.; Osborn, R.; Rosenkranz, Stephen; Lumsden, Mark D; Malliakas, C.; Todorov, L.; Claus, H.; Chung, D.Y.; Kanatzidis, M.; Bewley, Robert I.; Guidi, T.

    2008-12-18

    A new family of superconductors containing layers of iron arsenide has attracted considerable interest because of their high transition temperatures (T{sub c}), some of which are >50 K, and because of similarities with the high-{sub c} copper oxide superconductors. In both the iron arsenides and the copper oxides, superconductivity arises when an antiferromagnetically ordered phase has been suppressed by chemical doping. A universal feature of the copper oxide superconductors is the existence of a resonant magnetic excitation, localized in both energy and wavevector, within the superconducting phase. This resonance, which has also been observed in several heavy-fermion superconductors is predicted to occur when the sign of the superconducting energy gap takes opposite values on different parts of the Fermi surface, an unusual gap symmetry which implies that the electron pairing interaction is repulsive at short range. Angle-resolved photoelectron spectroscopy shows no evidence of gap anisotropy in the iron arsenides, but such measurements are insensitive to the phase of the gap on separate parts of the Fermi surface. Here we report inelastic neutron scattering observations of a magnetic resonance below T{sub c} in Ba{sub 0.6}K{sub 0.4}Fe{sub 2}As{sub 2}, a phase-sensitive measurement demonstrating that the superconducting energy gap has unconventional symmetry in the iron arsenide superconductors.

  12. Structure, phase transitions, and isotope effects in [(CH3)4N]2PuCl6

    SciTech Connect (OSTI)

    Wilson, Richard E.

    2015-11-02

    The single crystal X-ray diffraction structure of [(CH3)4N]2PuCl6 is presented for the first time, resolving long standing confusion and speculation regarding the structure of this compound in the literature. A temperature dependent study of this compound shows that the structure of [(CH3)4N]2PuCl6 undergoes no fewer than two phase transitions between 100 and 360 K. The phase of [(CH3)4N]2PuCl6 at room temperature is Fd-3c a = 26.012(3) Å. At 360 K, the structure is in space group Fm-3m with a = 13.088(1) Å. The plutonium octahedra and tetramethylammonium cations undergo a rotative displacement and the degree of rotation varies with temperature, giving rise to the phase transition from Fm-3m to Fd-3c as the crystal is cooled. Synthesis and structural studies of the deuterated salt [(CD3)4N]2PuCl6 suggest that there is an isotopic effect associated with this phase transition as revealed by a changing transition temperature in the deuterated versus protonated compound indicating that the donor-acceptor interactions between the tetramethylammonium cations and the hexachloroplutonate anions are driving the phase transformation.

  13. Thermal Reactions of Uranium Metal, UO2, U3O8, UF4, and UO2F2 with NF3 to Produce UF6

    SciTech Connect (OSTI)

    McNamara, Bruce K.; Scheele, Randall D.; Kozelisky, Anne E.; Edwards, Matthew K.

    2009-11-01

    he objective of this paper is to demonstrate that NF3 fluorinates uranium metal, UO2, UF4, UO3, U3O8, and UO2F22H2O to produce the volatile UF6 at temperatures between 100 and 500?C. Thermogravimetric reaction profiles are described that reflect changes in the uranium oxidation state and discrete chemical speciation. Differences in the onset temperatures for each system indicate that NF3-substrate interactions are important for the temperature at which NF3 reacts: U metal > UO3 > UO2 > UO2F2 > UF4 and in fact may indicate different fluorination mechanisms for these various substrates. These studies demonstrate that NF3 is a potential replacement fluorinating agent in the existing nuclear fuel cycle and in oft-proposed actinide volatility reprocessing.

  14. (2R)-4-Oxo-4[3-(Trifluoromethyl)-5,6-diihydro:1,2,4}triazolo[4,3-a}pyrazin-7(8H)-y1]-1-(2,4,5-trifluorophenyl)butan-2-amine: A Potent, Orally Active Dipeptidyl Peptidase IV Inhibitor for the Treatment of Type 2 Diabetes

    SciTech Connect (OSTI)

    Kim, D.; Wang, L.; Beconi, M.; Eiermann, G.; Fisher, M.; He, H.; Hickey, G.; Kowalchick, Jennifer; Leiting, Barbara; Lyons, K.; Marsilio, F.; McCann, F.; Patel, R.; Petrov, A.; Scapin, G.; Patel, S.; Roy, R.; Wu, J.; Wyvratt, M.; Zhang, B.; Zhu, L.; Thornberry, N.; Weber, A.

    2010-11-10

    A novel series of {beta}-amino amides incorporating fused heterocycles, i.e., triazolopiperazines, were synthesized and evaluated as inhibitors of dipeptidyl peptidase IV (DPP-IV) for the treatment of type 2 diabetes. (2R)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-amine (1) is a potent, orally active DPP-IV inhibitor (IC{sub 50} = 18 nM) with excellent selectivity over other proline-selective peptidases, oral bioavailability in preclinical species, and in vivo efficacy in animal models. MK-0431, the phosphate salt of compound 1, was selected for development as a potential new treatment for type 2 diabetes.

  15. 4-(3-Methoxyphenyl)-2,6-dimethylcyclohex-3-enecarboxylic acid

    SciTech Connect (OSTI)

    Xie, Songwen; Nusbaum, Dannette A.; Stein, Holly J.; Pink, Maren

    2012-03-15

    The racemic title compound, C{sub 16}H{sub 20}O{sub 3}, was synthesized to study the hydrogen-bonding interaction of the two enantiomers in the solid state. In the crystal structure, R and S pairs of the racemate are linked by pairs of intermolecular O-H...O hydrogen bonds, producing centrosymmetric R{sub 2}{sup 2}(8) rings.

  16. Two new coordination polymers constructed by naphthalene-1,4-dicarboxylic acid and 2,4-diamino-6-methyl-triazine

    SciTech Connect (OSTI)

    Li, Yamin; Xiao, Changyu; Zhang, Xudong; Xu, Yanhui; Li, Junrui; Lun, Huijie; Chen, Qi

    2013-08-15

    Two new transition metal coordination complexes, ([MnO(nda)](H{sub 2}dmt)(H{sub 2}O)){sub n} (1), [Ag{sub 5}(nda){sub 2.5}(dmt)]{sub n} (2), (H{sub 2}nda=naphthalene-1,4-dicarboxylic acid, dmt=2,4-diamine-6-methyl-1,3,5-triazine) have been hydrothermally synthesized by the reactions of H{sub 2}nda and dmt with the homologous MnCl{sub 24H{sub 2}O and AgNO{sub 3}, respectively, and characterized by single-crystal X-ray diffraction, IR spectra, elemental analysis, thermogravimetric analysis (TGA). The compound 1 exhibits a 3D network comprising 1D metal chain (MnO(CO{sub 2}){sub 2}){sub n} connected by the ligand nda{sup 2−}, featuring a four-connected uninodal diamond -like topology. In compound 2, it is firstly observed that decanuclear silver units as secondary building units to construct 3D network by the ligands dmt and nda{sup 2−}, with a rare 2-nodal (3,8)-connected tfz-d topology ((4{sup 3}){sub 2}(4{sup 6}.6{sup 18}.8{sup 4})). The interactions within each Mn(II)—Mn(II) pair of compound 1 are antiferromagnetic (g=2.07, J=−1.42(1) cm{sup −1}, zj′=−0.73(2) cm{sup −1}). In addition, compound 2 exhibits photoluminescent property at about 472 nm (λ{sub ex}=394 nm). - Graphical abstract: Two new transition metal coordination complexes 1–2 have been hydrothermally synthesized and characterized by single-crystal X-ray diffraction, IR spectra, elemental analysis thermogravimetric analysis (TGA). Highlights: • The compound 1 exhibits a 3D network with four-connected uninodal diamond-like topology. • The first 3D network of 2 with a rare tfz-d topology consists of decanuclear silver clusters as secondary building units. • The magnetic measurement indicates the compound 1 shows antiferromagnetic interactions. • The photoluminescent property of 2 has been measured.

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

    SciTech Connect (OSTI)

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

    2009-09-15

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

  18. Magnetocaloric effect in gadolinium-oxalate framework Gd{sub 2}(C{sub 2}O{sub 4}){sub 3}(H{sub 2}O){sub 6}⋅(0{sub ⋅}6H{sub 2}O)

    SciTech Connect (OSTI)

    Sibille, Romain Didelot, Emilie; Mazet, Thomas; Malaman, Bernard; François, Michel

    2014-12-01

    Magnetic refrigerants incorporating Gd{sup 3+} ions and light organic ligands offer a good balance between isolation of the magnetic centers and their density. We synthesized the framework material Gd{sub 2}(C{sub 2}O{sub 4}){sub 3}(H{sub 2}O){sub 6}⋅0.6H{sub 2}O by a hydrothermal route and characterized its structure. The honeycomb lattice of Gd{sup 3+} ions interlinked by oxalate ligands in the (a,c) plane ensures their decoupling in terms of magnetic exchange interactions. This is corroborated by magnetic measurements indicating negligible interactions between the Gd{sup 3+} ions in this material. The magnetocaloric effect was evaluated from isothermal magnetization measurements. The maximum entropy change −ΔS{sub M}{sup max} reaches 75.9 mJ cm{sup −3} K{sup −1} (around 2 K) for a moderate field change (2 T)

  19. O R N L 2 0 1 5 - G 0 0 6 9 4 / t c c

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

    N L 2 0 1 5 - G 0 0 6 9 4 t c c D e l i v e r i n g i n d u s t r y s o l u t i o n s t h r o u g h p r e d i c t i v e s i mu l a t i o n * I mp r o v e d r e a c t o r p e r f...

  20. Crystal structure of 1-methyl-3-([2,2-dimethyl-4,6-dioxo-1,3-dioxane-5-ylidene]methyl)urea

    SciTech Connect (OSTI)

    Habibi, A. Ghorbani, H. S.; Bruno, G.; Rudbari, H. A.; Valizadeh, Y.

    2013-12-15

    The crystal structure of 1-Methyl-3-([2,2-dimethyl-4,6-dioxo-1,3-dioxane-5-ylidene]methyl)urea (C{sub 9}H{sub 12}N{sub 2}O{sub 5}) has been determined by single crystal X-ray diffraction analysis. The crystals are monoclinic, a = 5.3179(2), b = 18.6394(6), c =10.8124(3) , ? = 100.015(2), Z = 4, sp. gr. P2{sub 1}/c, R = 0.0381 for 2537 reflections with I > 2?(I). Except for C(CH{sub 3}){sub 2} group, the molecule is planar. The structure is stabilized by inter- and intramolecular N-H...O hydrogen bonds and weak C-H...O interactions.

  1. Data:5277c4c2-0b8b-4179-ad2c-59139826c6f2 | Open Energy Information

    Open Energy Info (EERE)

    ad2c-59139826c6f2 No revision has been approved for this page. It is currently under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic...

  2. Intrinsic Nanostructure in Zr2-xFe4Si16-y (x=0.81, y=6.06)

    SciTech Connect (OSTI)

    Smith, G J; Simonson, J W; Orvis, T; Marques, C; Grose, J E; Kistner-Morris, J J; Wu, L; Cho, Kyuil; Kim, Hyong june; Tanatar, Makariy A; Garlea, V O; Prozorov, Ruslan; Zhu, Y; Aronson, M C

    2014-09-17

    We present a study of the crystal structure and physical properties of single crystals of a new Fe-based ternary compound, Zr2?x Fe4Si16?y(x=0.81,y=6.06). Zr1.19 Fe4Si9.94 is a layered compound, where stoichiometric ?-FeSi2-derived slabs are separated by Zr-Si planes with substantial numbers of vacancies. High resolution transmission electron microscopy (HRTEM) experiments show that these Zr-Si layers consist of 3.5nm domains where the Zrand Si vacancies are ordered within a supercell sixteen times the volume of the stoichiometric cell. Within these domains, the occupancies of the Zr and Si sites obey symmetry rules that permit only certain compositions, none of which by themselves reproduce the average composition found in x-ray diffraction experiments. Magnetic susceptibility and magnetization measurements reveal a small but appreciable number of magnetic moments that remain freely fluctuating to 1.8K, while neutron diffraction confirms the absence of bulk magnetic order with a moment of 0.2? B or larger down to 1.5K. Electrical resistivity measurements find that Zr1.19Fe4Si9.94 is metallic, and the modest value of the Sommerfeld coefficient of the specific heat ? = C/T suggests that quasi-particle masses are not particularly strongly enhanced. The onset of superconductivity at Tc 6K results in a partial resistive transition and a small Meissner signal, although a bulk-like transition is found in the specific heat. Sharp peaks in the ac susceptibility signal the interplay of the normal skin depth and the London penetration depth, typical of a system in which nano-sized superconducting grains are separated by a on-superconducting host. Ultra low field differential magnetic susceptibility measurements reveal the presence of a surprisingly large number of trace magnetic and superconducting phases, suggesting that the Zr-Fe-Si ternary system could be a potentially rich source of new bulk superconductor.

  3. TTW 4-6-06

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

    6, 2006 WIPP Quick Facts (As of 04-05-06) 4,472 Shipments received since opening 36,697 Cubic meters of waste disposed 76,623 Containers disposed in the underground Trone appointed to new position SNL-Carlsbad Program Group has announced the appointment of Janis Trone as the team lead for Quality Assurance (QA). Trone has seven years of experience in WIPP QA. Since joining SNL in 1993, she has worked in QA, the National TRU Program and Performance Assessment. CEO Tour Chuck Spencer, chief

  4. Data:D045f2af-6b4f-465b-b015-d2ee4a986972 | Open Energy Information

    Open Energy Info (EERE)

    under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic Information 2. Demand 3. Energy << Previous 1 2 3 Next >> Basic Information...

  5. 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.

  6. Final analysis of proton form factor ratio data at Q2 = 4.0, 4.8, and 5.6 GeV2

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

    Puckett, A. J. R.; Brash, E. J.; Gayou, O.; Jones, M. K.; Pentchev, L.; Perdrisat, C. F.; Punjabi, V.; Aniol, K. A.; Averett, T.; Benmokhtar, F.; et al

    2012-04-11

    Recently published measurements of the proton electromagnetic form factor ratio R = μp GEp/GMp at momentum transfers Q2 up to 8.5 GeV2 in Jefferson Lab Hall C deviate from the linear trend of previous measurements in Jefferson Lab Hall A, favoring a slower rate of decrease of R with Q2. While statistically compatible in the region of overlap with Hall A, the Hall C data hint at a systematic difference between the two experiments. This possibility was investigated in a reanalysis of the Hall A data. We find that the original analysis underestimated the background in the selection of elasticmore » events. The application of an additional cut to further suppress the background increases the results for R, improving the consistency between Halls A and C.« less

  7. Brazing ZrO{sub 2} ceramic to Ti6Al4V alloy using NiCrSiB amorphous filler foil: Interfacial microstructure and joint properties

    SciTech Connect (OSTI)

    Cao, J., E-mail: cao_jian@hit.edu.cn [Shandong Provincial Key Laboratory of Special Welding Technology, Harbin Institute of Technology at Weihai, Weihai 264209 (China); State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Song, X.G., E-mail: song_xiaoguohit@yahoo.com.cn [Shandong Provincial Key Laboratory of Special Welding Technology, Harbin Institute of Technology at Weihai, Weihai 264209 (China); State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Li, C., E-mail: li_chun1989@yahoo.cn [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Zhao, L.Y., E-mail: Zhao_ly@163.com [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Feng, J.C., E-mail: feng_jicai@163.com [Shandong Provincial Key Laboratory of Special Welding Technology, Harbin Institute of Technology at Weihai, Weihai 264209 (China); State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China)

    2013-07-15

    Reliable brazing of ZrO{sub 2} ceramic and Ti6Al4V alloy was achieved using NiCrSiB amorphous filler foil. The interfacial microstructure of ZrO{sub 2}/Ti6Al4V joints was characterized by scanning electron microscope, energy dispersive spectrometer and micro-focused X-ray diffractometer. The effects of brazing temperature on the interfacial microstructure and joining properties of brazed joints were investigated in detail. Active Ti of Ti6Al4V alloy dissolved into molten filler metal and reacted with ZrO{sub 2} ceramic to form a continuous TiO reaction layer, which played an important role in brazing. Various reaction phases including Ti{sub 2}Ni, Ti{sub 5}Si{sub 3} and ?-Ti were formed in brazed joints. With an increasing of brazing temperature, the TiO layer thickened gradually while the Ti{sub 2}Ni amount reduced. Shear test indicated that brazed joints tend to fracture at the interface between ZrO{sub 2} ceramic and brazing seam or Ti{sub 2}Ni intermetallic layer. The maximum average shear strength reached 284.6 MPa when brazed at 1025 C for 10 min. - Graphical Abstract: Interfacial microstructure of ZrO{sub 2}/TC4 joint brazed using NiCrSiB amorphous filler foil was: ZrO{sub 2}/TiO/Ti{sub 2}Ni + ?-Ti + Ti{sub 5}Si{sub 3}/?-Ti/Widmansttten structure/TC4. - Highlights: Brazing of ZrO{sub 2} ceramic and Ti-6Al-4V alloy was achieved. Interfacial microstructure was TiO/Ti{sub 2}Ni + ? + Ti{sub 5}Si{sub 3}/?/Widmansttten structure. The formation of TiO produced the darkening effect of ZrO{sub 2} ceramic. The highest joining strength of 284.6MPa was obtained.

  8. Spin orientations of the spin-half Ir4+ ions in Sr3NiIrO6, Sr2IrO4 and Na2IrO3: Density functional, perturbation theory and Madelung potential analyses

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

    Gordon, Elijah E.; Xiang, Hongjun; Koehler, Jurgen; Whangbo, Myung -Hwan

    2016-03-01

    The spins of the low-spin Ir4+ (S = 1/2, d5) ions at the octahedral sites of the oxides Sr3NiIrO6, Sr2IrO4 and Na2IrO3 exhibit preferred orientations with respect to their IrO6 octahedra. We evaluated the magnetic anisotropies of these S = 1/2 ions on the basis of DFT calculations including spin-orbit coupling (SOC), and probed their origin by performing perturbation theory analyses with SOC as perturbation within the LS coupling scheme. The observed spin orientations of Sr3NiIrO6 and Sr2IrO4 are correctly predicted by DFT calculations, and are accounted for by the perturbation theory analysis. As for the spin orientation of Na2IrO3,more » both experimental studies and DFT calculations have not been unequivocal. Our analysis reveals that the Ir4+ spin orientation of Na2IrO3 should have nonzero components along the c- and a-axes directions. The spin orientations determined by DFT calculations are sensitive to the accuracy of the crystal structures employed, which is explained by perturbation theory analyses when interactions between adjacent Ir4+ ions are taken into consideration. There are indications implying that the 5d electrons of Na2IrO3 are less strongly localized compared with those of Sr3NiIrO6 and Sr2IrO4. This implication was confirmed by showing that the Madelung potentials of the Ir4+ ions are less negative in Na2IrO3 than in Sr3NiIrO6, Sr2IrO4. Most transition-metal S = 1/2 ions do have magnetic anisotropies because the SOC induces interactions among their crystal-field split d-states, and the associated mixing of the states modifies only the orbital parts of the states. This finding cannot be mimicked by a spin Hamiltonian because this model Hamiltonian lacks the orbital degree of freedom, thereby leading to the spin-half syndrome. As a result, the spin-orbital entanglement for the 5d spin-half ions Ir4+ is not as strong as has been assumed lately.« less

  9. Final report for tank 241-AN-102, grab samples 2AN-95-1 through 2AN-95-6 and 102-AN-1 through 102-AN-4

    SciTech Connect (OSTI)

    Esch, R.A.

    1996-03-21

    Ten grab samples (2AN-95-1, 2, 3, 4A, 5A; 102-AN-1, 2, 3(A), 3(B), and 4) and one field blank (2AN-95-6) were taken from tank 241-AN-102. In support of the safety screening program, total organic carbon and cyanide were performed as secondary analyses because the differential scanning calorimetry results exceeded the notification limit. These were compared to safety screening limits at a confidence level of 95%. Waste compatibility analyses were performed on the 3 supernate samples and the field blank from the latest sampling event. Results presented in the 45 day and in this report show that the waste in Tank 241-AN-1D2 has energetics greater than 480 J/g (dry) and total organic carbon > 3 wt%; however, with a moisture content > 17 wt%, the tank may be considered ``conditionally`` safe in accordance with the Data Quality Objective to Support Resolution of the Organic Complexant Safety Issue.

  10. New hypodiphosphates of the alkali metals: Synthesis, crystal structure and vibrational spectra of the hypodiphosphates(IV) M{sub 2}[(H{sub 2}P{sub 2}O{sub 6})(H{sub 4}P{sub 2}O{sub 6})] (M=Rb and Cs)

    SciTech Connect (OSTI)

    Wu, Peng; Wiegand, Thomas; Eckert, Hellmut

    2012-10-15

    The new hypodiphosphates(IV) Rb{sub 2}[(H{sub 2}P{sub 2}O{sub 6})(H{sub 4}P{sub 2}O{sub 6})] (1) and Cs{sub 2}[(H{sub 2}P{sub 2}O{sub 6})(H{sub 4}P{sub 2}O{sub 6})] (2) were synthesized by soft chemistry reactions from aqueous solutions of hypophosphoric acid and the corresponding heavy alkali-metal carbonates. Their crystal structures were determined by single crystal X-ray diffraction. Both compounds crystallize isotypic in the triclinic space group P-1 with one formula unit in the unit cell. The structures are built up by discrete (H{sub 2}P{sub 2}O{sub 6}){sup 2-} and (H{sub 4}P{sub 2}O{sub 6}) units in staggered conformation for the P{sub 2}O{sub 6} skeleton and the corresponding alkali-metal cations. In the (H{sub 2}P{sub 2}O{sub 6}){sup 2-} ion the hydrogen atoms are in a 'trans-trans' conformation. O{center_dot}H-O hydrogen bonds between the (H{sub 2}P{sub 2}O{sub 6}){sup 2-} and (H{sub 4}P{sub 2}O{sub 6}) groups consolidate the structures into a three-dimensional network. The FT-Raman and {sup 31}P and {sup 1}H and MAS NMR spectra of the title compounds have been recorded and interpreted, especially with respect to their assignment to the (H{sub 2}P{sub 2}O{sub 6}){sup 2-} and (H{sub 4}P{sub 2}O{sub 6}) groups. Thermogravimetric data of 2 have been interpreted in terms of a thermal decomposition model. - Graphical Abstract: The layered compounds Rb{sub 2}[(H{sub 2}P{sub 2}O{sub 6})(H{sub 4}P{sub 2}O{sub 6})] and Cs{sub 2}[(H{sub 2}P{sub 2}O{sub 6})(H{sub 4}P{sub 2}O{sub 6})] have been synthesized and investigated. Both crystallize isotypic. The structures are built up by discrete (H{sub 2}P{sub 2}O{sub 6}){sup 2-} and (H{sub 4}P{sub 2}O{sub 6}) units and the corresponding alkali-metal cations. Highlights: Black-Right-Pointing-Pointer Synthesis and single-crystal structure of new alkali hypodiphosphates. Black-Right-Pointing-Pointer Structures are characterized by [(H{sub 2}P{sub 2}O{sub 6})(H{sub 4}P{sub 2}O{sub 6})]{sup 2-} units and M{sup +} cations. Black-Right-Pointing-Pointer (H{sub 2}P{sub 2}O{sub 6}){sup 2-} and (H{sub 4}P{sub 2}O{sub 6}) units are linked by short hydrogen bonds. Black-Right-Pointing-Pointer Both compounds are characterized by {sup 31}P MAS-NMR spectra.

  11. Balancing act: Evidence for a strong subdominant d-wave pairing channel in Ba0.6K0.4Fe2As2

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

    Böhm, T.; Kemper, A. F.; Moritz, B.; Kretzschmar, F.; Muschler, B.; Eiter, H. -M.; Hackl, R.; Devereaux, T. P.; Scalapino, D. J.; Wen, Hai -Hu

    2014-12-18

    We present detailed measurements of the temperature-dependent Raman spectra of optimally doped Ba0.6K0.4Fe2As2 and analyze the low-temperature spectra based on local-density-approximation band-structure calculations and the subsequent estimation of effective Raman vertices. Experimentally, a narrow, emergent mode appears in the B1g (dx2-y2) Raman spectra only below Tc, well into the superconducting state and at an energy below twice the energy gap on the electron Fermi-surface sheets. The Raman spectra can be reproduced quantitatively with estimates for the magnitude and momentum-space structure of an A1g (s-wave) pairing gap on different Fermi-surface sheets, as well as the identification of the emergent sharp featuremore » as a Bardasis-Schrieffer exciton. Formed as a Cooper-pair bound state in a subdominant dx2-y2 channel, the binding energy of the exciton relative to the gap edge shows that the coupling strength in the subdominant channel is as strong as 60% of that in the dominant s-wave channel. This result suggests that dx2-y2 may be the dominant pairing symmetry in Fe-based superconductors that lack central hole bands.« less

  12. table6.4_02.xls

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

    4 Consumption Ratios of Fuel, 2002; Level: National Data; Row: Employment Sizes within NAICS Codes; Column: Energy-Consumption Ratios; Unit: Varies. Consumption Consumption per Dollar Consumption per Dollar of Value RSE NAICS per Employee of Value Added of Shipments Row Code(a) Economic Characteristic(b) (million Btu) (thousand Btu) (thousand Btu) Factors Total United States RSE Column Factors: 1.1 1 1 311 - 339 ALL MANUFACTURING INDUSTRIES Employment Size Under 50 395.7 4.3 2.3 3.6 50-99 663.4

  13. Highly efficient visible-light-induced photocatalytic activity of Bi{sub 2}WO{sub 6}/BiVO{sub 4} heterojunction photocatalysts

    SciTech Connect (OSTI)

    Chaiwichian, Saranyoo; Inceesungvorn, Burapat; Wetchakun, Khatcharin; Phanichphant, Sukon; Kangwansupamonkon, Wiyong; Wetchakun, Natda

    2014-06-01

    Highlights: Bi{sub 2}WO{sub 6}/BiVO{sub 4} heterojunction photocatalysts were obtained using hydrothermal method. Physicochemical properties played a significant role on photocatalytic efficiency. Bi{sub 2}WO{sub 6}/BiVO{sub 4} heterogeneous structures were greatly enhanced for degradation of MB. A tentative mechanism of charge transfer process in MB degradation was proposed. - Abstract: The Bi{sub 2}WO{sub 6}/BiVO{sub 4} heterojunction photocatalysts were synthesized by hydrothermal method. Physical properties of the heterojunction photocatalyst samples were studied by X-ray diffraction (XRD), scanning electron microscopy (SEM) and transmission electron microscopy (TEM) techniques. The XRD results indicated that BiVO{sub 4} retain monoclinic and tetragonal structures, while Bi{sub 2}WO{sub 6} presented as orthorhombic structure. The Brunauer, Emmett and Teller (BET) adsorptiondesorption of nitrogen gas for specific surface area determination at the temperature of liquid nitrogen was performed on all samples. UVvis diffuse reflectance spectra (UVvis DRS) were used to identify the absorption range and band gap energy of the heterojunction photocatalysts. The photocatalytic performance of Bi{sub 2}WO{sub 6}/BiVO{sub 4} heterojunction photocatalysts was studied via the photodegradation of methylene blue (MB) under visible light irradiation. The results indicated that the heterojunction photocatalyst at 0.5:0.5 mole ratio of Bi{sub 2}WO{sub 6}:BiVO{sub 4} shows the highest photocatalytic activity.

  14. Itinerant ferromagnetism in the As 4p conduction band of Ba0.6K0.4Mn2As2 identified by x-ray magnetic circular dichroism

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

    Ueland, B. G.; Pandey, Abhishek; Lee, Y.; Sapkota, A.; Choi, Y.; Haskel, D.; Rosenberg, R. A.; Lang, J. C.; Harmon, B. N.; Johnston, D. C.; et al

    2015-05-27

    In this study, x-ray magnetic circular dichroism (XMCD) measurements on single-crystal and powder samples of Ba0.6K0.4Mn2As2 show that the ferromagnetism below TC ≈ 100 K arises in the As 4p conduction band. No XMCD signal is observed at the Mn x-ray absorption edges. Below TC, however, a clear XMCD signal is found at the As K edge which increases with decreasing temperature. The XMCD signal is absent in data taken with the beam directed parallel to the crystallographic c axis indicating that the orbital magnetic moment lies in the basal plane of the tetragonal lattice. These results show that themore » previously reported itinerant ferromagnetism is associated with the As 4p conduction band and that distinct local-moment antiferromagnetism and itinerant ferromagnetism with perpendicular easy axes coexist in this compound at low temperature.« less

  15. Magnetic domain structure and domain-wall energy in UFe{sub 8}Ni{sub 2}Si{sub 2} and UFe{sub 6}Ni{sub 4}Si{sub 2} intermetallic compounds

    SciTech Connect (OSTI)

    Wyslocki, J.J.; Suski, W.; Wochowski, K.

    1994-03-01

    Magnetic domain structures in the UFe{sub 8}Ni{sub 2}Si{sub 2} and UFe{sub 6}Ni{sub 4}Si{sub 2} compounds were studied using the powder pattern method. The domain structure observed is typical for uniaxial materials. The domain-wall energy density {gamma} was determined from the average surface domain width D{sub s} observed on surfaces perpendicular to the easy axis as equal to 16 erg/cm{sup 2} for UFe{sub 8}Ni{sub 2}Si{sub 2} and 10 erg/cm{sup 2} for UFe{sub 6}Ni{sub 4}Si{sub 2}. Moreover, the critical diameter for single domain particle D{sub c} was calculated for the studied compounds.

  16. Characterization of collision cascade damage in Ca{sub 2}La{sub 8}(SiO{sub 4}){sub 6}O{sub 2} by HRTEM

    SciTech Connect (OSTI)

    Weber, W.J.; Wang, L.M.

    1994-12-01

    Ca{sub 2}La{sub 8}(SiO{sub 4}){sub 6}O{sub 2} thin crystals become amorphous under ion beam irradiation. The ion dose required for complete amorphization of the thin crystal (critical amorphization dose, D{sub c}) increased with the increasing irradiation temperature and decreased with ion mass at elevated temperatures. Samples irradiated with 1-1.5 MeV Ar{sup +}, Kr{sup +} and Xe{sup +} ions to doses much lower than Dc, in the temperature range from 20 to 498 K were used for a detailed HRTEM study to better understand the amorphization process. The residual collision cascade damage after irradiation appeared as manometer scale amorphous domains. The images of these domains are extremely sensitive to the sample thickness. Small domains of cascade size were only found at the very thin edge of the sample. In thicker regions, amorphous domains appear after higher doses as the result of cascade overlap in projection. At higher temperatures, the observed amorphous domains are smaller indicating thermal recovery at the amorphous/crystalline interface. The amorphous domains are also larger in size after irradiation with ions of higher mass at a fixed ion dose. These results are consistent with the Dc-temperature curves determined by in situ TEM with the HVEM-Tandem Facility at Argonne National Laboratory. The width of the amorphous rim along the edge of the specimen grew with increasing ion dose suggesting that amorphization also proceeds from the sample surface. Images of the collision cascade damage were compared to the cascade sizes calculated with the TRIM code. Some digitally acquired HRTEM images of the cascade damage were processed to reveal more detailed information.

  17. Beamline 6.1.2

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

    Beamline 6.1.2 Beamline 6.1.2 Print Tuesday, 20 October 2009 08:41 Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics,...

  18. Crystal structure of bis(isothiocyanato)[2,6-diacetylpyridine bis(4-hydroxybenzoylhydrazone)]Fe(III) Chloride bis(dimethylformamide) solvate

    SciTech Connect (OSTI)

    Dilek, N.; Guenes, B.; Bueyuekguengoer, O.; Guep, R.

    2013-01-15

    The crystal structure of title compound (Fe[(C{sub 25}H{sub 21}N{sub 7}O{sub 4}S{sub 2})] {center_dot} 4(C{sub 3}NOH{sub 7}), where C{sub 3}NOH{sub 7} is dimethylformamide, DMF) was determined by the X-ray diffraction method. This compound crystallizes in the monoclinic C2/c space group, Z = 4. Unit cell parameters are: a = 13.6080(5), b = 17.6375(7), c = 19.5571(6) A, {beta} = 108.753(2) Degree-Sign . The N-H...O and O-H...O interactions stabilize the molecules in the lattice. The structure contains also the solvent dimethylformamide molecules, which are connected with intermoleculer hydrogen bond. The O atoms of DMF molecules take place as acceptor atoms.

  19. Beamline 4.2.2

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

    Beamline 4.2.2 Beamline 4.2.2 Print Tuesday, 20 October 2009 08:31 Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography...

  20. Data:05d6c74a-9073-4ad2-8045-cd52082ca0a4 | Open Energy Information

    Open Energy Info (EERE)

    under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic Information 2. Demand 3. Energy << Previous 1 2 3 Next >> Basic Information...

  1. PARC Periodical | Vol. 6, Issue 4 | Photosynthetic Antenna Research Center

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

    PARC Periodical | Vol. 6, Issue 4 April 6, 2015 PARC Periodical | Vol. 6, Issue 4 VIEW PERIODICAL HERE

  2. TableHC2.6.xls

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

    Coolling Equipment................................ 93.3 61.2 6.1 6.3 13.9 5.8 Use Cooling Equipment................................... 91.4 60.3 6.0 6.1 13.5 5.5 Have Equipment But Do Not Use it................. 1.9 1.0 Q 0.2 0.4 Q Air-Conditioning Equipment 1, 2 Central System............................................... 65.9 47.5 4.0 2.8 7.9 3.7 Without a Heat Pump.................................. 53.5 37.8 3.4 2.2 7.0 3.1 With a Heat Pump....................................... 12.3 9.7 0.6

  3. Beamline 4.2.2

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

    4.2.2 Print Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography (MX) Scientific discipline: Structural biology GENERAL...

  4. [H{sub 2}en]{sub 2}{l_brace}La{sub 2}M(SO{sub 4}){sub 6}(H{sub 2}O){sub 2}{r_brace} (M=Co, Ni): First organically templated 3d-4f mixed metal sulfates

    SciTech Connect (OSTI)

    Yuan Yanping; Wang Ruiyao; Kong Deyuan; Mao Jianggao . E-mail: mjg@ms.fjirsm.ac.cn; Clearfield, Abraham

    2005-06-15

    The first organically templated 3d-4f mixed metal sulfates, [H{sub 2}en]{sub 2}{l_brace}La{sub 2}M(SO{sub 4}){sub 6}(H{sub 2}O){sub 2}{r_brace} (M=Co 1, Ni 2) have been synthesized and structurally determined from non-merohedrally twinned crystals. The two compounds are isostructural and their structures feature a three-dimensional anionic network formed by the lanthanum(III) and nickel(II) ions bridged by sulfate anions. The La(III) ions in both compounds are 10-coordinated by four sulfate anions in bidentate chelating fashion, and two sulfate anions in a unidentate fashion. The transition metal(II) ion is octahedrally coordinated by six oxygens from four sulfate anions and two aqua ligands. The doubly protonated enthylenediamine cations are located at the tunnels formed by 8-membered rings (four La and four sulfate anions)

  5. Negative to positive magnetoresistance and magnetocaloric effect in Pr0.6Er0.4Al2

    SciTech Connect (OSTI)

    Pathak, Arjun K.; Gschneidner, Jr., K. A.; Pecharsky, V. K.

    2014-10-13

    We report on the magnetic, magnetocaloric and magnetotransport properties of Pr0.6Er0.4Al2. The title compound exhibits a large positive magnetoresistance (MR) for H ≥ 40 kOe and a small but non negligible negative MR for H ≤ 30 kOe. The maximum positive MR reaches 13% at H = 80 kOe. The magnetic entropy and adiabatic temperature changes as functions of temperature each show two anomalies: a broad dome-like maximum below 20 K and a relatively sharp peak at higher temperature. As a result, observed behaviors are unique among other binary and mixed lanthanide compounds.

  6. Magnetic properties of Ni40+xMn39-xSn21 (x=0, 2, 4, 6 and 8 at.%) Heusler alloys

    SciTech Connect (OSTI)

    Lazpita, P.; Lograsso, T.; Schlagel, D. L.

    2014-01-27

    The low electron concentration region (e/a < 7.75) of the magnetic phase diagram of the off-stoichiometric NiMnSn Heusler alloys was investigated in detail by DSC and magnetization measurements of the Ni40+xMn39?xSn21(x = 0, 2, 4, 6 and 8 at.%) alloys. The alloys show a stable austenitic phase without any martensitic transformation down to 5 K even after heat treatment. The Curie temperature exhibits a broad maximum over a large composition range. The evolution of the magnetic moment with the electron concentration fits the data of previous studies and confirms the peak-like dependence in the extended range of e/a values predicted by ab initio calculations. The explored part of the moment versus e/a curve can be explained in terms of a localized magnetic moment model and full atomic order in the alloys.

  7. Photoimaging of the multiple filamentation of femtosecond laser pulses in poly(methyl methacrylate) doped with 2,2-difluoro-4-(9-anthracyl)-6-methyl-1,3,2-dioxaborine

    SciTech Connect (OSTI)

    Kulchin, Yu N; Vitrik, O B; Chekhlenok, A A; Zhizhchenko, A Yu; Proschenko, D Yu; Mirochnik, A G; Lyu Guohui

    2013-12-31

    We have studied the filamentation of femtosecond laser pulses (? = 800 nm, ?42 fs pulse duration) in poly(methyl methacrylate) doped with 2,2-difluoro-4-(9-anthracyl)-6-methyl-1,3,2- dioxaborine and the associated photomodification of the material. The results demonstrate that multiple filamentation occurs at pulse energies above 5 ?J. At a pulse energy of 1.5 mJ, it is accompanied by supercontinuum generation. The average filament length in PMMA is 9 mm and the filament diameter is ?10 ?m. An incident power density of ?10{sup 12} W cm{sup -2} ensures inscription of the filament pattern owing to two-photon photochemical processes. Preliminary exposure to continuous light at ? = 400 nm enables an ordered filament pattern to be written. (interaction of laser radiation with matter)

  8. TtP-3 Tt-4 Tt-2 Tt-3 Tt-1 Tt-5 Tt-6 TtP-5 TtP-1 TtP-2 Tt-7 TtP-9

    Office of Legacy Management (LM)

    TtP-3 Tt-4 Tt-2 Tt-3 Tt-1 Tt-5 Tt-6 TtP-5 TtP-1 TtP-2 Tt-7 TtP-9 TtP-6 TtP-7 TtP-8 TtP-4 OLF-CM20 OLF-CM17 OLF-CM15 OLF-CM15 OLF-CM14 OLF-CM13 OLF-CM12 OLF-CM11 OLF-CM10 OLF-CM9 OLF-CM8 OLF-CM7 OLF-CM6 OLF-CM5 OLF-CM4 OLF-CM1 NORTH March 2014 Figure 1 Plan View of OLF Site Project No. 181750 DITCH/CHANNEL/CREEK L E G E N D : SLUMP OR SUBSIDENCE LINE AND DIRECTION ROAD TEST PIT LOCATION TEST BORING AND INCLINOMETER LOCATION SETTLEMENT MONUMENT (EXISTING) APPROXIMATE LIMITS OF GEOTECHNICAL

  9. Beamline 6.1.2

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

    Beamline 6.1.2 Beamline 6.1.2 Print Tuesday, 20 October 2009 08:41 Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE)

  10. Electron motion in the gases CF/sub 4/, C/sub 2/F/sub 6/, C/sub 3/F/sub 8/, and n-C/sub 4/F/sub 10/

    SciTech Connect (OSTI)

    Hunter, S.R.; Carter, J.G.; Christophorou, L.G.

    1988-07-01

    The drift velocity w of electrons has been measured in the perfluoroalkanes n-C/sub N/F/sub 2//sub N//sub +2/ (N = 1--4) over the density-reduced electric field (E/N) range 0.03 x 10/sup -17/ V cm/sup 2/less than or equal toE/Nless than or equal to500 x 10/sup -17/ V cm/sup 2/ using a pulsed Townsend experimental method. The present measurements of w are the first to be obtained for C/sub 2/F/sub 6/, C/sub 3/F/sub 8/, and n-C/sub 4/F/sub 10/ at low E/N values. The electron-drift-velocity measurements in C/sub 3/F/sub 8/ and n-C/sub 4/F/sub 10/ are dependent on gas pressure at high E/N values, even after allowing for nonequilibrium and boundary corrections to the measured electron swarm transit time. This is the first observation of a pressure dependence in the electron drift velocity in these gases and is believed to be due to changes in the electron energy distribution function f(epsilon-c,E/N) with gas pressure resulting from increases in the density-normalized electron attachment coefficient eta/N with gas pressure. The perfluoroalkanes CF/sub 4/, C/sub 2/F/sub 6/, and C/sub 3/F/sub 8/ exhibit regions of pronounced negative differential conductivity (NDC) similar to but smaller in magnitude than that in CH/sub 4/. Possible mechanisms leading to the observation of NDC effects in these molecular gases are discussed.

  11. Categorical Exclusion Determinations: B6.4 | Department of Energy

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

    4 Categorical Exclusion Determinations: B6.4 Existing Regulations B6.4: Facilities for ... Previous Regulations Categorical Exclusion Determinations dated before November 14th, 2011 ...

  12. Table 6.2 Consumption Ratios of Fuel, 2002

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

    "Value of Shipments and Receipts" "(million dollars)" " Under 20",281,3.9,2.2,3 " 20-49",583.7,6.1,3,4.6 " 50-99",889.2,8.1,3.8,4.9 " 100-249",1268.8,8.7,4.1,4.6 " ...

  13. Data:9436a490-e0ac-4ae2-b5e0-9ed6196f7cd6 | Open Energy Information

    Open Energy Info (EERE)

    ed6196f7cd6 No revision has been approved for this page. It is currently under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic Information 2....

  14. Utility of four strains of white-rot fungi for the detoxification of 2,4,6-trinitrotoluene in liquid culture

    SciTech Connect (OSTI)

    Donnelly, K.C.; Chen, J.C.; Huebner, H.J.; Brown, K.W.; Autenrieth, R.L.; Bonner, J.S.

    1997-06-01

    The purpose of this study was to investigate the potential of four different strains of white-rot fungi (Phanerochaete chrysosporium, Phanerochaete sordida, Phlebia brevispora, and Cyathus stercoreus) to degrade 2,4,6-trinitrotoluene (TNT) in liquid medium. Loss of TNT from the culture medium was determined using high-performance liquid chromatography (HPLC), while the mutagenicity of the medium residues were evaluated using the Salmonella/microsome bioassay. The data indicate that within 21 d of incubation, all fungi were able to reduce the TNT concentration in the liquid medium to below detection limits. In this study, P. sordida showed a relatively high growth rate and the fastest rate of TNT degradation. The fungal treatment also produced a significant reduction of TNT mutagenicity. Treatment with C. stercoreus, P. brevispora, P. sordida, and P. chrysosporium resulted in the elimination of 94%, 90%, 87%, and 67% of the initial TNT-amended medium mutagenicity, respectively. The data also demonstrate that during incubation, TNT was eliminated from the culture medium two to eight times faster than the reduction in mutagenic potential. These results suggest that TNT disappearance alone cannot be used as the sole criterion in TNT remediation. Chemical analysis revealed that the major metabolites in the initial transformation of TNT were the monoamino-dinitrotoluenes, which were also degraded by the selected white-rot fungi. The study demonstrated that the white-rot fungi are capable of metabolizing and detoxifying TNT under aerobic conditions in nonligninolytic liquid medium.

  15. Beamline 6.0.2

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

    0.2 Beamline 6.0.2 Print Tuesday, 20 October 2009 08:40 Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond

  16. Beamline 6.1.2

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

    Beamline 6.1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  17. Beamline 6.1.2

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

    Beamline 6.1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  18. Beamline 6.1.2

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

    Beamline 6.1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  19. Beamline 6.1.2

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

    Beamline 6.1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  20. Beamline 6.3.2

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

    6.3.2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300

  1. Beamline 6.3.2

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

    6.3.2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300

  2. Beamline 6.3.2

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

    6.3.2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300

  3. Beamline 6.3.2

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

    6.3.2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300

  4. Beamline 4.2.2

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

    4.2.2 Print Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography (MX) Scientific discipline: Structural biology GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Superbend Energy range 5,500-16,000eV Monochromator Rosenbaum-Rock Si(111) sagitally focused monochromator Calculated flux (1.9 GeV, 400 mA) 2.5 x 1011 photons/s at 12 keV Resolving power (E/ΔE) 7,000 with Si(111) crystals Endstations Minihutch Detectors

  5. Beamline 4.2.2

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

    4.2.2 Print Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography (MX) Scientific discipline: Structural biology GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Superbend Energy range 5,500-16,000eV Monochromator Rosenbaum-Rock Si(111) sagitally focused monochromator Calculated flux (1.9 GeV, 400 mA) 2.5 x 1011 photons/s at 12 keV Resolving power (E/ΔE) 7,000 with Si(111) crystals Endstations Minihutch Detectors

  6. Beamline 4.2.2

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

    4.2.2 Print Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography (MX) Scientific discipline: Structural biology GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Superbend Energy range 5,500-16,000eV Monochromator Rosenbaum-Rock Si(111) sagitally focused monochromator Calculated flux (1.9 GeV, 400 mA) 2.5 x 1011 photons/s at 12 keV Resolving power (E/ΔE) 7,000 with Si(111) crystals Endstations Minihutch Detectors

  7. Beamline 4.2.2

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

    4.2.2 Print Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography (MX) Scientific discipline: Structural biology GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Superbend Energy range 5,500-16,000eV Monochromator Rosenbaum-Rock Si(111) sagitally focused monochromator Calculated flux (1.9 GeV, 400 mA) 2.5 x 1011 photons/s at 12 keV Resolving power (E/ΔE) 7,000 with Si(111) crystals Endstations Minihutch Detectors

  8. Beamline 4.2.2

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

    4.2.2 Print Molecular Biology Consortium Multiple-Wavelength Anomalous Diffraction (MAD) and Macromolecular Crystallography (MX) Scientific discipline: Structural biology GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Superbend Energy range 5,500-16,000eV Monochromator Rosenbaum-Rock Si(111) sagitally focused monochromator Calculated flux (1.9 GeV, 400 mA) 2.5 x 1011 photons/s at 12 keV Resolving power (E/ΔE) 7,000 with Si(111) crystals Endstations Minihutch Detectors

  9. Beamline 6.0.2

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

    6.0.2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond

  10. Beamline 6.0.2

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

    Beamline 6.0.2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in

  11. Beamline 6.0.2

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

    Beamline 6.0.2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in

  12. NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} core/shell nanocomposite: A highly efficient visible-light-driven photocatalyst utilizing upconversion

    SciTech Connect (OSTI)

    Sun, Yuanyuan; Wang, Wenzhong Sun, Songmei; Zhang, Ling

    2014-04-01

    Highlights: Design and synthesis of NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} based on upconversion. NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} nanocomposite was prepared for the first time. Coreshell structure benefits the properties. Upconversion contributed to the enhanced photocatalytic activity. Helps to understand the functionality of new type photocatalysts. - Abstract: NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} core/shell nanocomposite was designed and prepared for the first time based on upconversion. The products were characterized by X-ray diffraction (XRD), transmission electron microscopy (TEM), high resolution TEM (HRTEM), energy dispersive X-ray spectroscopy (EDS) and diffuse reflectance spectra (DRS). The results revealed that the as-synthesized NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} consisted of spheres with a core diameter of about 26 nm and a shell diameter of around 6 nm. The core was upconversion illuminant NaYF{sub 4}:Er,Yb and the shell was Bi{sub 2}MoO{sub 6} around the core, which was confirmed by EDS. The NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} exhibited higher photocatalytic activity for the photodecomposition of Rhodamine B (RhB) under the irradiation of Xe lamp and green light emitting diode (g-LED). The mechanism of the high photocatalytic activity was discussed by photoluminescence spectra (PL), which is mainly attributed to upconversion of NaYF{sub 4}:Er,Yb in the NaYF{sub 4}:Er,Yb/Bi{sub 2}MoO{sub 6} nanocomposite and the coreshell structure.

  13. Comparative study on 2,2′,4,5,5′-pentachlorobiphenyl-mediated decrease in serum thyroxine level between C57BL/6 and its transthyretin-deficient mice

    SciTech Connect (OSTI)

    Kato, Yoshihisa; Tamaki, Sekihiro; Haraguchi, Koichi; Ikushiro, Shin-ichi; Sekimoto, Masashi; Ohta, Chiho; Endo, Tetsuya; Koga, Nobuyuki; Yamada, Shizuo; Degawa, Masakuni

    2012-09-15

    The relationships between the changes in the levels of serum total thyroxine (T{sub 4}), serum T{sub 4}-transthyretin (TTR) complex, and accumulation of T{sub 4} in tissues by 2,2′,4,5,5′-pentachlorobiphenyl (PentaCB) were examined using wild-type C57BL/6 (WT) and its TTR-deficient (TTR-null) mice. The constitutive level of serum total T{sub 4} was much higher in WT mice than in TTR-null mice. In WT mice 4 days after a single intraperitoneal injection with PentaCB (112 mg/kg), serum total T{sub 4} level was significantly decreased along with a decrease in serum T{sub 4}–TTR complex, and the levels of serum total T{sub 4} in the PentaCB-treated WT mice were almost the same to those in PentaCB-untreated (control) TTR-null mice. In addition, a slight decrease in serum total T{sub 4} by PentaCB treatment was observed in TTR-null mice. Furthermore, clearance of [{sup 125}I]T{sub 4} from the serum after [{sup 125}I]T{sub 4}-administration was promoted by the PentaCB-pretreatment in either strain of mice, especially WT mice. On the other hand, accumulation level of [{sup 125}I]T{sub 4} in the liver, but not in extrahepatic tissues, was strikingly enhanced in the PentaCB-pretreated WT and TTR-null mice. Furthermore, in both strains of mice, PentaCB-pretreatment led to significant increases in the steady-state distribution volume of [{sup 125}I]T{sub 4} and the concentration ratio of the liver to serum. The present findings demonstrate that PentaCB-mediated decrease in serum T{sub 4} level occurs mainly through increase in accumulation level of T{sub 4} in the liver and further indicate that the increased accumulation of T{sub 4} in the liver of WT mice is primarily dependent on the PentaCB-mediated inhibition of serum T{sub 4}–TTR complex formation.

  14. A novel inorganic-organic compound: Synthesis and structural characterization of tin(II) phenylbis(phosphonate), Sn{sub 2}(PO{sub 3}C{sub 6}H{sub 4}PO{sub 3})

    SciTech Connect (OSTI)

    Subbiah, Ayyappan; Bhuvanesh, Nattamai; Clearfield, Abraham . E-mail: clearfield@mail.chem.tamu.edu

    2005-04-15

    A novel tin(II) phenylbis(phosphonate) compound has been synthesized hydrothermally and its structure has been determined by single crystal X-ray diffraction. The structure is monoclinic, space group P2{sub 1}/c (no. 14), a=4.8094(4), b=16.2871(13), c=6.9107(6)A; {beta}=106.292(6){sup o}, V=519.59(7)A{sup 3}, Z=2. The three-dimensional structure consists of 3-coordinated tin and 4-coordinated phosphorus double layers separated (pillared) by phenyl rings. These phenyl rings are placed 4.8A apart along the a-axis in the structure resulting in lower surface area ({approx}14m{sup 2}/g). The porosity has been increased by replacing phenyl groups by methyl groups ({approx}31m{sup 2}/g)

  15. Structural characterization and AC conductivity of bis tetrapropylammonium hexachlorado-dicadmate, [N(C{sub 3}H{sub 7}){sub 4}]{sub 2}Cd{sub 2}Cl{sub 6}

    SciTech Connect (OSTI)

    Hannachi, N.; Guidara, K.; Bulou, A.; Hlel, F.

    2010-11-15

    Synthesis, crystal structure, vibrational study, {sup 13}C, {sup 111}Cd CP-MAS-NMR analysis and electrical properties of the compound [N(C{sub 3}H{sub 7}){sub 4}]{sub 2}Cd{sub 2}Cl{sub 6}, are reported. The latter crystallizes in the triclinic system (space group P1-bar, Z = 2) with the following unit cell dimensions: a = 9.530(1) A, b = 11.744(1) A, c = 17.433(1) A, {alpha} = 79.31(1){sup o}, {beta} = 84.00(1){sup o} and {gamma} = 80.32(1){sup o}. Besides, its structure was solved using 6445 independent reflections down to R = 0.037. The atomic arrangement can be described by alternating organic and inorganic layers parallel to the (11-bar 0) plan, made up of tetrapropylammonium groups and Cd{sub 2}Cl{sub 6} dimers, respectively. In crystal structure, the inorganic layer, built up by Cd{sub 2}Cl{sub 6} dimers, is connected to the organic ones through van der Waals interaction in order to build cation-anion-cation cohesion. Impedance spectroscopy study, reported in the sample, reveals that the conduction in the material is due to a hopping process. The temperature and frequency dependence of dielectric constants of the single crystal sample has been investigated to determine some related parameters to the dielectric relaxation.

  16. Synthesis and structural characterization of Al{sub 4}SiC{sub 4}-homeotypic aluminum silicon oxycarbide, [Al{sub 4.4}Si{sub 0.6}][O{sub 1.0}C{sub 2.0}]C

    SciTech Connect (OSTI)

    Kaga, Motoaki; Iwata, Tomoyuki [Department of Environmental and Materials Engineering, Nagoya Institute of Technology, Nagoya 466-8555 (Japan); Nakano, Hiromi [Cooperative Research Facility Center, Toyohashi University of Technology, Toyohashi 441-8580 (Japan); Fukuda, Koichiro, E-mail: fukuda.koichiro@nitech.ac.j [Department of Environmental and Materials Engineering, Nagoya Institute of Technology, Nagoya 466-8555 (Japan)

    2010-03-15

    A new quaternary layered oxycarbide, [Al{sub 4.39(5)}Si{sub 0.61(5)}]{sub S}IGMA{sub 5}[O{sub 1.00(2)}C{sub 2.00(2)}]{sub S}IGMA{sub 3}C, has been synthesized and characterized by X-ray powder diffraction, transmission electron microscopy and energy dispersive X-ray spectroscopy (EDX). The title compound was found to be hexagonal with space group P6{sub 3}/mmc, Z=2, and unit-cell dimensions a=0.32783(1) nm, c=2.16674(7) nm and V=0.20167(1) nm{sup 3}. The atom ratios Al:Si were determined by EDX, and the initial structural model was derived by the direct methods. The final structural model showed the positional disordering of one of the three types of Al/Si sites. The maximum-entropy methods-based pattern fitting (MPF) method was used to confirm the validity of the split-atom model, in which conventional structure bias caused by assuming intensity partitioning was minimized. The reliability indices calculated from the MPF were R{sub wp}=3.73% (S=1.20), R{sub p}=2.94%, R{sub B}=1.04% and R{sub F}=0.81%. The crystal was an inversion twin. Each twin-related individual was isostructural with Al{sub 4}SiC{sub 4} (space group P6{sub 3}mc, Z=2). - Graphical abstract: A new oxycarbide discovered in the Al-Si-O-C system, Al{sub 4}SiC{sub 4}-homeotypic [Al{sub 4.4}Si{sub 0.6}][O{sub 1.0}C{sub 2.0}]C. The crystal is an inversion twin, and hence the structure is represented by a split-atom model. The three-dimensional electron density distributions are determined by the maximum-entropy methods-based pattern fitting, being consistent with the disordered structural model.

  17. Second order phase transition temperature of single crystals of Gd5Si1.3Ge2.7 and Gd5Si1.4Ge2.6

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

    Hadimani, R. L.; Melikhov, Y.; Schlagel, D. L.; Lograsso, T. A.; Dennis, K. W.; McCallum, R. W.; Jiles, D. C.

    2015-01-30

    Gd5(SixGe1–x)4 has mixed phases in the composition range 0.32 < x < 0.41, which have not been widely studied. In this paper, we have synthesized and indexed single crystal samples of Gd5Si1.3Ge2.7 and Gd5Si1.4Ge2.6. In this study, we have investigated the first order and second order phase transition temperatures of these samples using magnetic moment vs. temperature and magnetic moment vs. magnetic field at different temperatures. We have used a modified Arrott plot technique that was developed and reported by us previously to determine the “hidden” second order phase transition temperature of the orthorhombic II phase.

  18. Synthesis and structural and magnetic characterization of the frustrated magnetic system La{sub 2}Ni{sub 4/3?x}Co{sub x}Sb{sub 2/3}O{sub 6}

    SciTech Connect (OSTI)

    Franco, D.G.; Carbonio, R.E.; Nieva, G.

    2013-11-15

    We report the synthesis of double perovskites La{sub 2}Ni{sub 4/3?x}Co{sub x}Sb{sub 2/3}O{sub 6} with x=0, 1/3, 2/3 and 1 by a solid state method. Rietveld refinements of X-ray and neutron powder diffraction data show that all samples crystallize in space group P2{sub 1}/n, with almost perfect occupation of the 2d octahedral site with the transition metals, while all Sb{sup 5+} are randomly distributed in a 2c octahedral site. The saturation magnetization in hysteresis loops indicates that the samples are ferrimagnetic throughout all the series. Virgin magnetization curves lie outside hysteresis loops at low temperatures and thermal evolution of H{sub m} defined as the inflection point of these curves follows the de AlmeidaThouless dependence for x?0. This spin glass like behavior below 30 K is also supported by thermal evolution of the coercivity, which follows an exponential law typical of magnetic clusters, not found in the pure Ni{sup 2+} perovskite, x=0 extreme. - Graphical abstract: Display Omitted - Author-Highlights: We synthesized new double perovskites: La{sub 2}Ni{sub 4/3?x}Co{sub x}SbO{sub 6} (x=1/3, 2/3, 1). The cations occupying octahedral sites are highly ordered in all samples. Magnetic transition occurs as a consequence of superexchange paths. Frustration is found and attributed to competition between different interactions.

  19. DWPF SB6 INITIAL CPC FLOWSHEET TESTING SB6-1 TO SB6-4L TESTS OF SB6-A AND SB6-B SIMULANTS

    SciTech Connect (OSTI)

    Lambert, D.; Pickenheim, B.; Best, D.

    2009-09-09

    The Defense Waste Processing Facility (DWPF) will transition from Sludge Batch 5 (SB5) processing to Sludge Batch 6 (SB6) processing in late fiscal year 2010. Tests were conducted using non-radioactive simulants of the expected SB6 composition to determine the impact of varying the acid stoichiometry during the Sludge Receipt and Adjustment Tank (SRAT) and Slurry Mix Evaporator (SME) processes. The work was conducted to meet the Technical Task Request (TTR) HLW/DWPF/TTR-2008-0043, Rev.0 and followed the guidelines of a Task Technical and Quality Assurance Plan (TT&QAP). The flowsheet studies are performed to evaluate the potential chemical processing issues, hydrogen generation rates, and process slurry rheological properties as a function of acid stoichiometry. These studies were conducted with the estimated SB6 composition at the time of the study. This composition assumed a blend of 101,085 kg of Tank 4 insoluble solids and 179,000 kg of Tank 12 insoluble solids. The current plans are to subject Tank 12 sludge to aluminum dissolution. Liquid Waste Operations assumed that 75% of the aluminum would be dissolved during this process. After dissolution and blending of Tank 4 sludge slurry, plans included washing the contents of Tank 51 to {approx}1M Na. After the completion of washing, the plan assumes that 40 inches on Tank 40 slurry would remain for blending with the qualified SB6 material. There are several parameters that are noteworthy concerning SB6 sludge: (1) This is the second batch DWPF will be processing that contains sludge that has had a significant fraction of aluminum removed through aluminum dissolution; (2) The sludge is high in mercury, but the projected concentration is lower than SB5; (3) The sludge is high in noble metals, but the projected concentrations are lower than SB5; and(4) The sludge is high in U and Pu - components that are not added in sludge simulants. Six DWPF process simulations were completed in 4-L laboratory-scale equipment using two projections of the SB6 blend simulant composition (Tank 40 simulant after Tank 51 transfer is complete). The more washed simulant (SB6-A) had a set of four SRAT and SME simulations at varying acid stoichiometry levels (90%, 100%, 120% and 150%) using the Koopman Acid Prediction Calculation. Two additional SRAT simulations were made using SB6-B blend simulant at 100% and 120% of acid stoichiometry. SME cycles were noted performed for the SB6B simulants to allow the SRAT products to be used for melt rate testing.

  20. Buildings Energy Data Book: 2.6 Residential Home Improvement

    Buildings Energy Data Book [EERE]

    Total 1980 72.2 35.2 107.4 1985 82.3 65.3 147.6 1990 91.4 85.5 176.9 1995 105.8 63.8 169.6 2000 138.2 52.7 191.0 2003 156.2 51.9 208.0 2004 169.2 57.9 227.1 2005 179.0 59.7 238.6 ...

  1. LCLS-scheduling-run_6_Ver4.xlsx

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

    1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 Tue Wed Thu Fri Sat Sun Mon Tue Wed Thu Fri Sat Sun Mon Tue Wed Thu Fri Sat Sun Mon Tue Wed Thu Fri Sat Sun Mon Tue Wed Thu Day IH L431 Frank Com HR CXI inhouse L456 Krasniqi L481/ L481/ Com. IH MEC L525 Night Feng RD Timing L481/494 Com L481/494 L406 Berrah L434 Fuchs June 12 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 Fri Sat Sun Mon Tue Wed Thu Fri Sat Sun Mon Tue Wed Thu

  2. Integrated Dry NO{sub x}/SO{sub 2} Emissions Control System baseline SNCR test report, February 4--March 6, 1992

    SciTech Connect (OSTI)

    Smith, R.A.; Shiomoto, G.H.; Muzio, L.J.; Hunt, T.

    1993-09-01

    The DOE sponsored Integrated Dry NO{sub x}SO{sub 2} Emissions Control System program, which is a Clean Coal Technology III demonstration, is being conducted by Public Service Company of Colorado. The test site is Arapahoe Generating Station Unit 4, which is a 100 MWe, down-fired utility boiler burning a low sulfur western coal. The project goal is to demonstrate 70 percent reductions in NO{sub x} and SO{sub 2} emissions through the integration of: (1) down-fired low-NO{sub x} burners with overfire air; (2) selective Non-Catalytic Reduction (SNCR) for additional NO{sub x} removal; and (3) dry sorbent injection and duct humidification for SO{sub 2} removal. The effectiveness of the integrated system on a high-sulfur coal will also be tested. This report documents the second test phase of the program. This second test phase was comprised of the start up of the SNCR system followed by a brief parametric test series. Time constraints due to the retrofit schedule precluded optimizing the SNCR system. Testing investigated both urea and aqueous ammonia as SNCR chemicals. Other parameters investigated included boiler load, the amount of chemical injected, as well as injection parameters (injection location, amount of mixing air, dilution water flow, and injector orifice sizes). NO{sub x} removals of nominally 35 percent could be obtained with both chemicals while maintaining ammonia slip levels less than 10 ppM at full load. At higher chemical injection rates (nominal N/NO molar ratios of 1.5 to 2.0), NO{sub x} reductions in the range of 60 to 70 percent were achieved, but with unacceptable levels of NH{sub 3} slip. For a given level of NO{sub x} reduction, ammonia slip was lower with aqueous ammonia injection than with urea. The test program also confirmed prior observations that (1) the optimum temperature for NO{sub x} reduction with ammonia is lower than with urea, and (2) N{sub 2}O emissions as a by-product of the SNCR process are lower for ammonia compared to urea.

  3. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV...

  4. Tax Deduction Qualified Software: TRACE Version 6.3.2

    Broader source: Energy.gov [DOE]

    Provides required documentation that the TRACE version 6.3.2 meets Internal Revenue Code §179D (c)(1) and (d) Regulations Notice 2006-52, Section 6 requirements as amplified by Notice 2008-40, Section 4 requirements.

  5. Final analysis of proton form factor ratio data at Q2 = 4.0, 4.8, and 5.6 GeV2

    SciTech Connect (OSTI)

    Puckett, A. J. R.; Brash, E. J.; Gayou, O.; Jones, M. K.; Pentchev, L.; Perdrisat, C. F.; Punjabi, V.; Aniol, K. A.; Averett, T.; Benmokhtar, F.; Bertozzi, W.; Bimbot, L.; Calarco, J. R.; Cavata, C.; Chai, Z.; Chang, C. -C.; Chang, T.; Chen, J. P.; Chudakov, E.; De Leo, R.; Dieterich, S.; Endres, R.; Epstein, M. B.; Escoffier, S.; Fissum, K. G.; Fonvieille, H.; Frullani, S.; Gao, J.; Garibaldi, F.; Gilad, S.; Gilman, R.; Glamazdin, A.; Glashausser, C.; Gomez, J.; Hansen, J. -O.; Higinbotham, D.; Huber, G. M.; Iodice, M.; de Jager, C. W.; Jiang, X.; Khandaker, M.; Kozlov, S.; Kramer, K. M.; Kumbartzki, G.; LeRose, J. J.; Lhuillier, D.; Lindgren, R. A.; Liyanage, N.; Lolos, G. J.; Margaziotis, D. J.; Marie, F.; Markowitz, P.; McCormick, K.; Michaels, R.; Milbrath, B. D.; Nanda, S. K.; Neyret, D.; Piskunov, N. M.; Ransome, R. D.; Raue, B. A.; Roch, R.; Rvachev, M.; Salgado, C.; Sirca, S.; Sitnik, I.; Strauch, S.; Todor, L.; Tomasi-Gustafsson, E.; Urciuoli, G. M.; Voskanyan, H.; Wijesooriya, K.; Wojtsekhowski, B. B.; Zheng, X.; Zhu, L.

    2012-04-11

    Recently published measurements of the proton electromagnetic form factor ratio R = ?p GEp/GMp at momentum transfers Q2 up to 8.5 GeV2 in Jefferson Lab Hall C deviate from the linear trend of previous measurements in Jefferson Lab Hall A, favoring a slower rate of decrease of R with Q2. While statistically compatible in the region of overlap with Hall A, the Hall C data hint at a systematic difference between the two experiments. This possibility was investigated in a reanalysis of the Hall A data. We find that the original analysis underestimated the background in the selection of elastic events. The application of an additional cut to further suppress the background increases the results for R, improving the consistency between Halls A and C.

  6. Beamline 6.1.2

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

    1000 x 1000 pixels, 1000 photonspixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (EE) 500-700 Endstations X-ray microscope (XM-1) Characteristics Full-field soft...

  7. Beamline 6.1.2

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

    recorded in 3 s at 517 eV with 0.2% BW Resolving power (EE) 500-700 Endstations X-ray microscope (XM-1) Characteristics Full-field soft x-ray transmission microscope Spatial...

  8. Beamline 6.1.2

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

    1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  9. Beamline 6.1.2

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

    1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  10. Beamline 6.1.2

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

    1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  11. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300 µm

  12. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300 µm

  13. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300 µm

  14. Beamline 6.3.2

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

    3.2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300

  15. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300 µm

  16. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300 µm

  17. Beamline 6.1.2

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

    1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  18. Beamline 6.1.2

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

    1.2 Print Center for X-Ray Optics Soft X-Ray Microscopy Scientific disciplines: Magnetism, spin dynamics, x-ray optics, environmental science, materials science GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics Bend magnet Energy range 500-1300 eV Monochromator Zone-plate linear Measured flux (1.9 GeV, 400 mA) Images with 1000 x 1000 pixels, 1000 photons/pixel recorded in 3 s at 517 eV with 0.2% BW Resolving power (E/ΔE) 500-700 Endstations X-ray microscope (XM-1)

  19. Beamline 6.3.2

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

    2 Print EUV Calibrations Scientific discipline: Applied sciences GENERAL BEAMLINE INFORMATION Operational Now Source characteristics Bend magnet Energy range 25-1300 eV Monochromator VLS-PGM Calculated flux (1.9 GeV, 400 mA) 1011 photons/s/0.01%BW at 100 eV Resolving power (E/ΔE) <7,000 Endstations Reflectometer Characteristics 2-circle goniometer with x, y, z, q movement of sample Spatial resolution Can position to 10 µm, 0.01° Detectors Photodiode, channeltron Spot size at sample 300 µm

  20. Energy Department Awards $4.6 Million to Advance Hydrogen Storage...

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

    Awards 4.6 Million to Advance Hydrogen Storage Systems Energy Department Awards 4.6 Million to Advance Hydrogen Storage Systems April 8, 2015 - 2:54pm Addthis The Energy ...

  1. Synthesis, crystal structure and thermal behavior of two hydrated forms of lanthanide phthalates Ln{sub 2}(O{sub 2}+C{sub 6}H{sub 4}-CO{sub 2}){sub 3}(H{sub 2}O) (Ln=Ce, Nd) and Nd{sub 2}(O{sub 2}C-C{sub 6}H{sub 4}-CO{sub 2}){sub 3}(H{sub 2}O){sub 3}

    SciTech Connect (OSTI)

    Pizon, David; Henry, Natacha; Loiseau, Thierry; Roussel, Pascal; Abraham, Francis

    2010-09-15

    New hydrated lanthanide phthalates have been hydrothermally prepared with cerium and neodymium in different reaction media involving water or mixed water-ethanol solvent. The monohydrated Ln{sub 2}(1,2-bdc){sub 3}(H{sub 2}O) (Ln=Ce or Nd) and dihydrated Nd{sub 2}(1,2-bdc){sub 3}(H{sub 2}O){sub 2} forms have been characterized by single-crystal analysis. Their structures consist of infinite inorganic chains of lanthanide-centered polyhedra linked to each other through the phthalate ligands in order to generate mixed organic-inorganic layered structure. The two hydrated structures differ by the number of terminal water species attached to the lanthanide cations, which induce symmetry change from a triclinic (Nd{sub 2}(1,2-bdc){sub 3}(H{sub 2}O){sub 2}) to an orthorhombic (Nd{sub 2}(1,2-bdc){sub 3}(H{sub 2}O){sub 2}) cell for neodymium whereas the cerium-based phase only exists in the monohydrated form, with two distinct symmetries (orthorhombic or triclinic). Structural comparisons with the other members of the lanthanide phthalate series with identical chemical formula are also discussed. Thermal X-ray diffraction experiment indicates that the transformation from dihydrate form into the monohydrated form does not occur during a heating process. - Graphical abstract: New members of the chain-like structures of neodymium phthalates with different hydration states Nd{sub 2}(1,2-bdc){sub 3}(H{sub 2}O){sub x} (x=1 or 2, 1-2bdc=phthalate group) and comparison with cerium-based analogs.

  2. RCRA Facility Investigation report for Waste Area Grouping 6 at Oak Ridge National Laboratory, Oak Ridge, Tennessee. Volume 2, Sections 4 through 9: Environmental Restoration Program

    SciTech Connect (OSTI)

    Not Available

    1991-09-01

    This report presents compiled information concerning a facility investigation of waste area group 6(WAG-6), of the solid waste management units (SWMU`s) at Oak Ridge National Laboratory (ORNL). The WAG is a shallow ground disposal area for low-level radioactive wastes and chemical wastes. The report contains information on hydrogeological data, contaminant characterization, radionuclide concentrations, risk assessment and baseline human health evaluation including a toxicity assessment, and a baseline environmental evaluation.

  3. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  4. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  5. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  6. Beamline 6.0.2

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

    0.2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  7. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  8. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  9. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  10. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  11. Beamline 6.0.2

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

    2 Print Ultrafast/Femtosecond Dynamics Soft X Ray Scientific disciplines: Chemical dynamics, materials science, surfaces, interfaces GENERAL BEAMLINE INFORMATION Operational Yes, but not open to General Users Source characteristics 3.5-cm period undulator (U3) Energy range 250 eV- 1.5 keV Monochromator White light and VLS-PGM, with two gratings (250 and 1000 lines/mm) Calculated fs flux (1.9 GeV, 400 mA) 10,000-100,000 photons/pulse in picosecond mode. 10,000 times smaller in femtosecond mode.

  12. RSE Table N6.3 and N6.4. Relative Standard Errors for Tables N6.3 and N6.4

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

    3 and N6.4. Relative Standard Errors for Tables N6.3 and N6.4;" " Unit: Percents." " "," ",," ","Distillate"," "," " " "," ",,,"Fuel Oil",,,"Coal" "NAICS"," ","Net Demand","Residual","and",,"LPG and","(excluding Coal" "Code(a)","End Use","for Electricity(b)","Fuel

  13. SPEAR_09-10_rev_4-2-09.xls

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

    2008 2009 Dec Jan Feb Mar Apr May Jun Jul Aug Sep Oct S 1 1 S 2 1 1 2 2 3 M 3 3 1 2 MA 1 4 T 4 2 3 2 AP 3 W 1 3 1 4 1 3 7 4 5 12 MA 6 20 17 17 14 4 5 2 3 1 4 1 2 5 4 2 6 3 1 F...

  14. 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

  15. Replication Bypass of the trans-4-Hydroxynonenal-Derived (6S,8R,11S)-1,N[superscript 2]-Deoxyguanosine DNA Adduct by the Sulfolobus solfataricus DNA Polymerase IV

    SciTech Connect (OSTI)

    Banerjee, Surajit; Christov, Plamen P.; Kozekova, Albena; Rizzo, Carmelo J.; Egli, Martin; Stone, Michael P.

    2014-10-02

    trans-4-Hydroxynonenal (HNE) is the major peroxidation product of {omega}-6 polyunsaturated fatty acids in vivo. Michael addition of the N{sub 2}-amino group of dGuo to HNE followed by ring closure of N1 onto the aldehyde results in four diastereomeric 1,N{sub 2}-dGuo (1,N{sub 2}-HNE-dGuo) adducts. The (6S,8R,11S)-HNE-1,N{sub 2}-dGuo adduct was incorporated into the 18-mer templates 5'-d(TCATXGAATCCTTCCCCC)-3' and d(TCACXGAATCCTTCCCCC)-3', where X = (6S,8R,11S)-HNE-1,N{sub 2}-dGuo adduct. These differed in the identity of the template 5'-neighbor base, which was either Thy or Cyt, respectively. Each of these templates was annealed with either a 13-mer primer 5'-d(GGGGGAAGGATTC)-3' or a 14-mer primer 5'-d(GGGGGAAGGATTCC)-3'. The addition of dNTPs to the 13-mer primer allowed analysis of dNTP insertion opposite to the (6S,8R,11S)-HNE-1,N{sub 2}-dGuo adduct, whereas the 14-mer primer allowed analysis of dNTP extension past a primed (6S,8R,11S)-HNE-1,N{sub 2}-dGuo:dCyd pair. The Sulfolobus solfataricus P2 DNA polymerase IV (Dpo4) belongs to the Y-family of error-prone polymerases. Replication bypass studies in vitro reveal that this polymerase inserted dNTPs opposite the (6S,8R,11S)-HNE-1,N{sub 2}-dGuo adduct in a sequence-specific manner. If the template 5'-neighbor base was dCyt, the polymerase inserted primarily dGTP, whereas if the template 5'-neighbor base was dThy, the polymerase inserted primarily dATP. The latter event would predict low levels of Gua {yields} Thy mutations during replication bypass when the template 5'-neighbor base is dThy. When presented with a primed (6S,8R,11S)-HNE-1,N{sub 2}-dGuo:dCyd pair, the polymerase conducted full-length primer extension. Structures for ternary (Dpo4-DNA-dNTP) complexes with all four template-primers were obtained. For the 18-mer:13-mer template-primers in which the polymerase was confronted with the (6S,8R,11S)-HNE-1,N{sub 2}-dGuo adduct, the (6S,8R,11S)-1,N{sub 2}-dGuo lesion remained in the ring-closed conformation at the active site. The incoming dNTP, either dGTP or dATP, was positioned with Watson-Crick pairing opposite the template 5'-neighbor base, dCyt or dThy, respectively. In contrast, for the 18-mer:14-mer template-primers with a primed (6S,8R,11S)-HNE-1,N{sub 2}-dGuo:dCyd pair, ring opening of the adduct to the corresponding N{sub 2}-dGuo aldehyde species occurred. This allowed Watson-Crick base pairing at the (6S,8R,11S)-HNE-1,N{sub 2}-dGuo:dCyd pair.

  16. Data:6e9c2d62-8752-4ecd-8df5-cacbcd112c34 | Open Energy Information

    Open Energy Info (EERE)

    cacbcd112c34 No revision has been approved for this page. It is currently under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic Information 2....

  17. Beamline 4.0.2

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

    Beamline 4.0.2 Beamline 4.0.2 Print Tuesday, 20 October 2009 08:27 Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole...

  18. High-performance symmetric sodium-ion batteries using a new, bipolar O3-type material, Na 0.8 Ni 0.4 Ti 0.6 O 2

    SciTech Connect (OSTI)

    Guo, Shaohua; Yu, Haijun; Liu, Pan; Ren, Yang; Zhang, Tao; Chen, Mingwei; Ishida, Masayoshi; Zhou, Haoshen

    2015-01-01

    Based on low-cost and rich resources, sodium-ion batteries have been regarded as a promising candidate for next-generation energy storage batteries in the large-scale energy applications of renewable energy and smart grids. However, there are some critical drawbacks limiting its application, such as safety and stability problems. In this work, a stable symmetric sodium-ion battery based on the bipolar, active O3-type material, Na0.8Ni0.4Ti0.6O2, is developed. This bipolar material shows a typical O3-type layered structure, containing two electrochemically active transition metals with redox couples of Ni4+/Ni2+ and Ti4+/Ti3+, respectively. This Na0.8Ni0.4Ti0.6O2-based symmetric cell exhibits a high average voltage of 2.8 V, a reversible discharge capacity of 85 mA h g(-1), 75% capacity retention after 150 cycles and good rate capability. This full symmetric cell will greatly contribute to the development of room-temperature sodium-ion batteries with a view towards safety, low cost and long life, and it will stimulate further research on symmetric cells using the same active materials as both cathode and anode.

  19. The unusual stability of TATB (1,3,5-triamino-2,4,6-trinitrobenzene): A review of the scientific literature

    SciTech Connect (OSTI)

    Rice, S.F.; Simpson, R.L.

    1990-07-04

    This review is intended as an up-to-date review of the scientific literature on TATB since its discovery as a high explosive. In particular, it focuses on clarifying our current understanding of the relationship between the structure of TATB and its unique thermal stability. We review a large number of different publications by many authors. A small portion of the work on TATB'' presented actually consists of experimental studies on TATB formulated as PBX-9502 or as LX-17. Where relevant, this distinction is indicated. However, inasmuch as this review focuses on thermal response and the relationship of chemical reactivity to the molecular and lattice structure of TATB as a pure material, results from these other formulations may not be directly applicable, and in general we have omitted them. 4 refs.

  20. Summary of Decisions - February 2, 2015 - February 6, 2015 | Department

    Energy Savers [EERE]

    of Energy 2, 2015 - February 6, 2015 Summary of Decisions - February 2, 2015 - February 6, 2015 February 6, 2015 - 2:34pm Addthis Personnel Security Decision (10 CFR Part 710) On February 4, 2015, an OHA Administrative Judge (AJ) issued a decision in which she concluded that the DOE should not restore an individual's suspended access authorization. A DOE Operations Office referred the individual to administrative review citing as security concerns the individual's diagnoses of Other

  1. RELATIVISTIC (E > 0.6, > 2.0, AND > 4.0 MeV) ELECTRON ACCELERATION AT GEOSYNCHRONOUS ORBIT DURING HIGH-INTENSITY, LONG-DURATION, CONTINUOUS AE ACTIVITY (HILDCAA) EVENTS

    SciTech Connect (OSTI)

    Hajra, Rajkumar; Echer, Ezequiel; Gonzalez, Walter D.; Tsurutani, Bruce T.; Santolik, Ondrej

    2015-01-20

    Radiation-belt relativistic (E > 0.6, > 2.0, and > 4.0MeV) electron acceleration is studied for solar cycle 23 (1995-2008). High-intensity, long-duration, continuous AE activity (HILDCAA) events are considered as the basis of the analyses. All of the 35 HILDCAA events under study were found to be characterized by flux enhancements of magnetospheric relativistic electrons of all three energies compared to the pre-event flux levels. For the E > 2.0MeV electron fluxes, enhancement of >50% occurred during 100% of HILDCAAs. Cluster-4 passes were examined for electromagnetic chorus waves in the 5 < L < 10 and 0 < MLT < 12 region when wave data were available. Fully 100% of these HILDCAA cases were associated with enhanced whistler-mode chorus waves. The enhancements of E > 0.6, > 2.0, and > 4.0MeV electrons occurred ?1.0day, ?1.5days, and ?2.5days after the statistical HILDCAA onset, respectively. The statistical acceleration rates for the three energy ranges were ?1.8 10{sup 5}, 2.2 10{sup 3}, and 1.0 10{sup 1} cm{sup 2} s{sup 1} sr{sup 1} d{sup 1}, respectively. The relativistic electron-decay timescales were determined to be ?7.7, 5.5, and 4.0days for the three energy ranges, respectively. The HILDCAAs were divided into short-duration (D ? 3days) and long-duration (D > 3days) events to study the dependence of relativistic electron variation on HILDCAA duration. For long-duration events, the flux enhancements during HILDCAAs with respect to pre-event fluxes were ?290%, 520%, and 82% for E > 0.6, > 2.0, and > 4.0MeV electrons, respectively. The enhancements were ?250%, 400%, and 27% respectively, for short-duration events. The results are discussed with respect to the current understanding of radiation-belt dynamics.

  2. Native defects in Tl6SI4: Density functional calculations

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

    Shi, Hongliang; Du, Mao -Hua

    2015-05-05

    In this study, Tl6SI4 is a promising room-temperature semiconductor radiation detection material. Here, we report density functional calculations of native defects and dielectric properties of Tl6SI4. Formation energies and defect levels of native point defects and defect complexes are calculated. Donor-acceptor defect complexes are shown to be abundant in Tl6SI4. High resistivity can be obtained by Fermi level pinning by native donor and acceptor defects. Deep donors that are detrimental to electron transport are identified and methods to mitigate such problem are discussed. Furthermore, we show that mixed ionic-covalent character of Tl6SI4 gives rise to enhanced Born effective charges andmore » large static dielectric constant, which provides effective screening of charged defects and impurities.« less

  3. Synthesis of 6-Methyl-9-n-propyldibenzothiophene-4-ol

    SciTech Connect (OSTI)

    Not Available

    1991-10-28

    The material presented here has been described to some extent in Status Reports 12, 13, and 14 and covers the progress toward the synthesis of the modified target molecules 9-isopropyl-4-methoxy-6-methyldibenzothiophene (13) and 9-isopropyl-6-methyldibenzothiophene-4-ol (14). It is divided into three parts: (a) Dehydrogenation experiments On tetrahydrodibenzothiophene 12. (b) methoxyl methyl cleavage of 13 to 14 using boron tribromide. (c) isolation and purification of methoxydibenzothiophene 13.

  4. Beamline 4.0.2

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

    Beamline 4.0.2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet...

  5. Synthesis, structure, and physical properties of [Sm(C{sub 6}NO{sub 2}H{sub 5}){sub 3}(H{sub 2}O){sub 2}]{sub 2n}.(H{sub 5}O{sub 2}){sub n}(ZnCl{sub 5}){sub n}(ZnCl{sub 4}){sub 2n}.(H{sub 2}O){sub 2n} with unprecedented ZnCl{sub 5}{sup 3-} species

    SciTech Connect (OSTI)

    Xie Yiming Chen Wentong; Wu Jihuai

    2008-08-15

    A novel bimetallic 4f-3d metal-isonicotinic acid inorganic-organic hybrid complex [Sm(C{sub 6}NO{sub 2}H{sub 5}){sub 3}(H{sub 2}O){sub 2}]{sub 2n}.(H{sub 5}O{sub 2}){sub n}(ZnCl{sub 5}){sub n}(ZnCl{sub 4}){sub 2n}.(H{sub 2}O){sub 2n} (1) has been synthesized via hydrothermal reaction and structurally characterized by single-crystal X-ray diffraction. Complex 1 is characteristic of a one-dimensional polycationic chain-like structure and unprecedented ZnCl{sub 5}{sup 3-} species. Photoluminescent investigation reveals that the title complex displays interesting emissions in a wide region. Optical absorption spectra of 1 reveal the presence of an optical gap of 3.59 eV. - Graphical abstract: A novel bimetallic 4f-3d metal-isonicotinic acid inorganic-organic hybrid complex was synthesized. It is characteristic of a one-dimensional polycationic chain-like structure. Photoluminescent investigation reveals that the title complex displays interesting emissions in a wide region. Optical absorption spectra of 1 reveal the presence of a wide optical bandgap.

  6. PARC Periodical | Vol. 6, Issue 2 | Photosynthetic Antenna Research Center

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

    2 December 1, 2014 PARC Periodical | Vol. 6, Issue 2

  7. 2D-network of inorganic-organic hybrid material built on Keggin type polyoxometallate and amino acid: [L-C{sub 2}H{sub 6}NO{sub 2}]{sub 3}[(PO{sub 4})Mo{sub 12}O{sub 36}].5H{sub 2}O

    SciTech Connect (OSTI)

    Alizadeh, M.H. Mirzaei, M.; Razavi, H.

    2008-03-04

    A new inorganic-organic hybrid material based on polyoxometallate, [L-C{sub 2}H{sub 6}NO{sub 2}]{sub 3}[(PO{sub 4})Mo{sub 12}O{sub 36}].5H{sub 2}O, has been successfully synthesized and characterized by single-crystal X-ray analysis, elemental analysis, infrared and ultraviolet spectroscopy, proton nuclear magnetic resonance and differential thermal analysis techniques. The title compound crystallizes in the monoclinic space group, P2{sub 1}/c{sub ,} with a = 12.4938 (8) A, b = 19.9326 (12) A, c = 17.9270 (11) A, {beta} = 102.129 (1){sup o}, V = 4364.8 (5) A{sup 3}, Z = 4 and R{sub 1}(wR{sub 2}) = 0.0513, 0.0877. The most remarkable structural feature of this hybrid can be described as two-dimensional inorganic infinite plane-like (2D/{infinity} [(PO{sub 4})Mo{sub 12}O{sub 36}]{sup 3-}) which forming via weak Van der Waals interactions along the z axis. The characteristic band of the Keggin anion [(PO{sub 4})Mo{sub 12}O{sub 36}]{sup 3-} appears at 210 nm in the UV spectrum. Thermal analysis indicates that the Keggin anion skeleton begins to decompose at 520 deg. C.

  8. Structural and spectroscopic characterization of the macrocyclic complex: [Tb(CrO{sub 4})(H{sub 2}O)(C{sub 22}H{sub 26}N{sub 6})] {center_dot}0.5(Cr{sub 2}O{sub 7}){center_dot}(H{sub 2}O)

    SciTech Connect (OSTI)

    Ayala, J.D.; Bombieri, G.; Benetollo, F.

    1995-06-01

    The title complex was obtained by anion metathesis form [Tb(CH{sub 3}COO){sub 2}(C{sub 22}H{sub 26}N{sub 6})] (CH{sub 3}COO){center_dot}4H{sub 2}O and K{sub 2}CrO{sub 4} in aqueous solution. The compound crystallizes in the triclinic space group P1 with a = 8.384(2), b = 10.425(2) c = 15.752(2){angstrom}, {alpha} = 98.82(2), {beta} = 93.52(2), {gamma} = 97.22(2){degrees}, and Z = 2. The structure is ionic and consists of a (+1) complex cation balanced in a 2:1 ratio by a disordered dichromate ion. The 9-coordinate Tb(III) is linked to the six nitrogen atoms of the macrocyclic ligand L = C{sub 22}H{sub 26}N{sub 6}, as well as to a water molecule and a bidentate chelating chromate situated on opposite sides of the macrocycle. The infrared spectrum shows, in addition to the pattern of the macrocyclic ligand, the absorptions arising form the stretching modes of the bidentate chelating CrO{sub 4}{sup 2{minus}} ligand and of the Cr{sub 2}O{sub 7}{sup 2{minus}} counterion.

  9. ULO_2.4W

    Energy Science and Technology Software Center (OSTI)

    2012-03-02

    ULO_2.4W is a computer program that can be used to model elastic wave propagation in heterogeneous media from earthquake (souble couple) point sources. The program is a modified version of the orginal program ULO_2.4 developed by Arben Pitarka. The modifications allow for treatment of solid liquid boundary conditions.

  10. CO2/CH4, CH4/H2 and CO2/CH4/H2 separations at high pressures...

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

    CH4, CH4H2 and CO2CH4H2 separations at high pressures using Mg2(dobdc) Previous Next List Zoey R. Herm, Rajamani Krishna, Jeffrey R. Long, Microporous Mesoporous Mater., 151,...

  11. Temperature dependence of structural parameters in oxide-ion-conducting Nd{sub 9.33}(SiO{sub 4}){sub 6}O{sub 2}: single crystal X-ray studies from 295 to 900K

    SciTech Connect (OSTI)

    Okudera, Hiroki [Max-Planck-Institut fuer Festkoerperforschung, Heisenbergstrasse 1, DE-70569 Stuttgart (Germany)]. E-mail: h.okudera@fkf.mpg.de; Yoshiasa, Akira [Department of Earth and Space Science, Graduate School of Science, Osaka University, 1-1 Machikaneyama-cho, Toyonaka, Osaka 560-0043 (Japan); Masubuchi, Yuuji [Material Science and Engineering, Graduate School of Engineering, Hokkaido University, N13, W8, Kita-ku, Sapporo, Hokkaido 060-8628 (Japan); Higuchi, Mikio [Material Science and Engineering, Graduate School of Engineering, Hokkaido University, N13, W8, Kita-ku, Sapporo, Hokkaido 060-8628 (Japan); Kikkawa, Shinichi [Material Science and Engineering, Graduate School of Engineering, Hokkaido University, N13, W8, Kita-ku, Sapporo, Hokkaido 060-8628 (Japan)

    2004-12-01

    Crystallographic space group, structural parameters and their thermal changes in oxide-ion-conducting Nd{sub 9.33}(SiO{sub 4}){sub 6}O{sub 2} were investigated using high-temperature single-crystal X-ray diffraction experiments in the temperature range of 295=6{sub 3}/m), and no notable structural change occurred over the temperature range examined. Observed anisotropy in thermal motions of oxide ions which belong to SiO{sub 4} tetrahedron indicated high rigidity of the tetrahedron in the structure, indicating that they form sp3 hybrid orbitals and the ligand oxygens do not take part in oxide-ion conductivity. Virtually full occupation of the 6h Nd site and highly anisotropic displacements of oxide ion inside the hexagonal channel were maintained over the temperature range examined. This result confirms that oxide-ion transport inside the hexagonal channel is the dominant process of conduction in the title compound.

  12. TableHC2.4.xls

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

    81.5 72.1 7.6 N N 1.9 For Two Housing Units............................. 18.1 N N 1.4 16.7 N Heat Pump.................................................. 9.2 7.4 0.3 Q 0.7 0.5 Other Equipment......................................... 1.3 0.6 Q Q Q N Fuel Oil........................................................... 7.7 5.5 0.4 0.8 0.9 0.2 Steam or Hot Water System........................ 4.7 2.9 Q 0.7 0.8 N For One Housing Unit.............................. 3.3 2.9 Q Q Q N For Two Housing

  13. Energy Department Awards $4.6 Million to Advance Hydrogen Storage Systems |

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

    Department of Energy Awards $4.6 Million to Advance Hydrogen Storage Systems Energy Department Awards $4.6 Million to Advance Hydrogen Storage Systems April 8, 2015 - 2:54pm Addthis The Energy Department today announced up to $4.6 million for four projects to develop advanced hydrogen storage materials that have potential to enable longer driving ranges and help make fuel cell systems competitive for different platforms and sizes of vehicles. Advanced hydrogen storage systems will be

  14. Thermodynamic data of Ba{sub 0.6}Sr{sub 0.4}Co{sub 0.8}Fe{sub 0.2}O{sub 3−δ} SOFC cathode material

    SciTech Connect (OSTI)

    Botea-Petcu, A.; Tanasescu, S.; Varazashvili, V.; Lejava, N.; Machaladze, T.; Khundadze, M.; Maxim, F.; Teodorescu, F.; Martynczuk, J.; Yáng, Z.; Gauckler, L.J.

    2014-09-15

    Graphical abstract: Partial molar energy of oxygen dissolution (ΔG{sup −}{sub O{sub 2}}) and equilibrium partial pressure of oxygen (log⁡p{sub O{sub 2}}) of perovskite material with the composition Ba{sub 0.6}Sr{sub 0.4}Co{sub 0.8}Fe{sub 0.2}O{sub 3−δ} as a function of temperature. - Highlights: • We report relevant data for thermodynamic stability of Ba{sub 0.6}Sr{sub 0.4}Co{sub 0.8}Fe{sub 0.2}O{sub 3−δ} perovskite compound. • Temperature of structural transformations related to the charge compensation of the material system is evidenced. • The results are discussed based on the properties-defect structure relationship. - Abstract: The compound Ba{sub 0.6}Sr{sub 0.4}Co{sub 0.8}Fe{sub 0.2}O{sub 3−δ} with perovskite structure has been studied focusing mainly on the thermodynamic stability in correlation to the change in the oxygen stoichiometry. The thermochemical behavior has been investigated from room temperature to 1300 K by thermal gravimetry and differential thermal analysis in air and by calorimetry in scanning mode in Argon. The temperature dependence of enthalpy (ΔH{sup T}{sub 298}) in the temperature range of 300–900 K was measured by drop calorimetry. Thermodynamic properties represented by the relative partial molar free energies, enthalpies and entropies of oxygen dissolution in the perovskite phase, as well as the equilibrium partial pressures of oxygen have been obtained in the temperature range of 823–1273 K using solid electrolyte electrochemical cells (EMF). The influence of the oxygen stoichiometry on the thermodynamic properties was examined using a coulometric titration technique coupled with EMF measurements. The results are discussed based on the strong correlation between the energetic parameters and the charge compensation of the material system.

  15. A novel technique for measurement of thermal rate constants and temperature dependences of dissociative recombination: CO{sub 2}{sup +}, CF{sub 3}{sup +}, N{sub 2}O{sup +}, C{sub 7}H{sub 8}{sup +}, C{sub 7}H{sub 7}{sup +}, C{sub 6}H{sub 6}{sup +}, C{sub 6}H{sub 5}{sup +}, C{sub 5}H{sub 6}{sup +}, C{sub 4}H{sub 4}{sup +}, and C{sub 3}H{sub 3}{sup +}

    SciTech Connect (OSTI)

    Fournier, Joseph A.; Shuman, Nicholas S.; Melko, Joshua J.; Ard, Shaun G.; Viggiano, Albert A.

    2013-04-21

    A novel technique using a flowing afterglow-Langmuir probe apparatus for measurement of temperature dependences of rate constants for dissociative recombination (DR) is presented. Low ({approx}10{sup 11} cm{sup -3}) concentrations of a neutral precursor are added to a noble gas/electron afterglow plasma thermalized at 300-500 K. Charge exchange yields one or many cation species, each of which may undergo DR. Relative ion concentrations are monitored at a fixed reaction time while the initial plasma density is varied between 10{sup 9} and 10{sup 10} cm{sup -3}. Modeling of the decrease in concentration of each cation relative to the non-recombining noble gas cation yields the rate constant for DR. The technique is applied to several species (O{sub 2}{sup +}, CO{sub 2}{sup +}, CF{sub 3}{sup +}, N{sub 2}O{sup +}) with previously determined 300 K values, showing excellent agreement. The measurements of those species are extended to 500 K, with good agreement to literature values where they exist. Measurements are also made for a range of C{sub n}H{sub m}{sup +} (C{sub 7}H{sub 7}{sup +}, C{sub 7}H{sub 8}{sup +}, C{sub 5}H{sub 6}{sup +}, C{sub 4}H{sub 4}{sup +}, C{sub 6}H{sub 5}{sup +}, C{sub 3}H{sub 3}{sup +}, and C{sub 6}H{sub 6}{sup +}) derived from benzene and toluene neutral precursors. C{sub n}H{sub m}{sup +} DR rate constants vary from 8-12 Multiplication-Sign 10{sup -7} cm{sup 3} s{sup -1} at 300 K with temperature dependences of approximately T{sup -0.7}. Where prior measurements exist these results are in agreement, with the exception of C{sub 3}H{sub 3}{sup +} where the present results disagree with a previously reported flat temperature dependence.

  16. Zr{sub 9}Co{sub 2}P{sub 4} and Zr{sub 9}Ni{sub 2}P{sub 4}: A new 3D structure type, consisting of edge- and vertex-condensed Zr{sub 6} octahedra

    SciTech Connect (OSTI)

    Kleinke, H.; Franzen, H.F.

    1996-08-28

    The isostructural title compounds were synthesized by arc-melting of stoichiometric ratios of ZrP, Zr, and Co and Ni, respectively, and subsequent annealing at 1450 {degrees}C. Their crystal structure (space group P4/mbm; Zr{sub 9-}Co{sub 2}P{sub 4}, a = 532.23(5) {angstrom}{sup 3}, Z = 2) is derived from a three-dimensional network of Zr{sub 6} octahedra. These octahedra are connected via common vertices to form chains parallel to the c axis and via common edges and vertices in the ab plane, resulting in one double chain and one single chain. Both kinds of the interstitial atoms, the iron-group-metal atom and the phosphorus, are situated in trigonal prismatic holes between these chains, forming short M-P and M-M{prime} bonds. These octahedra can be described as being of the M{sub 6}X{sub 8} cluster type as is also observed in the chalcogenide Chevrel phases. Due to the electronically nonsaturated character of the Zr octahedra and their three-dimensional connectivity, three-dimensional metallic properties are expected for both phosphides, and metallic behavior is confirmed by the observation of Pauli paramagnetism for both compounds.

  17. New insights in the polarization resistance of anode-supported solid oxide fuel cells with La0.6Sr0.4Co0.2Fe0.8O3 cathodes

    SciTech Connect (OSTI)

    Lu, Zigui; Hardy, John S.; Templeton, Jared W.; Stevenson, Jeffry W.

    2011-01-01

    In this study, the polarization resistance of the La0.6Sr0.4Co0.2Fe0.8O3 (LSCF) solid oxide fuel cell (SOFC) cathode was investigated by I-V sweep and electrochemcial impedance spectroscopy under a series of dc bias voltages and cathode environments (i.e. stagnant air, flowing air, and flowing oxygen) at temperatures from 550 to 750 C. In flowing oxygen, the polarization resistance of the fuel cell decreased considerably with the applied current density. A linear relationship was observed between the ohmic-free over-potential and the logarithm of the current density of the fuel cell at all the measuring temperatures. In stagnant or flowing air, a new arc related to the molecular oxygen diffusion in the pores of the cathode was identified at high temperatures and high current densities. The magnitude of this arc increased with the applied current density due to the decreased oxygen partial pressure at the interface of the cathode and the electrolyte. It is found that the performance of the fuel cell in air is mainly determined by the oxygen diffusion process. Elimination of this process by flowing oxygen to the cathode improved the cell performance significantly. At 750 C, for a fuel cell with a laser-deposited Sm0.2Ce0.8O1.9 (SDC) interlayer, an extraordinarily high power density of 2.6 W cm-2 at 0.7 V was achieved in flowing oxygen, as a result of reduced ohmic and polarization resistance of the fuel cell, which were 0.06 ? cm2 and 0.03 ? cm2, respectively. The results indicate that optimization of the microstructure of the LSCF cathode or adoption of a new cell design which can mitigate the diffusion problem in the cathode might enhance cell performance significantly.

  18. Buildings Energy Data Book: 2.6 Residential Home Improvement

    Buildings Energy Data Book [EERE]

    6 2010-2011 National Professional Remodeling Cost and Amount Recouped in Resale Value Envelope Siding Replacement - Vinyl 11.4 8.2 72% Window Replacement - Vinyl 11.1 7.9 72% Window Replacement - Wood 12.0 8.7 72% Roofing Replacement 21.5 12.8 60% Entry Door Replacement - Fiberglass 3.6 2.1 60% Entry Door Replacement - Steel 1.2 1.2 102% Remodel Minor Kitchen Remodel 21.7 15.8 73% Major Kitchen Remodel 58.4 40.1 69% Bathroom Remodel 16.6 10.7 64% Attic Bedroom Remodel 51.4 37.1 72% Basement

  19. Buildings Energy Data Book: 2.4 Residential Environmental Data

    Buildings Energy Data Book [EERE]

    5 2025 Residential Buildings Energy End-Use Carbon Dioxide Emissions Splits, by Fuel Type (Million Metric Tons) (1) Natural Petroleum Gas Distil. Resid. LPG Oth(2) Total Coal Electricity (3) Total Percent Space Heating (4) 173.9 27.9 15.2 1.6 44.7 0.6 73.2 292.3 25.1% Space Cooling 0.0 177.2 177.2 15.2% Water Heating 70.2 3.5 2.5 6.0 83.7 159.9 13.8% Lighting 74.1 74.1 6.4% Refrigeration (5) 75.8 75.8 6.5% Electronics (6) 58.7 58.7 5.1% Wet Cleaning (7) 3.3 47.9 51.2 4.4% Cooking 11.7 1.6 1.6

  20. Itinerant ferromagnetism in the As 4p conduction band of Ba0.6K0.4Mn2As2 identified by x-ray magnetic circular dichroism

    SciTech Connect (OSTI)

    Ueland, B. G.; Pandey, Abhishek; Lee, Y.; Sapkota, A.; Choi, Y.; Haskel, D.; Rosenberg, R. A.; Lang, J. C.; Harmon, B. N.; Johnston, D. C.; Kreyssig, A.; Goldman, A. I.

    2015-05-27

    In this study, x-ray magnetic circular dichroism (XMCD) measurements on single-crystal and powder samples of Ba0.6K0.4Mn2As2 show that the ferromagnetism below TC ≈ 100 K arises in the As 4p conduction band. No XMCD signal is observed at the Mn x-ray absorption edges. Below TC, however, a clear XMCD signal is found at the As K edge which increases with decreasing temperature. The XMCD signal is absent in data taken with the beam directed parallel to the crystallographic c axis indicating that the orbital magnetic moment lies in the basal plane of the tetragonal lattice. These results show that the previously reported itinerant ferromagnetism is associated with the As 4p conduction band and that distinct local-moment antiferromagnetism and itinerant ferromagnetism with perpendicular easy axes coexist in this compound at low temperature.

  1. Beamline 4.0.2

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

    4.0.2 Beamline 4.0.2 Print Tuesday, 20 October 2009 08:27 Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the

  2. Beamline 4.0.2

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

    Beamline 4.0.2 Beamline 4.0.2 Print Tuesday, 20 October 2009 08:27 Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported

  3. Beamline 4.0.2

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

    Beamline 4.0.2 Beamline 4.0.2 Print Tuesday, 20 October 2009 08:27 Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported

  4. Quantification of corrosion resistance of a new-class of criticality control materials: thermal-spray coatings of high-boron iron-based amorphous metals - Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4

    SciTech Connect (OSTI)

    Farmer, J C; Choi, J S; Shaw, C K; Rebak, R; Day, S D; Lian, T; Hailey, P; Payer, J H; Branagan, D J; Aprigliano, L F

    2007-03-28

    An iron-based amorphous metal, Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} (SAM2X5), with very good corrosion resistance was developed. This material was produced as a melt-spun ribbon, as well as gas atomized powder and a thermal-spray coating. Chromium (Cr), molybdenum (Mo) and tungsten (W) provided corrosion resistance, and boron (B) enabled glass formation. The high boron content of this particular amorphous metal made it an effective neutron absorber, and suitable for criticality control applications. Earlier studies have shown that ingots and melt-spun ribbons of these materials have good passive film stability in these environments. Thermal spray coatings of these materials have now been produced, and have undergone a variety of corrosion testing, including both atmospheric and long-term immersion testing. The modes and rates of corrosion have been determined in the various environments, and are reported here.

  5. From the ternary Eu(Au/In)2 and EuAu4(Au/In)2 with remarkable Au/In distributions to a new structure type: The gold-rich Eu5Au16(Au/In)6 structure

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

    Steinberg, Simon; Card, Nathan; Mudring, Anja -Verena

    2015-08-13

    The ternary Eu(Au/In)2 (EuAu0.46In1.54(2)) (I), EuAu4(Au/In)2 (EuAu4+xIn2–x with x = 0.75(2) (II), 0.93(2), and 1.03(2)), and Eu5Au16(Au/In)6 (Eu5Au17.29In4.71(3)) (III) have been synthesized, and their structures were characterized by single-crystal X-ray diffraction. I and II crystallize with the CeCu2-type (Pearson Symbol oI12; Imma; Z = 4; a = 4.9018(4) Å; b = 7.8237(5) Å; c = 8.4457(5) Å) and the YbAl4Mo2-type (tI14; I4/mmm; Z = 2; a = 7.1612(7) Å; c = 5.5268(7) Å) and exhibit significant Au/In disorder. I is composed of an Au/In-mixed diamond-related host lattice encapsulating Eu atoms, while the structure of II features ribbons of distorted, squaredmore » Au8 prisms enclosing Eu, Au, and In atoms. Combination of these structural motifs leads to a new structure type as observed for Eu5Au16(Au/In)6 (Eu5Au17.29In4.71(3)) (oS108; Cmcm; Z = 4; a = 7.2283(4) Å; b = 9.0499(6) Å; c = 34.619(2) Å), which formally represents a one-dimensional intergrowth of the series EuAu2–“EuAu4In2”. The site preferences of the disordered Au/In positions in II were investigated for different hypothetical “EuAu4(Au/In)2” models using the projector-augmented wave method and indicate that these structures attempt to optimize the frequencies of the heteroatomic Au–In contacts. Furthermore, a chemical bonding analysis on two “EuAu5In” and “EuAu4In2” models employed the TB-LMTO-ASA method and reveals that the subtle interplay between the local atomic environments and the bond energies determines the structural and site preferences for these systems.« less

  6. Cobalt-iron red-ox behavior in nanostructured La{sub 0.4}Sr{sub 0.6}Co{sub 0.8}Fe{sub 0.2}O{sub 3-{delta}} cathodes

    SciTech Connect (OSTI)

    Soldati, Analia L.; Baque, Laura; Napolitano, Federico; Serquis, Adriana

    2013-02-15

    Nano-sized La{sub 0.4}Sr{sub 0.6}Co{sub 0.8}Fe{sub 0.2}O{sub 3-{delta}} (LSCF) perovskite samples (prepared by a conventional acetate route and a novel acetate synthesis with HMTA additives), were tested simulating a red-ox cycle. The crystallography was studied by X-ray Powder Diffraction (XPD) and the changes in the oxidation state of the perovskite B-site were evaluated by synchrotron X-ray Absorption Near Edge Spectroscopy (XANES). After a reducing treatment, LSFC particles show the appearance of a new phase that coexists with the original one. The structural change is accompanied by a Co and Fe formal oxidation states decrease, although Fe remains always closer to 4+ and Co closer to 3+. The treatment produces a B-site valence average reduction from 3.52+ to 3.26+ and the formation of oxygen vacancies. A re-oxidation treatment under O{sub 2} rich atmosphere at 800 Degree-Sign C for 10 h shows that the change is reversible and independent of the two chemical methods used to synthesize the LSCF nano-particles. - Graphical abstract: XANES and XPD measurements in nanostructured LSCF before (black) and after (red/green) a red/ox cycle. Highlights: Black-Right-Pointing-Pointer Red-ox treatments in LSCF nano-particles cause a reversible reaction. Black-Right-Pointing-Pointer XPD analyses show that a new 'reduced' phase coexist with the oxidize one. Black-Right-Pointing-Pointer The B-site formal oxidation state decreases and the {delta} increases upon reduction. Black-Right-Pointing-Pointer Fe remains in a higher valence (closer to 4+) than Co (close to 3+). Black-Right-Pointing-Pointer The behavior seems to be independent of the synthesis method used.

  7. CsBi4Te6: A High-Performance Thermoelectric Material for Low...

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

    thermoelectric properties of CsBi(4)Te(6) appear to match or exceed those of Bi(2-x)Sb(x)Te(3-y)Se(y) alloys. URL: Link to article - National Center for Biotechnology Information

  8. Correlation between upconversion photoluminescence and dielectric response in Ba-substituted (Sr{sub 1?x}Ba{sub x}){sub 4}(La{sub 0.85}Ho{sub 0.025}Yb{sub 0.125}){sub 2}Ti{sub 4}Nb{sub 6}O{sub 30}

    SciTech Connect (OSTI)

    Wei, T.; Wang, X. D.; Zhao, C. Z.; Liu, M. F.; Liu, J. M.

    2014-06-30

    The filled tetragonal tungsten bronze (Sr{sub 1?x}Ba{sub x}){sub 4}(La{sub 0.85}Ho{sub 0.025}Yb{sub 0.125}){sub 2}Ti{sub 4}Nb{sub 6}O{sub 30} (SBLTNx: Ho-Yb) ceramics with different Ba substitution levels (x) are prepared. The upconversion photoluminescence (UC-PL) and dielectric permittivity are investigated. The substitution of Sr{sup 2+} ions at the A{sub 2}-sites by larger Ba{sup 2+} ions results in substantial variation of the UC-PL intensity as a function of substitution level x. Furthermore, the dielectric response to the substitution of Sr{sup 2+} by Ba{sup 2+} suggests a close correlation between the UC-PL intensity and dielectric permittivity. The origin for this correlation is discussed based on the random stress field (RSF) model.

  9. Table 4.6 Crude Oil and Natural Gas Exploratory Wells, 1949-2010

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

    6 Crude Oil and Natural Gas Exploratory Wells, 1949-2010 Year Wells Drilled Successful Wells Footage Drilled 1 Average Footage Drilled Crude Oil 2 Natural Gas 3 Dry Holes 4 Total Crude Oil 2 Natural Gas 3 Dry Holes 4 Total Crude Oil 2 Natural Gas 3 Dry Holes 4 Total Number Percent Thousand Feet Feet per Well 1949 1,406 424 7,228 9,058 20.2 5,950 2,409 26,439 34,798 4,232 5,682 3,658 3,842 1950 1,583 431 8,292 10,306 19.5 6,862 2,356 30,957 40,175 4,335 5,466 3,733 3,898 1951 1,763 454 9,539

  10. Synthesis and structural characterization of Al{sub 4}Si{sub 2}C{sub 5}-homeotypic aluminum silicon oxycarbide, (Al{sub 6-x}Si{sub x})(O{sub y}C{sub 5-y}) (x{approx}0.8 and y{approx}1.6)

    SciTech Connect (OSTI)

    Kaga, Motoaki; Urushihara, Daisuke; Iwata, Tomoyuki; Sugiura, Keita [Department of Environmental and Materials Engineering, Nagoya Institute of Technology, Nagoya 466-8555 (Japan); Nakano, Hiromi [Cooperative Research Facility Center, Toyohashi University of Technology, Toyohashi 441-8580 (Japan); Fukuda, Koichiro, E-mail: fukuda.koichiro@nitech.ac.j [Department of Environmental and Materials Engineering, Nagoya Institute of Technology, Nagoya 466-8555 (Japan)

    2010-09-15

    We have prepared a new layered oxycarbide, [Al{sub 5.25(5)}Si{sub 0.75(5)}][O{sub 1.60(7)}C{sub 3.40(7)}], by isothermal heating of (Al{sub 4.4}Si{sub 0.6})(O{sub 1.0}C{sub 3.0}) at 2273 K near the carbon-carbon monoxide buffer. The crystal structure was characterized using X-ray powder diffraction, transmission electron microscopy and energy dispersive X-ray spectroscopy (EDX). The title compound is trigonal with space group R3m (centrosymmetric), Z=3, and hexagonal cell dimensions a=0.32464(2) nm, c=4.00527(14) nm and V=0.36556(3) nm{sup 3}. The atom ratios Al:Si were determined by EDX, and the initial structural model was derived by the direct methods. The final structural model showed the positional disordering of one of the three types of Al/Si sites. The reliability indices were R{sub wp}=4.45% (S=1.30), R{sub p}=3.48%, R{sub B}=2.27% and R{sub F}=1.25%. The crystal is composed of three types of domains with nearly the same fraction, one of which has the crystal structure of space group R3-bar m. The crystal structure of the remaining two domains, which are related by pseudo-symmetry inversion, is noncentrosymmetric with space group R3m. - Graphical Abstract: A new aluminum silicon oxycarbide, (Al{sub 6-x}Si{sub x})(O{sub y}C{sub 5-y}) (x{approx}0.8 and y{approx}1.6). The crystal is composed of three types of domains (I, II and III), and hence the structure is represented by a split-atom model. Individual crystal structures can be regarded as layered structures, which consist of A-type [(Al,Si){sub 4}(O,C){sub 4}] unit layers and B-type [(Al,Si)(O,C){sub 2}] single layers.

  11. Shock initiation of 2,4-dinitroimidazole (2,4-DNI)

    SciTech Connect (OSTI)

    Urtiew, P.A.; Tarver, C.M.; Simpson, R.L.

    1995-07-19

    The shock sensitivity of the pressed solid explosive 2,4-dinitroimidazole (2,4-DNI) was determined using the embedded manganin pressure gauge technique. At an initial shock pressure of 2 GPa, several microseconds were required before any exothermic reaction was observed. At 4 GPa, 2,4-DNI reacted more rapidly but did not transition to detonation at the 12 mm deep gauge position. At 6 GPa, detonation occurred in less than 6 mm of shock propagation. Thus, 2,4-DNI is more shock sensitive than TATB-based explosives but is considerably less shock sensitive than HMX-based explosives. An Ignition and Growth reactive flow model for 2,4-DNI based on these gauge records showed that 2,4-DNI exhibits shock initiation characteristics similar to TATB but reacts faster. The chemical structure of 2,4-DNI suggests that it may exhibit thermal decomposition reactions similar to nitroguanine and explosives with similar ring structures, such as ANTA and NTO.

  12. Synthesis of 6-Methyl-9-propyldibenzothiophene-4-ol amended to 9-isopropyl-6-methyldibenzothiophene-4-ol. Final technical report, July 25, 1991--January 25, 1993

    SciTech Connect (OSTI)

    Eisenbraun, E.J.

    1992-02-17

    This is a draft final technical report on Task 1 of a contract to synthesize 6-Methyl-9-propyldibenzothiophene-4-ol, as amended to 9- isopropyl-6-methyldibenzothiophene-4-ol. This report is a compilation of data presented in earlier reports. The first annual report dealt with an attempted synthesis of 4-methoxy-6-methyl-9- propyldibenzothiophene (the original target compound), the successful synthesis and delivery of 200 grams of the sulfide 1,4-diethyl-2- [(2{prime}-methoxyphenyl)-thio]benzene, and initial work on a new synthesis route for the preparation of the new target compound 9- isopropyl-6-methyldibenzothiophene-4-ol. The change to the new target compound and the new synthesis route became necessary when it was learned that the sulfide mixture could not be cyclized to the substituted dibenzothiophene mixture. The second annual report described the successful preparation of 45 g of the new target compound using the new synthesis route. Subsequently funds were provided to synthesize an additional 45 g of the new target using the same reaction scheme. This task was recently completed.

  13. Beamline 4.0.2

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

    Beamline 4.0.2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x

  14. Beamline 4.0.2

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

    Beamline 4.0.2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x

  15. Beamline 4.0.2

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

    Beamline 4.0.2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x

  16. Buildings Energy Data Book: 2.4 Residential Environmental Data

    Buildings Energy Data Book [EERE]

    3 2010 Residential Buildings Energy End-Use Carbon Dioxide Emissions Splits, by Fuel Type (Million Metric Tons) (1) Natural Petroleum Gas Distil. Resid. LPG Oth(2) Total Coal Electricity (3) Total Percent Space Heating (4) 185.5 38.8 18.7 2.2 59.7 0.7 77.6 323.5 26.3% Space Cooling 0.0 210.2 210.2 17.1% Water Heating 68.7 7.1 4.6 11.7 90.4 170.8 13.9% Lighting 126.0 126.0 10.2% Electronics (5) 96.5 96.5 7.8% Refrigeration (6) 80.7 80.7 6.6% Wet Cleaning (7) 2.9 57.8 60.8 4.9% Cooking 11.4 1.9

  17. Buildings Energy Data Book: 2.4 Residential Environmental Data

    Buildings Energy Data Book [EERE]

    4 2015 Residential Buildings Energy End-Use Carbon Dioxide Emissions Splits, by Fuel Type (Million Metric Tons) (1) Natural Petroleum Gas Distil. Resid. LPG Oth(2) Total Coal Electricity (3) Total Percent Space Heating (4) 180.5 34.9 16.6 1.8 53.3 0.6 66.6 301.0 27.4% Space Cooling 0.0 161.1 161.1 14.7% Water Heating 69.6 5.1 3.1 8.2 75.3 153.1 13.9% Lighting 83.7 83.7 7.6% Refrigeration (5) 71.7 71.7 6.5% Electronics (6) 52.0 52.0 4.7% Wet Cleaning (7) 3.2 51.6 54.7 5.0% Cooking 11.5 1.8 1.8

  18. Modernization Enhancements in SCALE 6.2

    SciTech Connect (OSTI)

    Rearden, Bradley T; Lefebvre, Robert A; Lefebvre, Jordan P; Clarno, Kevin T; Williams, Mark L; Petrie Jr, Lester M; Mertyurek, Ugur

    2014-01-01

    SCALE is a widely used suite of tools for nuclear systems modeling and simulation that provides comprehensive, verified and validated, user-friendly capabilities for criticality safety, reactor physics, radiation shielding, and sensitivity and uncertainty analysis. For more than 30 years, regulators, industry, and research institutions around the world have used SCALE for nuclear safety analysis and design. However, the underlying architecture of SCALE is based on a 40-year old design with dozens of independent functional modules and control programs, primarily implemented in the Fortran programming language, with extensive use of customized intermediate files to control the logical flow of the analysis. Data are passed between individual computational codes using custom binary files that are read from and written to the hard disk. The SCALE modernization plan provides a progression towards SCALE 7, which will provide an object-oriented parallel-enabled software infrastructure with state-of-the-art methods implemented as reusable components. This paper provides a brief overview of the goals of SCALE modernization and details some modernized features available with SCALE 6.2.

  19. Preparation of 4-amino-2,4-dioxobutanoic acid

    DOE Patents [OSTI]

    Unkefer, Pat J.; Martinez, Rodolfo A.; Glass, David R.

    2016-03-22

    A process for synthesizing 4-amino-2,4-dioxobutanoate involves reacting a dialkyl oxalate with an alkoxide in ethanol to form a reaction mixture, and afterward adding an alkyl cyano acetate to the reaction mixture and allowing a reaction to proceed under conditions suitable to form a first reaction product of the formula diethyl 2-cyano-3-hydroxy-butenedioate, and then isolating the diethyl 2-cyano-3-hydroxy-butenedioate, and afterward reacting the diethyl-2-cyano-3-hydroxy-butenedioate with an aqueous hydroxide under conditions suitable to form 4-amino-2,4-dioxobutanoate. The 4-amino-2,4-dioxobutanoate may be acidified into 4-amino-2,4-dioxobutanoic acid.

  20. Categorical Exclusion Determinations: B2.6 | Department of Energy

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

    6 Categorical Exclusion Determinations: B2.6 Existing Regulations B2.6: Recovery of radioactive sealed sources Recovery of radioactive sealed sources and sealed source-containing ...

  1. RSE Table E6.1 and E6.2. Relative Standard Errors for Tables E6.1 and E6.2

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

    E6.1 and E6.2. Relative Standard Errors for Tables E6.1 and E6.2;" " Unit: Percents." " "," ",," ","Distillate"," "," ",," " " ",,,,"Fuel Oil",,,"Coal" " "," ","Net","Residual","and",,"LPG and","(excluding Coal"," " "End Use","Total","Electricity(a)","Fuel

  2. Table 4.2 Offsite-Produced Fuel Consumption, 2010

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

    49 9 * * 22 * 0 0 17 325193 Ethyl Alcohol 307 25 0 * 252 * 25 0 4 325199 Other ... 6 1 * * 5 * 0 0 * 325193 Ethyl Alcohol 2 * 0 * 2 * 0 0 0 325199 Other Basic ...

  3. NCIPO Ex A (Rev. 2.6, 3/6/15) Exhibit A General Conditions

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

    6, 3/6/15) Exhibit A General Conditions Page 1 of 14 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1B DEFINITIONS (Jan 2010) .......................................................................................................... 2 GC-2B CORRESPONDENCE AND SUBCONTRACT INTERPRETATION (Jan 2010) ....................... 2 GC-5 NOTICE TO PROCEED (Jul 2011) ........................................................................................... 2 GC-6A ORDER OF

  4. file://C:\\Documents%20and%20Settings\\VM3\\My%20Documents\\hc6-4a...

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

    0.4 Q Q 0.3 Q | 30.7 | Adequacy of Insulation | Well Insulated...... 42.6 30.4 3.0 6.8 2.5 | 6.7 Adequately Insulated...... 43.1 30.1 3.3 ...

  5. file://C:\\Documents%20and%20Settings\\VM3\\My%20Documents\\hc6-2a...

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

    Equipment But | Do Not Use It...... 0.4 Q Q Q Q Q Q | 43.6 | Adequacy of Insulation | Well Insulated...... 42.6 9.8 8.6 7.2 5.2 4.4 7.4 | 6.0 ...

  6. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.2.6

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.2.6 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  7. Table HC6.4 Space Heating Characteristics by Number of Household Members, 2005

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

    4 Space Heating Characteristics by Number of Household Members, 2005 Total..................................................................... 111.1 30.0 34.8 18.4 15.9 12.0 Do Not Have Space Heating Equipment............ 1.2 0.3 0.3 Q 0.2 0.2 Have Main Space Heating Equipment............... 109.8 29.7 34.5 18.2 15.6 11.8 Use Main Space Heating Equipment................. 109.1 29.5 34.4 18.1 15.5 11.6 Have Equipment But Do Not Use It................... 0.8 Q Q Q Q Q Main Heating Fuel and

  8. LCLS-scheduling-run_6_Ver4.xlsx

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

    LCLS shutdown LCLS Approved Experiments for Run 6, June-December 2012 Instrument Prop Proposal Title Spokesperson XPP L503 Ultrafast Resonant Inelastic X-ray Scattering...

  9. Preparation of 4-amino-2,4-dioxobutanoic acid

    DOE Patents [OSTI]

    Unkefer, Pat J.; Martinez, Rodolfo A.; Glass, David R.

    2015-06-02

    A process for synthesizing 4-amino-2,4-dioxobutanoic acid involves reacting diethyl oxalate with sodium ethoxide in ethanol to form a reaction mixture, and afterward adding ethyl cyanoacetate to the reaction mixture and allowing a reaction to proceed under conditions suitable to form a first reaction product of the formula diethyl-2-cyano-3-hydroxy-butenedioate, and then isolating the diethyl-2-cyano-3-hydroxybutenedioate, and afterward reacting the diethyl-2-cyano-3-hydroxy-butenedioate with aqueous sodium hydroxide under conditions suitable to form 4-amino-2,4-dioxobutanoic acid.

  10. Preparation of 4-amino-2,4-dioxobutanoic acid

    DOE Patents [OSTI]

    Unkefer, Pat J.; Martinez, Rodolfo A.; Glass, David R.

    2016-03-22

    A process for synthesizing 4-amino-2,4-dioxobutanoic acid involves reacting diethyl oxalate with an alkoxide in ethanol to form a reaction mixture, and afterward adding ethyl cyanoacetate to the reaction mixture and allowing a reaction to proceed under conditions suitable to form a first reaction product of the formula diethyl 2-cyano-3-hydroxy-butenedioate, and then isolating the diethyl 2-cyano-3-hydroxy-butenedioate, and afterward reacting the diethyl-2-cyano-3-hydroxy-butenedioate with an aqueous hydroxide under conditions suitable to form 4-amino-2,4-dioxobutanoic acid.

  11. Temperature- and frequency-dependent dielectric properties of organic–inorganic hybrid compound: (C{sub 6}H{sub 9}N{sub 2}){sub 2}(Hg{sub 0.75}Cd{sub 0.25})Cl{sub 4}

    SciTech Connect (OSTI)

    Elwej, R. Hamdi, M.; Hannachi, N.; Hlel, F.

    2015-02-15

    Highlights: • We have synthesized a new hybrid compound of composition (C6H9N2)2(Hg0.75Cd0.25)Cl4. • The Ac conductivity of the title material was studied as a function of frequency and temperature. • The dielectric data have been analyzed in modulus formalism using KWW. - Abstract: The bis-2-amino-4-picolinium tetrachloromercurate-cadmate compound (C{sub 6}H{sub 9}N{sub 2}){sub 2}(Hg{sub 0.75}Cd{sub 0.25})Cl{sub 4} was prepared by hydrothermal method and characterized by X-ray diffraction (XRD) technique. The electrical properties of the compound were studied using impedance spectroscopy in the frequency and temperature range of 200 Hz–5 MHz and 308–403 K, respectively. The equivalent circuit is modeled by a combination of a parallel Rp//CPE circuit to explain the impedance results. The dielectric data were analyzed using complex electrical modulus M* at various temperatures. The activation energy responsible for the relaxation calculated from the modulus spectra is found to be almost the same as the value obtained from the temperature variation of dc conductivity. The electrical modulus and its scaling behavior are also investigated.

  12. Criticality safety review of 2 1/2 -, 10-, and 14-ton UF sub 6 cylinders

    SciTech Connect (OSTI)

    Broadhead, B.L.

    1991-01-01

    The US regulations governing the packaging and transportation of UF{sub 6} cylinders are contained in the publication 10CFR71. Under the current 10CFR71 regulations, packages are classified according to Fissile Class I, II, or III and a corresponding transport index (TI). UF{sub 6} cylinders designed to contain 2{1/2}-tons of UF{sub 6} are classified as Fissile Class II packages with a TI of 5 for the purpose of transportation. The 10-ton UF{sub 6} cylinders are classified as Fissile Class I with no TI assigned for transportation. The 14-ton cylinders are not certified for transport with enrichments greater than 1 wt % since they have no approved overpack. This work reviews the suitability of 2{1/2}-ton UF{sub 6} packages for reclassification as Fissile Class I with a maximum {sup 235}U enrichment of 5 wt %. Additionally, the 10- and 14-ton cylinders are reviewed to address a change in maximum {sup 235}U enrichment from 4.5 to 5 wt %. Based on this evaluation, the 2{1/2}-ton UF{sub 6} cylinders meet the 10CFR71 criteria for Fissile Class I packages, and no TI is needed for criticality safety purposes. Similarly, the 10- and 14-ton UF{sub 6} packages appear suitable for a maximum enrichment rating change to 5 wt % {sup 235}U. 6 refs., 4 figs., 1 tab.

  13. Buildings Energy Data Book: 2.6 Residential Home Improvement

    Buildings Energy Data Book [EERE]

    5 Single-Family Residential Renovations, by Project and Vintage Pre-1946 1946-60 1961-73 1974-80 1981-98 1999 or later Kitchen Remodeled 60% 57% 54% 60% 44% 8% Bathroom Remodeled 59% 52% 59% 55% 40% 4% Add Room(s) 29% 18% 14% 24% 21% 15% Exterior Improvement 21% 15% 15% 16% 9% 4% Basement Room Finished 14% 10% 6% 12% 16% 65% Redesign/Restructure 14% 8% 11% 10% 5% 4% Bathroom Added 8% 7% 6% 7% 6% 27% Sun room Added 4% 6% 3% 4% 5% 8% Note(s): Source(s): Year Home was Built Data based on a

  14. Photodissociation of (SO{sub 2}?XH) Van der Waals complexes and clusters (XH = C{sub 2}H{sub 2}, C{sub 2}H{sub 4}, C{sub 2}H{sub 6}) excited at 32?04032?090 cm{sup ?1} with formation of HSO{sub 2} and X

    SciTech Connect (OSTI)

    Makarov, Vladimir I.; Kochubei, Sergei A.; Khmelinskii, Igor

    2014-02-07

    We studied photodecomposition dynamics of (SO{sub 2}?XH) Van der Waals (VdW) complexes and clusters in gas phase, with X = C{sub 2}H, C{sub 2}H{sub 3}, and C{sub 2}H{sub 5}. SO{sub 2} was excited by frequency-doubled radiation of a tunable dye laser and resonance-enhanced multiphoton ionization was used to detect the C{sub 2}H (m/z 25), C{sub 2}H{sub 3} (m/z 27), and C{sub 2}H{sub 5} (m/z 29) ions by time-of-flight mass spectroscopy. Spectra obtained at higher nozzle pressures (P{sub 0} > 2.5 atm) indicate formation of clusters. Detailed studies of the VdW complex structure were carried out by analyzing the rotational structure of the respective action spectra. We also performed ab initio theoretical analysis of structures of the VdW complexes and transitional states leading to photodecomposition. We find that the structure of the transition state is significantly different as compared to the equilibrium ground-state structure of the respective complex. The photodecomposition mechanism depends on the hydrocarbon molecule bound to SO{sub 2}.

  15. MCNP6 Cosmic & Terrestrial Background Particle Fluxes -- Release 4

    SciTech Connect (OSTI)

    McMath, Garrett E.; McKinney, Gregg W.; Wilcox, Trevor

    2015-01-23

    Essentially a set of slides, the presentation begins with the MCNP6 cosmic-source option, then continues with the MCNP6 transport model (atmospheric, terrestrial) and elevation scaling. It concludes with a few slides on results, conclusions, and suggestions for future work.

  16. RSE Table N6.1 and N6.2. Relative Standard Errors for Tables N6.1 and N6.2

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

    1 and N6.2. Relative Standard Errors for Tables N6.1 and N6.2;" " Unit: Percents." " "," "," ",," ","Distillate"," "," ",," " " "," ",,,,"Fuel Oil",,,"Coal" "NAICS"," "," ","Net","Residual","and",,"LPG and","(excluding Coal"," " "Code(a)","End

  17. Full differentiation and assignment of boron species in the electrolytes Li{sub 2}B{sub 6}O{sub 9}F{sub 2} and Li{sub 2}B{sub 3}O{sub 4}F{sub 3} by solid-state {sup 11}B NMR spectroscopy

    SciTech Connect (OSTI)

    Braeuniger, Thomas; Pilz, Thomas; Chandran, C. Vinod; Jansen, Martin

    2012-10-15

    The syntheses of two new fluorooxoborates, Li{sub 2}B{sub 3}O{sub 4}F{sub 3} and Li{sub 2}B{sub 6}O{sub 9}F{sub 2}, which possess considerable ion conductivity at higher temperatures, have been reported recently. Here, we describe the characterisation of these compounds by solid-state {sup 11}B NMR spectroscopy. The complex central-transition MAS spectra, resulting from overlap of sub-spectra contributed by the individual boron species in the crystal structures, could be clearly separated by acquisition and analysis of 3QMAS spectra. By numerical fit of these sub-spectra, the isotropic chemical shift {delta}{sub iso}, the quadrupolar coupling constant {chi}, and the asymmetry {eta} were determined. Using known relations between boron coordination and chemical shift as well as quadrupolar coupling, the individual {sup 11}B NMR resonances have been ascribed to boron species in tetrahedral or trigonal environment. To remove remaining assignment ambiguities, the response of the {sup 11}B resonances to {sup 19}F decoupling was qualitatively analysed. Thus, by using the combined information conveyed by chemical shift, quadrupolar and dipolar interaction, a complete assignment of the complex {sup 11}B line shapes exhibited by the fluorooxoborates has been achieved. - Graphical abstract: Structure and solid-state {sup 11}B NMR spectrum of Li{sub 2}B{sub 3}O{sub 4}F{sub 3}. Highlights: Black-Right-Pointing-Pointer Characterisation of title compounds by solid-state {sup 11}B NMR spectroscopy. Black-Right-Pointing-Pointer Sub-spectra of boron species separated by evaluation of 3QMAS spectra. Black-Right-Pointing-Pointer Isotropic chemical shift and quadrupolar interaction parameters determined. Black-Right-Pointing-Pointer Full boron assignment based on NMR parameters and response to {sup 19}F decoupling.

  18. Beamline 4.0.2

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

    2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL...

  19. Microsoft PowerPoint - MO Orientation Final 6 4 07

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

    beforeon schedule Department of Energy 4 What is GFPR (cont) *Philosophy whereby work is performed with minimal contract focus on process *Focus is on Results with...

  20. table6.2_02.xls

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

    2 Consumption Ratios of Fuel, 2002; Level: National and Regional Data; Row: Values of Shipments and Employment Sizes; Column: Energy-Consumption Ratios; Unit: Varies. Consumption Consumption per Dollar Consumption per Dollar of Value RSE Economic per Employee of Value Added of Shipments Row Characteristic(a) (million Btu) (thousand Btu) (thousand Btu) Factors Total United States RSE Column Factors: 1.1 1 0.9 Value of Shipments and Receipts (million dollars) Under 20 281.0 3.9 2.2 3 20-49 583.7

  1. Experimental Station 6-2C | Stanford Synchrotron Radiation Lightsource

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

    C Beamline 6-2 is a wiggler end-station beamline dedicated for advanced x-ray spectroscopy and transmission x-ray microscopy. The 6-2 middle hutch is equipped with a 40-crystal...

  2. RFP RCE-6-6377 Sample Subcontract, Attachment 2

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

    PAYMENT, AND CEILING AMOUNT ... 2 ARTICLE 4 - PERSONAL PROPERTY MANAGEMENT AND CONTROL (JAN 2010) ... 2 ARTICLE 5 -...

  3. Table HC6.2 Living Space Characteristics by Number of Household Members, 2005

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

    2 Living Space Characteristics by Number of Household Members, 2005 Total...................................................................... 111.1 30.0 34.8 18.4 15.9 12.0 Floorspace (Square Feet) Total Floorspace 1 Fewer than 500............................................... 3.2 1.7 0.8 0.4 0.3 Q 500 to 999....................................................... 23.8 10.2 6.4 3.4 2.3 1.5 1,000 to 1,499................................................. 20.8 5.5 6.3 3.0 3.3 2.6 1,500 to

  4. SUPESv.4.1.2

    Energy Science and Technology Software Center (OSTI)

    2001-04-25

    SUPES is a collection of subprograms that perform frequently used non-numerical services for the engineering applications programmer. The three functional categories of SUPES are: (1) input command parsing, (2) dynamic memory management, and (3) system dependent utilities. The subprograms in categories one and two are written in standard FORTRAN-77, while the subprograms in category three are written provide a standarized FORTRAN interface to several system dependent features.

  5. Beamline 4.0.2

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

    2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x (degree of

  6. Beamline 4.0.2

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

    2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x (degree of

  7. Beamline 4.0.2

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

    2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x (degree of

  8. Beamline 4.0.2

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

    2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x (degree of

  9. Beamline 4.0.2

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

    2 Print Magnetic Spectroscopy and Scattering Scientific disciplines: Magnetism, materials science Endstations: Eight-pole electromagnet Scattering Chamber 9T magnet GENERAL BEAMLINE INFORMATION Operational Yes Source characteristics 5.0-cm period elliptical polarization undulator (EPU5) Energy range 100-2000 eV Monochromator Variable-included-angle PGM Calculated flux (1.9 GeV, 400 mA) 1 x 1013 photons/s/0.1%BW at 800 eV [Value reported is the merit function, flux = total flux x (degree of

  10. Synthesis of 6-Methyl-9-n-propyldibenzothiophene-4-ol ammended to 6-Methyl-9-(1-methylethyl)-dibenzothiophene-4-ol

    SciTech Connect (OSTI)

    Not Available

    1992-02-28

    The material presented below is taken from Status Reports 15, 16 and 17 and covers the progress made toward the synthesis of the modified target molecules 9-isopropyl-4-methoxy-6 methyldibenzothiophene (13) and 9-isopropyl-6methyldibenzothiophene-4-ol (14).

  11. Franklin XT4 to Hopper XE6 Katie Antypas and Helen He NERSC User Services Group

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

    Transitioning Users from Franklin XT4 to Hopper XE6 Katie Antypas and Helen He NERSC User Services Group May 23-26, CUG 2011 2 Outline * Introduction * Hopper Early User Program * Effectively Using 24 Cores Per Node * I/O Performance * Bugs Found and Fixed * Error Messages * User Feedback * Ongoing Issues * Summary 3 Franklin and Hopper Franklin: Cray XT4 * 9,532 nodes, 38,128 cores * ~32 TFlop/s sustained * 356 TFlop/s peak Hopper: * Phase 1: Cray XT5, 668 nodes, 5,344 cores * Phase 2: Cray

  12. Data:Caa5cce6-c6c8-4b7a-ac01-eb6abdf87c9b | Open Energy Information

    Open Energy Info (EERE)

    Caa5cce6-c6c8-4b7a-ac01-eb6abdf87c9b No revision has been approved for this page. It is currently under review by our subject matter experts. Jump to: navigation, search Loading......

  13. Microstructure characterization of laser welded Ti-6Al-4V fusion zones

    SciTech Connect (OSTI)

    Xu, Pei-quan; Li, Leijun, E-mail: leijun.li@ualberta.ca; Zhang, Chunbo

    2014-01-15

    The as-welded microstructure of laser-welded Ti-6Al-4V is characterized as a function of CO2 key-hole mode laser welding speed. Martensitic ?? is the predominant phase, with some ? and retained ?. Phase transformation is affected by the cooling rate through laser welding speed. A higher welding speed of 1.6 to 2.0 m/min produced more martensite ?? and less retained ? in the welds. 1.4 m/min welding speed produced small amounts of ?, besides the martensite ??. A trace of ? titanium hydride phase seems to have formed in the weld fusion zone. Moir fringes are a common feature in the TEM microstructure, due to abundance of multi-phase interfaces. Tensile twins and clusters of dislocations indicate that plastic deformation has happened in the as-welded microstructure, indicating the local stress levels to be approaching the yield stress on-cooling during laser welding.

  14. Table 6.4 Natural Gas Gross Withdrawals and Natural Gas Well Productivity, 1960-2011

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

    Natural Gas Gross Withdrawals and Natural Gas Well Productivity, 1960-2011 Year Natural Gas Gross Withdrawals From Crude Oil, Natural Gas, Coalbed, and Shale Gas Wells Natural Gas Well Productivity Texas 1 Louisiana 1 Oklahoma Other States 1 Federal Gulf of Mexico 2 Total Onshore Offshore Total Gross With- drawals From Natural Gas Wells 3 Producing Wells 4 Average Productivity Federal State Total Million Cubic Feet Million Cubic Feet Million Cubic Feet Number Cubic Feet per Well 1960 6,964,900

  15. Microsoft Word - 4Q13 Web Rev1 5-6-14

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

    3 SRR-ESH-2014-00010 Revision 1 May 30, 2014 Page 1 of 6 Z-Area Saltstone Disposal Facility Permit General Condition B.5.a-h Information and Consent Order of Dismissal, Section III.7 Permit Condition Requirement Estimated Value Updated Value Comments B.5 a) Cumulative process volume of salt waste disposed to date Not Applicable 8,770 kgals Vault 4, Cells B, D, E, F, H, J, K, L SDU 2, Cells 2A and 2B SDU 5, Cell 5B Cumulative salt waste disposed volume updated to 8,770 kgals from 8,767 kgals

  16. Decision document for function 4.2.4 dispose waste

    SciTech Connect (OSTI)

    Claghorn, R.D.

    1996-09-23

    This report formally documents the planning assumptions for Function 4.2.4, Dispose Waste, to provide a basis for lower level Tank Waste Remediation System (TWRS) Disposal Program decisions and analyses. The TWRS Environmental Impact Statement (DOE/EIS 1996) and a supplemental Environmental Impact Statement for closure of operable units will provide the ultimate Records of Decision for the TWRS strategy at this level. However, in the interim, this decision document provides a formal basis for the TWRS Dispose Waste planning assumptions. Function 4.2.4 addresses the disposition of immobilized high-level waste (IHLW), the disposition of immobilized low-activity waste (ILAW), and closure of the tank farm operable units.

  17. Decision document for function 4.2.4 dispose waste

    SciTech Connect (OSTI)

    Mcconville, C.M.

    1996-09-23

    This report formally documents the planning assumptions for Function 4.2.4, {ital Dispose Waste} to provide a basis for lower level Tank Waste Remediation System (TWRS) Disposal Program decisions and analyses. The TWRS Environmental Impact Statement (DOE/EIS 1996) and a supplemental Environmental Impact Statement for closure of operable units will provide the ultimate Records of Decision for the TWRS strategy at this level. However, in the interim, this decision document provides a formal basis for the TWRS Dispose Waste planning assumptions. Function 4.2.4 addresses the disposition of immobilized high-level waste (IHLW), the disposition of immobilized low-activity waste (ILAW), and closure of the tank farm operable units.

  18. Buildings Energy Data Book: 2.4 Residential Environmental Data

    Buildings Energy Data Book [EERE]

    6 2035 Residential Buildings Energy End-Use Carbon Dioxide Emissions Splits, by Fuel Type (Million Metric Tons) (1) Natural Petroleum Gas Distil. Resid. LPG Oth(2) Total Coal Total Percent Space Heating (4) 169.7 22.8 14.1 1.5 38.3 0.5 76.7 285.3 23.1% Water Heating 67.2 2.6 2.1 4.7 84.8 156.7 12.7% Space Cooling 0.0 194.5 194.5 15.7% Electronics (5) 68.1 68.1 5.5% Refrigeration (6) 81.5 81.5 6.6% Lighting 74.3 74.3 6.0% Wet Cleaning (7) 3.5 50.0 53.4 4.3% Cooking 12.2 1.5 1.5 23.2 37.0 3.0%

  19. table2.4_02.xls

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

    Number of Establishments by Nonfuel (Feedstock) Use of Combustible Energy, 2002; Level: National Data; Row: NAICS Codes (3-Digit Only); Column: Energy Sources; Unit: Establishment Counts. Any Combustible RSE NAICS Energy Residual Distillate Natural LPG and Coke Row Code(a) Subsector and Industry Source(b) Fuel Oil Fuel Oil(c) Gas(d) NGL(e) Coal and Breeze Other(f) Factors Total United States RSE Column Factors: 1.5 0.6 1.1 1 1.1 0.7 1 1.4 311 Food 406 W 152 185 0 0 4 83 9.6 311221 Wet Corn

  20. Data:225b952f-75c8-44c8-9e4b-2e63f6a9a928 | Open Energy Information

    Open Energy Info (EERE)

    under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic Information 2. Demand 3. Energy << Previous 1 2 3 Next >> Basic Information...

  1. Measurements of coronal Faraday rotation at 4.6 R {sub ?}

    SciTech Connect (OSTI)

    Kooi, Jason E.; Fischer, Patrick D.; Buffo, Jacob J.; Spangler, Steven R.

    2014-03-20

    Many competing models for the coronal heating and acceleration mechanisms of the high-speed solar wind depend on the solar magnetic field and plasma structure in the corona within heliocentric distances of 5 R {sub ?}. We report on sensitive Very Large Array (VLA) full-polarization observations made in 2011 August, at 5.0 and 6.1 GHz (each with a bandwidth of 128 MHz) of the radio galaxy 3C 228 through the solar corona at heliocentric distances of 4.6-5.0 R {sub ?}. Observations at 5.0 GHz permit measurements deeper in the corona than previous VLA observations at 1.4 and 1.7 GHz. These Faraday rotation observations provide unique information on the magnetic field in this region of the corona. The measured Faraday rotation on this day was lower than our a priori expectations, but we have successfully modeled the measurement in terms of observed properties of the corona on the day of observation. Our data on 3C 228 provide two lines of sight (separated by 46'', 33,000 km in the corona). We detected three periods during which there appeared to be a difference in the Faraday rotation measure between these two closely spaced lines of sight. These measurements (termed differential Faraday rotation) yield an estimate of 2.6-4.1 GA for coronal currents. Our data also allow us to impose upper limits on rotation measure fluctuations caused by coronal waves; the observed upper limits were 3.3 and 6.4 rad m{sup 2} along the two lines of sight. The implications of these results for Joule heating and wave heating are briefly discussed.

  2. DOE Exhibit D 2-6-06.doc

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

    06 2 Sun Mon Tue Wed Thu Fri Sat 1 Units 1 & 4 on, with trona 2 3 4 Unit 4 off for boiler leak 5 Units 1 on, with trona Another base load unit will be added with trona as ...

  3. Notice of Intent to Revise DOE M 470.4-6

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

    2010-10-06

    The proposed revision of this manual will convert the requirements to and new order, DOE O 470.6, and cancel DOE M 470.4-6, Chg 1.

  4. NMS 74-6-4 Duties and Powers of the Water Quality Control Commission...

    Open Energy Info (EERE)

    -4 Duties and Powers of the Water Quality Control Commission Jump to: navigation, search OpenEI Reference LibraryAdd to library Legal Document- StatuteStatute: NMS 74-6-4 Duties...

  5. High temperature experiments on a 4 tons UF6 container TENERIFE program

    SciTech Connect (OSTI)

    Casselman, C.; Duret, B.; Seiler, J.M.; Ringot, C.; Warniez, P.

    1991-12-31

    The paper presents an experimental program (called TENERIFE) whose aim is to investigate the behaviour of a cylinder containing UF{sub 6} when exposed to a high temperature fire for model validation. Taking into account the experiments performed in the past, the modelization needs further information in order to be able to predict the behaviour of a real size cylinder when engulfed in a 800{degrees}C fire, as specified in the regulation. The main unknowns are related to (1) the UF{sub 6} behaviour beyond the critical point, (2) the relationship between temperature field and internal pressure and (3) the equivalent conductivity of the solid UF{sub 6}. In order to investigate these phenomena in a representative way it is foreseen to perform experiments with a cylinder of real diameter, but reduced length, containing 4 tons of UF{sub 6}. This cylinder will be placed in an electrically heated furnace. A confinement vessel prevents any dispersion of UF{sub 6}. The heat flux delivered by the furnace will be calibrated by specific tests. The cylinder will be changed for each test.

  6. Conduction below 100 °C in nominal Li6ZnNb4O14

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

    Li, Yunchao; Paranthaman, Mariappan Parans; Gill, Lance W.; Edward W. Hagaman; Wang, Yangyang; Sokolov, Alexei P.; Dai, Sheng; Ma, Cheng; Chi, Miaofang; Veith, Gabriel M.; et al

    2015-09-15

    The increasing demand for a safe rechargeable battery with a high energy density per cell is driving a search for a novel solid electrolyte with a high Li+ or Na+ conductivity that is chemically stable in a working Li-ion or Na-ion battery. Li6ZnNb4O14 has been reported to exhibit a σ Li > 10-2 S cm-1 at 250 °C, but to disproportionate into multiple phases on cooling from 850 °C to room temperature. An investigation of the room-temperature Li-ion conductivity in a porous pellet of a multiphase product of a nominal Li6ZnNb4O14 composition is shown to have bulk σ Li 3.3more » x 10-5 S cm-1 at room temperature that increases to 1.4 x 10-4 S cm-1 by 50 °C. 7Li MAS NMR spectra were fitted to two Lorentzian lines, one of which showed a dramatic increase with increasing temperature. As a result, a test for water stability indicates that Li+ may move to the particle and grain surfaces to react with adsorbed water as occurs in the garnet Li+ conductors.« less

  7. Categorical Exclusion Determinations: B4.2

    Broader source: Energy.gov [DOE]

    B4.2: Export of electric energyExport of electric energy as provided by Section 202(e) of the Federal Power Act over existing transmission systems or using transmission system changes that are...

  8. Buildings Energy Data Book: 6.2 Electricity Generation, Transmission, and Distribution

    Buildings Energy Data Book [EERE]

    9 2009 Peak Load and Capacity Margin, Summer and Winter by NERC Region (MW) NERC Region Capacity Margin Capacity Margin TRE 16.7% 19.1% FRCC 6.0% 2.0% MRO (U.S.) 24.6% 26.8% NPCC (U.S.) 29.1% 43.2% RFC 25.2% 33.3% SERC 24.6% 26.2% SPP 16.4% 34.6% WECC 19.4% 29.6% U.S. TOTAL 22.2% 28.5% Note(s): Source(s): 128,245 109,565 725,958 668,818 1) Summer Demand includes the months of June, July, August, and September. 2) Winter Demand includes December of the previous year and January-March of the

  9. CASL Plan of Record 2 (1/11-6/11)

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

    ... 2.3 and 2.4) that will be needed to permit users of VERA to install and utilize the ... as new capabilities and improvements become available using a "pipeline" update process. ...

  10. Categorical Exclusion Determinations: B6.2 | Department of Energy

    Office of Environmental Management (EM)

    June 15, 2009 CX-000496: Categorical Exclusion Determination F Area Hazardous Waste Management Facility Silver Chloride Solution Injection Wells CX(s) Applied: B6.2 Date: 0615...

  11. Simultaneous presence of (Si{sub 3}O{sub 10}){sup 8−} and (Si{sub 2}O{sub 7}){sup 6−} groups in new synthetic mixed sorosilicates: BaY{sub 4}(Si{sub 2}O{sub 7})(Si{sub 3}O{sub 10}) and isotypic compounds, studied by single-crystal X-ray diffraction, Raman spectroscopy and DFT calculations

    SciTech Connect (OSTI)

    Wierzbicka-Wieczorek, Maria; Többens, Daniel M.; Kolitsch, Uwe; Tillmanns, Ekkehart

    2013-11-15

    Three new, isotypic silicate compounds, BaY{sub 4}(Si{sub 2}O{sub 7})(Si{sub 3}O{sub 10}), SrYb{sub 4}(Si{sub 2}O{sub 7})(Si{sub 3}O{sub 10}) and SrSc{sub 4}(Si{sub 2}O{sub 7})(Si{sub 3}O{sub 10}), were synthesized using high-temperature flux growth techniques, and their crystal structures were solved from single-crystal X-ray intensity data: monoclinic, P2{sub 1}/m, with a=5.532(1)/5.469(1)/5.278(1), b=19.734(4)/19.447(4)/19.221(4), c=6.868(1)/6.785(1)/6.562(1) Å, β=106.53(3)/106.20(3)/106.50(3)°, V=718.8(2)/693.0(2)/638.3(2) Å{sup 3}, R(F)=0.0225/0.0204/0.0270, respectively. The topology of the novel structure type contains isolated horseshoe-shaped Si{sub 3}O{sub 10} groups (Si–Si–Si=93.15–95.98°), Si{sub 2}O{sub 7} groups (Si–O{sub bridge}–Si=180°, symmetry-restricted) and edge-sharing M(1)O{sub 6} and M(2)O{sub 6} octahedra. Single-crystal Raman spectra of the title compounds were measured and compared with Raman spectroscopic data of chemically and topologically related disilicates and trisilicates, including BaY{sub 2}(Si{sub 3}O{sub 10}) and SrY{sub 2}(Si{sub 3}O{sub 10}). The band assignments are supported by additional theoretical calculation of Raman vibrations by DFT methods. - Graphical abstract: View of BaY{sub 4}(Si{sub 2}O{sub 7})(Si{sub 3}O{sub 10}) along [100], showing zigzag chains and the tri- and disilicate groups. The unit cell is outlined. Display Omitted - Highlights: • We report a novel interesting crystal structure type for mixed sorosilicates containing Y, Yb, and Sc. • Synthesis of such mixed sorosilicates is possible by a high-temperature flux-growth technique. • Calculation of Raman vibrations by advanced DFT methods allows a considerably improved interpretation of measured Raman spectra.

  12. IDIQ BS Ex A (Rev. 3.2, 6/14/13) Exhibit A General Conditions

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

    2, 6/14/13) Exhibit A General Conditions Page 1 of 19 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1 DEFINITIONS (Aug 2012) ......................................................................................................... 3 GC-2A AUTHORIZED REPRESENTATIVES, COMMUNICATIONS AND NOTICES (Jan 2010) ....... 3 GC-3 INDEPENDENT CONTRACTOR (Jun 2009) ............................................................................ 4 GC-4 SUBCONTRACT INTERPRETATION (Jun

  13. "Order Module--DOE O 470.4B, SAFEGUARDS AND SECURITY PROGRAM, DOE O 471.6,

    Office of Environmental Management (EM)

    !!"#$%&$'(&)'*+,&)-'.*/*"0123 "Case in Point"! Community-Scale Renewable Energy ! at ! Blue Lake Rancheria " !"#$%"#&'()"*' !"#"$%&'()*+&,*$-.$/,&)01$$ 2-++3,4*1$#5(6&$7&,&8(96&$/,&)01$:-);<=-'$ >(6+$#')4,0<?$2@$ +#,"-%"./'0123' !!!"#$%&$'(&)'*+,&)-'.*/*"0123 Overview" ! " 4*5)16%+71*/33 *"

  14. Rietveld refinement and ionic conductivity of Ca{sub 8.4}Bi{sub 1.6}(PO{sub 4}){sub 6}O{sub 1.8}

    SciTech Connect (OSTI)

    Tmar Trabelsi, I.; Madani, A.; Mercier, A.M.; Toumi, M.

    2013-01-15

    The structure of Ca{sub 8.4}Bi{sub 1.6}(PO{sub 4}){sub 6}O{sub 1.8}, isostructural with Fluoroapatite, was determined by X-ray powder diffraction methods. The results of Rietveld refinement revealed that the formula of this compound is [Ca{sub 4}]{sup 4f}[Ca{sub 4.4}Bi{sub 1.6}]{sup 6h}(PO{sub 4}){sub 6}[O{sub 1.8}]{sup 2a}, space group P63/m (a=9.468 (3) A, c=6.957 (3) A). A total substitution of Bi{sup 3+} ions in the (6h) sites was related particularly to the high polarizability of the Bi{sup 3+} ion compared to Ca{sup 2+}. The observed frequencies in the Raman and infrared spectra were explained and discussed on the basis of unit-cell group analyses and in comparison with Fluoroapatite and other oxyapatites. The ionic conductivity over a wide range of temperature was investigated according to the complex impedance method. The highest overall conductivity values were found at {sigma}{sub 700 Degree-Sign C} =5.03 Multiplication-Sign 10{sup -7} S cm{sup -1} and E{sub a}=0.50 eV. - Graphical abstract: The final Rietveld refinement plot of the Ca{sub 8.4}Bi{sub 1.6} (PO{sub 4}){sub 6}O{sub 1.8}. Highlights: Black-Right-Pointing-Pointer The Rietveld refinement revealed that the formula of this compound is Ca{sub 8.4}Bi{sub 1.6}(PO{sub 4}){sub 6}O{sub 1.8}. Black-Right-Pointing-Pointer Vibrational spectroscopy supports the high symmetry P63/m space group for this apatite. Black-Right-Pointing-Pointer This apatite contained channels where oxygen ions were located in 2a sites. Black-Right-Pointing-Pointer The possibility of anionic conduction along these channels was considered.

  15. Synthesis of 3-amino-4-hydroxylaminothiazolidine-2-thiones and 2,3-dimethyl-4. cap alpha. ,5-dihydro-7-thioxothiazolo(3,4-b)-1,2,4-triazines

    SciTech Connect (OSTI)

    Epshtein, S.P.; Orlova, T.I.; Rukasov, A.F.; Tashchi, V.P.; Putsykin, Yu. G.

    1987-10-01

    The reaction of dimeric nitroso chlorides of olefins with potassium dithiocarbazate was used to synthesize 3-amino-4-hydroxylaminothiazolidine-2-thiones, which undergo rearrangement to 2-mercapto-1,3,4-thiadiazines on heating and react with butane-2,3-dione to give 2,3-dimethyl-4..cap alpha..,5-dihydro-7-thioxothiazolo(3,4-b)-1,2,4-triazine 4-oxides. The latter are reduced by sodium borohydride to the corresponding 3,4,4..cap alpha..,5-tetrahydro-7-thioxo derivatives. The IR spectra of KBr pellets of the compounds were recorded with a Perkin-Elmer spectrometer. The UV spectra of solutions in ethanol were obtained with a Specord UV spectrophotometer. The PMR spectra of solutions of the compounds in d/sub 6/-DMSO were obtained with a Varian FT-80A spectrometer with tetramethylsilane (TMS) as the internal standard.

  16. Rational Design of Cesium-Selective Ionophores and Chemosensors: Dihydrocalix[4]arene Crown-6 Ethers

    SciTech Connect (OSTI)

    Sachleben, Richard A.; Bryan, Jeffrey C.; Brown, Gilbert M.; Engle, Nancy L.; Haverlock, Tamara J.; Hay, Benjamin P.; Urvoas, Agathe; Moyer, Bruce A.

    2003-12-15

    Molecular mechanics calculations performed on calix[4]arene crown-6 ethers predict that the 1,3-dihydro derivatives will exhibit greater complementarity for potassium and cesium ions than the parent 1,3-dialkoxy calix crowns. The X-ray crystal structures of 1,3-alt bis-octyloxycalix[4]arene benzocrown-6 ether, dihydrocalix[4]arene benzocrown-6 ether, and the cesium nitrate complex of dihydrocalix[4]arene benzocrown-6 ether were determined. The cesium complex structure corresponds closely to the structure predicted by molecular mechanics. The dihydrocalix[4]arene crown-6 ethers exhibit enhanced cesium selectivity in the extraction of alkali metal salts and provide a platform for a highly sensitive and selective cesium chemosensor.

  17. Coupled antiferromagnetic spin- 12 chains in green dioptase Cu6[Si6O18]·6H2O

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

    Podlesnyak, Andrey A; Larry M. Anovitz; Kolesnikov, Alexander I; Matsuda, Masaaki; Prisk, Timothy R; Toth, Sandor; Ehlers, Georg

    2016-02-01

    Inmore » this paper, we report inelastic neutron scattering measurements of the magnetic excitations of green dioptase Cu6[Si6O18]∙6H2O. The observed spectrum contains two magnetic modes and a prominent spin gap that is consistent with the ordered ground state of Cu moments coupled antiferromagnetically in spiral chains along the c axis and ferromagnetically in ab planes on the hexagonal cell. The data are in excellent agreement with a spin- 12Hamiltonian that includes antiferromagnetic nearest-neighbor intrachain coupling Jc=10.6(1) meV, ferromagnetic interchain coupling Jab=₋1.2 (1) meV, and exchange anisotropy ΔJc=0.14(1) meV. We calculated the sublattice magnetization to be strongly reduced, ~0.39μB. This appears compatible with a reduced Néel temperature, TN=14.5K

  18. Laser cladding of Ti-6Al-4V with various carbide powders

    SciTech Connect (OSTI)

    Folkes, J.A.; Shibata, K. )

    1994-06-01

    Laser cladding Ti-6Al-4V can be achieved with various weight percentages of different carbide powders. The microstructure and morphology of the clad layer is determined by the cladding powder composition, for a given set of laser parameters, such that 10 and 20 wt% Cr[sub 3]C[sub 2] results in a [beta] + TiC clad microstructure; 10 and 20 wt% WC results in an [alpha] + TiC clad microstructure (plus some original WC); and Mo[sub 2]C gives an [alpha] + [beta] + TiC or [beta] + TiC structure, depending on the weight percentage of Mo[sub 2]C. The morphology of the TiC in all cases is dendritic or feathery, depending on the carbide content. The microstructure observed in all cases agreed well with that theoretically predicted from the energetics of carbide formation and [beta]-stabilizing properties of each element.

  19. Synthesis of 6-Methyl-9-n-propyldibenzo thiophene-4-ol ammended to 6-Methyl-9-(1-methylethyl)-dibenzo thiophene-4-ol. Quarterly technical progress report No. 6, October 28, 1991--January 26, 1992

    SciTech Connect (OSTI)

    Not Available

    1992-02-28

    The material presented below is taken from Status Reports 15, 16 and 17 and covers the progress made toward the synthesis of the modified target molecules 9-isopropyl-4-methoxy-6 methyldibenzothiophene (13) and 9-isopropyl-6methyldibenzothiophene-4-ol (14).

  20. Operation Greenhouse. Scientific Director's report of atomic-weapon tests at Eniwetok, 1951. Annex 1. 6. Blast measurements. Part 4. Pressure-time measurements in the Mach region. Sections 1 and 2

    SciTech Connect (OSTI)

    Price, J.F.; Sokol, G.M.; Anastasion, S.N.; Vader, R.L.; Walthall, E.R.

    1985-09-01

    The objective of the laboratory and field work described in this report was to make accurate measurements of air blast in the Mach region from two explosions of Operation Greenhouse. Measurements were made at constant height along a single radius on Test Dog and along two different radii for test Easy. In addition, diaphragm-type inductance gages were installed at five different heights on approximately the same radii on test Easy. The spring-piston gage successfully did the job it was designed to do. The diaphragm-type inductance-gage measuring system had an accuracy of 2% in pressure and a resolving time of approximately 1 musec. Complete details concerning equipment design, field operation, and recommendations for future use of the systems are presented.

  1. Operational guidance for using DOT-6M/2R packaging

    SciTech Connect (OSTI)

    Kelly, D.L.; Hummer, J.H.

    1994-03-01

    The purpose of this paper is to describe a new US Department of Energy (DOE), Transportation Management Division task to create a US Department of Transportation (DOT) Specification 6M/2R packaging configuration user`s guide. The need for a user`s guide was identified because the DOT-6M/2R packaging configuration is widely used by DOE site contractors, and DOE receives many questions about the approved packaging configurations. Currently, two DOE organizations have the authority to approve new DOT-6M/2R configurations. For Defense Programs, the Transportation and Packaging Safety Division (EH-332) administers the program. For Environmental Restoration and Waste Management, the Transportation Management Division (EM-261) administers the program.

  2. Polyorganometallosiloxane-2- or -4-pyridine coatings

    DOE Patents [OSTI]

    Sugama, Toshifumi

    1997-01-01

    A new family of polyorganometallosiloxane-2- or -4-pyridine compounds are provided for corrosion resistant coatings on light metals such as aluminum, magnesium, zinc, steel and their allows. The novel compounds contain backbones modified by metal alkoxides, metallocenes and metallophthalocyanates where the metal is Zr, Ti, Mo, V, Hf, Nb, Si, B and combinations thereof. Methods of making the new compounds are also provided.

  3. In Situ Foaming of Porous (La 0.6 Sr 0.4 ) 0.98 (Co 0.2 Fe 0.8 ) O 3−δ (LSCF) Cathodes for Solid Oxide Fuel Cell Applications

    SciTech Connect (OSTI)

    Gandavarapu, Sodith; Sabolsky, Edward; Sabolsky, Katarzyna; Gerdes, Kirk

    2015-01-01

    A binder system containing polyurethane precursors was used to in situ foam (direct foam) a (La{sub 0.6}Sr{sub 0.4}){sub 0.98} (Co{sub 0.2} Fe{sub 0.8}) O{sub 3-{#2;delta}} (LSCF) composition for solid oxide fuel cell (SOFC) cathode applications. The relation between in situ foaming parameters on the final microstructure and electrochemical properties was characterized by microscopy and electrochemical impedance spectroscopy (EIS), respectively. The optimal porous cathode architecture was formed with a 70 vol% solids loading within a polymer precursor composition with a volume ratio of 8:4:1 (isocyanate: PEG: surfactant) in a terpineol-based ink vehicle. The resultant microstructure displayed a broad pore size distribution with highly elongated pore structure.

  4. Recyclability study on Inconel 718 and Ti-6Al-4V powders for...

    Office of Scientific and Technical Information (OSTI)

    Ti-6Al-4V, on the other hand, finds its reuse time governed by the oxygen pick up that occurs during and in between build cycles. The detailed results have been presented. Authors: ...

  5. Title 43 CFR 1610.4-6 Estimation of Effects of Alternatives ...

    Open Energy Info (EERE)

    4-6 Estimation of Effects of Alternatives Jump to: navigation, search OpenEI Reference LibraryAdd to library Legal Document- Federal RegulationFederal Regulation: Title 43 CFR...

  6. An experimental study of the (Ti-6Al-4V)-xH phase diagram using...

    Office of Scientific and Technical Information (OSTI)

    An experimental study of the (Ti-6Al-4V)-xH phase diagram using in situ synchrotron XRD and TGADSC techniques This content will become publicly available on February 10, 2017 ...

  7. NCIPO Ex A (Rev. 2.2, 6/14/13) Exhibit A General Conditions

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

    2, 6/14/13) Exhibit A General Conditions Page 1 of 11 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1B DEFINITIONS (Jan 2010) .......................................................................................................... 2 GC-2B CORRESPONDENCE AND SUBCONTRACT INTERPRETATION (Jan 2010) ....................... 2 GC-6A ORDER OF PRECEDENCE (Jan 2010) ................................................................................... 2 GC-8A COMPLIANCE WITH

  8. Polyorganometallosiloxane-2- or -4-pyridine coatings

    DOE Patents [OSTI]

    Sugama, T.

    1997-12-30

    A new family of polyorganometallosiloxane-2- or -4-pyridine compounds are provided for corrosion resistant coatings on light metals such as aluminum, magnesium, zinc, steel and their alloys. The novel compounds contain backbones modified by metal alkoxides, metallocenes and metallophthalocyanates where the metal is Zr, Ti, Mo, V, Hf, Nb, Si, B and combinations thereof. Methods of making the new compounds are also provided. 13 figs.

  9. Synthesis, crystal structure and photoluminescence of a new Eu-doped Sr containing sialon (Sr{sub 0.94}Eu{sub 0.06})(Al{sub 0.3}Si{sub 0.7}){sub 4}(N{sub 0.8}O{sub 0.2}){sub 6}

    SciTech Connect (OSTI)

    Yamane, Hisanori; Shimooka, Satoshi; Uheda, Kyota

    2012-06-15

    Colorless transparent platelet single crystals of a novel Eu{sup 2+}-doped strontium silicon aluminum oxynitride, (Sr{sub 0.94}Eu{sub 0.06})(Al{sub 0.3}Si{sub 0.7}){sub 4}(N{sub 0.8}O{sub 0.2}){sub 6}, were prepared at 1800 Degree-Sign C and 0.92 MPa of N{sub 2}. Fundamental reflections of electron and X-ray diffraction of the crystals were indexed with a face-centered orthorhombic unit cell (a=5.8061(5) A, b=37.762(3) A, c=9.5936(9) A). Diffuse streaks elongated in the b-axis direction were observed around the fundamental reflections hkl with h=2n+1 of the electron and X-ray diffraction, indicating stacking faults of (0 1 0)[1 0 0]/2. A crystal structure model without the stacking faults was obtained using the X-ray diffraction data of the fundamental reflections with the space group Fdd2. A SiN{sub 4}-tetrahedron double layer of [SiN{sub 2}]{sub 2} and a Sr/Eu double layer of [(Sr{sub 0.94}Eu{sub 0.06})Al{sub 1.2}Si{sub 0.8}N{sub 0.8} O{sub 1.2}]{sub 2} are stacked alternately along the b-axis direction. The title compound showed an emission with a peak wavelength of 490 nm under 334 nm excitation at room temperature. - Graphical abstract: Single crystals of a novel Eu{sup 2+}-doped strontium silicon aluminum oxynitride, (Sr{sub 0.94}Eu{sub 0.06})(Al{sub 0.3}Si{sub 0.7}){sub 4}(N{sub 0.8}O{sub 0.2}){sub 6}, having stacking faults on the (0 1 0) plane of an orthorhombic cell, were prepared at 1800 Degree-Sign C and 0.92 MPa of N{sub 2}. The compound showed emission with a peak wavelength of 490 nm under 334 nm excitation at room temperature. Highlights: Black-Right-Pointing-Pointer A new compound Eu{sup 2+}-doped (Sr{sub 0.94}Eu{sub 0.06})(Al{sub 0.3}Si{sub 0.7}){sub 4}(N{sub 0.8}O{sub 0.2}){sub 6} was prepared. Black-Right-Pointing-Pointer Stacking faults in the compound were clarified by electron and X-ray diffraction. Black-Right-Pointing-Pointer A basic crystal structure model was obtained based on the X-ray diffraction data. Black-Right-Pointing-Pointer An emission of 490 nm under 334 nm excitation at room temperature was observed.

  10. Microsoft Word - P450-2A6.doc

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

    Science Highlight -November 2005 Figure 1. Stereo views of σ A -weighted 2|Fo|-|Fc| composite omit electron density maps contoured at 1σ and rendered within 1 Å of the heme and substrate for the P450 2A6 (a) coumarin or (b) methoxsalen complexes. Coumarin and methoxsalen are stabilized by hydrogen bonding with Asn297, which places the carbon atom to be oxidized 3.2 ± 0.13 Å (coumarin) or 3.8 ± 0.09 Å (methoxsalen) from the heme iron. The distances are shown as a red dotted line and the

  11. AcqGuide4.2-OPAM | Department of Energy

    Energy Savers [EERE]

    AcqGuide4.2-OPAM AcqGuide4.2-OPAM Requirements for Contracting with Public Relations Firms PDF icon AcqGuide4.2-OPAM More Documents & Publications Chapter 4 - Administrative...

  12. R&D Ex A (Rev. 3.4, 3/6/15) Exhibit A General Conditions

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

    4, 3/6/15) Exhibit A General Conditions Page 1 of 21 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1 DEFINITIONS (Aug 2012) .......................................................................................................... 3 GC-2A AUTHORIZED REPRESENTATIVES, COMMUNICATIONS AND NOTICES (Jan 2010) ........................................................................................................................................... 3 GC-3 INDEPENDENT

  13. Buildings Energy Data Book: 6.2 Electricity Generation, Transmission, and Distribution

    Buildings Energy Data Book [EERE]

    2010 Existing Capacity, by Energy Source (GW) Number of Generator Nameplate Net Summer Net Winter Plant Fuel Type Generators Capacity Capacity Capacity Coal Petroleum Natural Gas Other Gases Nuclear Hydroelectric Conventional Wind Solar Thermal and Photovoltaic Wood and Wood Derived Fuels Geothermal Other Biomass Pumped Storage Other Total Source(s): EIA, Electric Power Annual 2010, Feb. 2012, Table 1.2. 51 1.0 0.9 0.9 18,150 1,138.6 1,039.1 1,078.7 1,574 5.0 4.4 4.4 151 20.5 22.2 22.1 346 7.9

  14. Dielectric properties of <001>-oriented Ba{sub 0.6}Sr{sub 0.4}TiO{sub 3} thin films on polycrystalline metal tapes using biaxially oriented MgO/{gamma}-Al{sub 2}O{sub 3} buffer layers

    SciTech Connect (OSTI)

    Choi, W.; Kang, B.S.; Jia, Q.X.; Matias, V.; Findikoglu, A.T.

    2006-02-06

    We report the growth of <001>-oriented Ba{sub 0.6}Sr{sub 0.4}TiO{sub 3} (BST) thin films on polycrystalline Ni-alloy tapes by pulsed laser deposition using biaxially oriented, ion-beam-assisted deposited (IBAD) MgO and {gamma}-Al{sub 2}O{sub 3} buffer layers. Dielectric constant values of our BST films were up to {approx}85% of those in the epitaxial films prepared under similar conditions on single-crystal MgO substrates. No significant dispersion of the dielectric constant was observed for frequencies from 100 Hz to 1 MHz. These results demonstrate the versatility of using IBAD-textured MgO and {gamma}-Al{sub 2}O{sub 3} buffer layers to integrate highly oriented good-quality BST films with nonsingle-crystalline substrates.

  15. CROSSFLOW FILTRATION: EM-31, WP-2.3.6

    SciTech Connect (OSTI)

    Duignan, M.; Nash, C.; Poirier, M.

    2011-02-01

    In the interest of accelerating waste treatment processing, the DOE has funded studies to better understand filtration with the goal of improving filter fluxes in existing crossflow equipment. The Savannah River National Laboratory (SRNL) performed some of those studies, with a focus on start-up techniques, filter cake development, the application of filter aids (cake forming solid precoats), and body feeds (flux enhancing polymers). This paper discusses the progress of those filter studies. Crossflow filtration is a key process step in many operating and planned waste treatment facilities to separate undissolved solids from supernate solutions. This separation technology generally has the advantage of self-cleaning through the action of wall shear stress created by the flow of waste slurry through the filter tubes. However, the ability of filter wall self-cleaning depends on the slurry being filtered. Many of the alkaline radioactive wastes are extremely challenging to filtration, e.g., those containing compounds of aluminum and iron, which have particles whose size and morphology reduce permeability. Unfortunately, low filter flux can be a bottleneck in waste processing facilities such as the Savannah River Integrated Salt Disposition Process and the Hanford Waste Treatment Plant. Any improvement to the filtration rate would lead directly to increased throughput of the entire process. To date increased rates are generally realized by either increasing the crossflow filter feed flow rate, limited by pump capacity, or by increasing filter surface area, limited by space and increasing the required pump load. SRNL set up both dead-end and crossflow filter tests to better understand filter performance based on filter media structure, flow conditions, filter cleaning, and several different types of filter aids and body feeds. Using non-radioactive simulated wastes, both chemically and physically similar to the actual radioactive wastes, the authors performed several tests to evaluate methods to improve filter performance. With the proper use of filter flow conditions and filter enhancers, filter flow rates can be increased over rates currently realized today. Experiments that use non-radioactive simulants for actual waste always carry the inherent risk of not eliciting prototypic results; however, they will assist in focusing the scope needed to minimize radioactive testing and thus maximize safety. To that end this investigation has determined: (1) Waste simulant SB6 was found to be more challenging to filtration than a SRS Tank 8F simulant; (2) Higher solids concentration presents a greater challenge to filtration; (3) Filter cake is something that should be properly developed in initial filter operation; (4) Backpulsing is not necessary to maintain a good filter flux with salt wastes; (5) Scouring a filter without cleaning will lead to improved filter performance; (6) The presence of a filter cake can improve the solids separation by an order of magnitude as determined by turbidity; (7) A well developed cake with periodic scouring may allow a good filter flux to be maintained for long periods of time; and (8) Filtrate flux decline is reversible when the concentration of the filtering slurry drops and the filter is scoured.

  16. table4.2_02.xls

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

    Offsite-Produced Fuel Consumption, 2002; Level: National and Regional Data; Row: NAICS Codes; Column: Energy Sources; Unit: Trillion Btu. RSE NAICS Residual Distillate Natural LPG and Coke Row Code(a) Subsector and Industry Total Electricity(b) Fuel Oil Fuel Oil(c) Gas(d) NGL(e) Coal and Breeze Other(f) Factors Total United States RSE Column Factors: 0.8 0.8 1.1 1.6 0.9 1.8 0.7 0.7 1.2 311 Food 1,079 233 13 19 575 5 184 1 50 8 311221 Wet Corn Milling 217 24 * * 61 * 121 0 11 1.1 31131 Sugar 74

  17. Energy Department Announces up to $4.6 Million through the Fuel Cell

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

    Technologies Incubator Funding Opportunity Announcement to Support Innovations in Fuel Cell and Hydrogen Fuel Technologies | Department of Energy .6 Million through the Fuel Cell Technologies Incubator Funding Opportunity Announcement to Support Innovations in Fuel Cell and Hydrogen Fuel Technologies Energy Department Announces up to $4.6 Million through the Fuel Cell Technologies Incubator Funding Opportunity Announcement to Support Innovations in Fuel Cell and Hydrogen Fuel Technologies

  18. D E -F G 0 2 -1 0 E R 2 6 0 2 1

    Office of Scientific and Technical Information (OSTI)

    D E -F G 0 2 -1 0 E R 2 6 0 2 1 P r o je c t T itle: D etection, Localization and D iagnosis o f P erform ance Problems Using P erfS O N A R P r o je c t W eb site: h ttp ://p y th ia .g a te c h .e d u / P I: Prof. C on stan tin e D ovrolis I n s titu tio n : G eorgia Tech C heck one: [ ] 1st Annual Report (9/1/10-8/31/11) Date [ ] 2nd Annual Report Date [X] Final R ep o rt D ate April 25, 2014 U n e x p en d ed funds by end o f rep ortin g period: 0 1 O rigin al P r o p o sa l S u m m a ry

  19. Ab Initio Many-Body Calculations of Deuteron-4He Scattering And 6Li States

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect Journal Article: Ab Initio Many-Body Calculations of Deuteron-4He Scattering And 6Li States Citation Details In-Document Search Title: Ab Initio Many-Body Calculations of Deuteron-4He Scattering And 6Li States Authors: Quaglioni, S ; Navratil, P Publication Date: 2011-02-08 OSTI Identifier: 1118007 Report Number(s): LLNL-JRNL-469878 DOE Contract Number: W-7405-ENG-48 Resource Type: Journal Article Resource Relation: Journal Name: Phisical Review C, na, na,

  20. Gas-to-cluster effects in S 2p-excited SF{sub 6}

    SciTech Connect (OSTI)

    Flesch, Roman; Serdaroglu, Ertugrul; Ruehl, Eckart; Brykalova, Xenia O.; Kan, Elena I.; Klyushina, Ekaterina S.; Krivosenko, Yuri S.; Pavlychev, Andrey A.

    2013-04-14

    High resolution X-ray spectroscopic studies on free SF{sub 6} molecules and SF{sub 6} clusters near the S 2p ionization thresholds are reported. Spectral changes occurring in clusters for the intense molecular-like S 2p{sub 1/2,3/2}{yields} 6a{sub 1g}-, 2t{sub 2g}-, and 4e{sub g}-resonances are examined in detail. Neither gas-to-cluster spectral shifts nor changes in peak shape are observed for the pre-edge 6a{sub 1g}-band. Significant changes in band shape and distinct gas-to-cluster shifts occur in the S 2p{sub 1/2,3/2}{yields} 2t{sub 2g}- and 4e{sub g}-transitions. These are found in the S 2p-ionization continua. The quasiatomic approach is used to assign the experimental results. It is shown that a convolution of asymmetric and symmetric contributions from Lorentzian and Gaussian line shapes allows us to model the spectral distribution of oscillator strength for the S 2p{sub 1/2,3/2}{yields} 2t{sub 2g}-, and 4e{sub g}-transitions. The asymmetry is due to trapping of the photoelectron within the finite size potential barrier. The Lorentzian contribution is found to be dominating in the line shape of the S 2p{yields} 2t{sub 2g}- and 4e{sub g}-bands. The spectroscopic parameters of the spin-orbit components of both the 2t{sub 2g}- and 4e{sub g}-bands are extracted and their gas-to-cluster changes are analyzed. The photoelectron trapping times in free and clustered SF{sub 6} molecules are determined. Specifically, it is shown that spectral changes in clusters reflected in core-to-valence-transitions are due to a superposition of the singly scattered photoelectron waves at the neighboring molecules with the primary and multiply scattered waves within the molecular cage.

  1. Being WISE. I. Validating stellar population models and M {sub *}/L ratios at 3.4 and 4.6 μm

    SciTech Connect (OSTI)

    Norris, Mark A.; Meidt, Sharon; Van de Ven, Glenn; Schinnerer, Eva; Groves, Brent; Querejeta, Miguel

    2014-12-10

    Using data from the Wide-field Infrared Survey Explorer mission, we have measured near infra-red (NIR) photometry of a diverse sample of dust-free stellar systems (globular clusters, dwarf and giant early-type galaxies) which have metallicities that span the range -2.2 < [Fe/H] (dex) < 0.3. This dramatically increases the sample size and broadens the metallicity regime over which the 3.4 (W1) and 4.6 μm (W2) photometry of stellar populations have been examined. We find that the W1 – W2 colors of intermediate and old (>2 Gyr) stellar populations are insensitive to the age of the stellar population, but that the W1 – W2 colors become bluer with increasing metallicity, a trend not well reproduced by most stellar population synthesis (SPS) models. In common with previous studies, we attribute this behavior to the increasing strength of the CO absorption feature located in the 4.6 μm bandpass with metallicity. Having used our sample to validate the efficacy of some of the SPS models, we use these models to derive stellar mass-to-light ratios in the W1 and W2 bands. Utilizing observational data from the SAURON and ATLAS3D surveys, we demonstrate that these bands provide extremely simple, yet robust stellar mass tracers for dust free older stellar populations that are freed from many of the uncertainties common among optical estimators.

  2. Oxygen trapped by rare earth tetrahedral clusters in Nd4FeOS6: Crystal structure, electronic structure, and magnetic properties

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

    Lin, Qisheng; Taufour, Valentin; Zhang, Yuemei; Wood, Max; Drtina, Thomas; Bud’ko, Sergey L.; Canfield, Paul C.; Miller, Gordon J.

    2015-05-22

    Single crystals of Nd4FeOS6 were grown from an Fe-S eutectic solution. Single crystal X-ray diffraction analysis revealed a Nd4MnOSe6-type structure (P63mc, a = 9.2693(1) Å, c = 6.6650(1) Å, V = 495.94(1) Å3, Z = 2), featuring parallel chains of face-sharing [FeS6x1/2]4- trigonal antiprisms and interlinked [Nd4OS3]4+ cubane-like clusters. Oxygen atoms were found to be trapped by Nd4 clusters in the [Nd4OS3]4+ chains. Structural differences among Nd4MnOSe6-type Nd4FeOS6 and the related La3CuSiS7- and Pr8CoGa3-type structures have been described. Magnetic susceptibility measurements on Nd4FeOS6 suggested the dominance of antiferromagnetic interactions at low temperature, but no magnetic ordering down to 2 Kmore » was observed. Spin-polarized electronic structure calculations revealed magnetic frustration with dominant antiferromagnetic interactions.« less

  3. Unified description of 6Li structure and deuterium-4He dynamics with chiral two- and three-nucleon forces

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

    Hupin, Guillaume; Quaglioni, Sofia; Navratil, Petr

    2015-05-29

    Here, we provide a unified ab initio description of the 6Li ground state and elastic scattering of deuterium (d) on 4He (α) using two- and three-nucleon forces from chiral effective field theory. We analyze the influence of the three-nucleon force and reveal the role of continuum degrees of freedom in shaping the low-lying spectrum of 6Li. The calculation reproduces the empirical binding energy of 6Li, yielding an asymptotic D- to S-state ratio of the 6Li wave function in the d+α configuration of –0.027, in agreement with a determination from 6Li–4He elastic scattering, but overestimates the excitation energy of the 3+more » state by 350 keV. The bulk of the computed differential cross section is in good agreement with data. These results endorse the application of the present approach to the evaluation of the 2H(α,γ)6Li radiative capture, responsible for the big-bang nucleosynthesis of 6Li.« less

  4. b)(4

    National Nuclear Security Administration (NNSA)

    (b)(4) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(4) (b)(4) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(4) (b)(4) (b)(4) (b)(4) (b)(6)

  5. An Experimental and Theoretical Multi-Mbar Study of Ti-6Al-4V

    SciTech Connect (OSTI)

    Tegner, B E; Macleod, S G; CYNN, H; Proctor, J; Evans, W J; McMahon, M I; Ackland, G J

    2011-04-13

    We report results from an experimental and theoretical study of the room temperature (RT) compression of the ternary alloy Ti-6Al-4V. In this work, we have extended knowledge of the equation of state (EOS) from 40 GPa to 221 GPa, and observed a different sequence of phase transitions to that reported previously for pure Ti.

  6. Buildings Energy Data Book: 2.4 Residential Environmental Data

    Buildings Energy Data Book [EERE]

    1 Carbon Dioxide Emissions for U.S. Residential Buildings, by Year (Million Metric Tons) (1) Residential U.S. Site Res.% Res.% Fossil Electricity Total Total of Total U.S. of Total Global 1980 385 525 909 4723 19% 4.9% 1981 361 518 878 4601 19% 4.8% 1982 359 511 870 4357 20% 4.8% 1983 340 525 865 4332 20% 4.7% 1984 349 535 883 4561 19% 4.6% 1985 351 549 901 4559 20% 4.6% 1986 343 551 894 4564 20% 4.5% 1987 346 574 920 4714 20% 4.5% 1988 367 603 970 4939 20% 4.6% 1989 374 606 980 4983 20% 4.6%

  7. Monte Carlo Simulation of Electron Transport in 4H- and 6H-SiC

    SciTech Connect (OSTI)

    Sun, C. C.; You, A. H.; Wong, E. K.

    2010-07-07

    The Monte Carlo (MC) simulation of electron transport properties at high electric field region in 4H- and 6H-SiC are presented. This MC model includes two non-parabolic conduction bands. Based on the material parameters, the electron scattering rates included polar optical phonon scattering, optical phonon scattering and acoustic phonon scattering are evaluated. The electron drift velocity, energy and free flight time are simulated as a function of applied electric field at an impurity concentration of 1x10{sup 18} cm{sup 3} in room temperature. The simulated drift velocity with electric field dependencies is in a good agreement with experimental results found in literature. The saturation velocities for both polytypes are close, but the scattering rates are much more pronounced for 6H-SiC. Our simulation model clearly shows complete electron transport properties in 4H- and 6H-SiC.

  8. [PATCHED] python/2.7.4 gzip package fails

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

    PATCHED python2.7.4 gzip package fails PATCHED python2.7.4 gzip package fails September 24, 2013 by Doug Jacobsen The modules version of python (python2.7.4) had a bug in...

  9. Syntheses and characterization of the cubic uranium chalcogenides Rh2U6S15,

    Office of Scientific and Technical Information (OSTI)

    Cs2Ti2U6Se15, Cs2Cr2U6Se15, and Cs2Ti2U6Te15 (Journal Article) | DOE PAGES DOE PAGES Search Results Publisher's Accepted Manuscript: Syntheses and characterization of the cubic uranium chalcogenides Rh2U6S15, Cs2Ti2U6Se15, Cs2Cr2U6Se15, and Cs2Ti2U6Te15 This content will become publicly available on July 11, 2017 « Prev Next » Title: Syntheses and characterization of the cubic uranium chalcogenides Rh2U6S15, Cs2Ti2U6Se15, Cs2Cr2U6Se15, and Cs2Ti2U6Te15 Authors: Ward, Matthew D. ; Oh,

  10. LiveChat Wed, 6/29, 2pm: Our Energy Independence | Department of Energy

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

    6/29, 2pm: Our Energy Independence LiveChat Wed, 6/29, 2pm: Our Energy Independence June 27, 2011 - 9:29am Addthis Ginny Simmons Ginny Simmons Former Managing Editor for Energy.gov, Office of Public Affairs How can I participate? Submit a question via E-mail, Facebook or Twitter Watch live on June 29 at 2 PM ET As many of us hit the road to celebrate America's independence this upcoming 4th of July weekend, we must once again confront the reality of our country's economy, environment and

  11. Buildings Energy Data Book: 6.2 Electricity Generation, Transmission, and Distribution

    Buildings Energy Data Book [EERE]

    4 Electric Conversion Factors and Transmission and Distribution (T&D) Losses Average Utility Average Utility Growth Rate Delivery Efficiency (1, 2) Delivery Ratio (Btu/kWh) (2, 3) (2010-year) 1980 29.4% 1981 29.9% 1982 29.7% 1983 29.8% 1984 30.5% 1985 30.4% 1986 30.8% 1987 31.1% 1988 31.1% 1989 30.2% 1990 30.3% 1991 30.5% 1992 30.7% 1993 30.6% 1994 30.9% 1995 30.7% 1996 30.7% 1997 30.8% 1998 30.7% 1999 30.6% 2000 30.7% 2001 31.1% 2002 31.1% 2003 31.3% 2004 31.3% 2005 31.5% 2006 31.7% 2007

  12. Magnetic properties of double perovskite La2BMnO6 (B = Ni or Co) nanoparticles

    SciTech Connect (OSTI)

    Mao, Yuanbing; Parsons, Jason; McCloy, John S.

    2013-03-31

    Double perovskite La2BMnO6 (B = Ni and Co) nanoparticles with average particle size of ~50 nm were synthesized using a facile, environmentally friendly, scalable molten-salt reaction at 700 C in air. Their structural and morphological properties were characterized by x-ray diffraction and transmission electron microscopy. Magnetic properties were evaluated using dc magnetic M-T and M-H, and ac magnetic susceptibility versus frequency, temperature, and field. The magnetization curve shows a paramagnetic-ferromagnetic transition at TC ~275 and 220 K for La2NiMnO6 (LNMO) and La2CoMnO6 (LCMO) nanoparticles, respectively. ac susceptibility revealed that the LCMO had a single magnetic transition indicative of Co2+-O2--Mn4+ ordering, whereas the LNMO showed more complex magnetic behavior suggesting a re-entrant spin glass.

  13. Improving the osteointegration of Ti6Al4V by zeolite MFI coating

    SciTech Connect (OSTI)

    Li, Yong; Jiao, Yilai; Li, Xiaokang; Guo, Zheng

    2015-05-01

    Osteointegration is crucial for success in orthopedic implantation. In recent decades, there have been numerous studies aiming to modify titanium alloys, which are the most widely used materials in orthopedics. Zeolites are solid aluminosilicates whose application in the biomedical field has recently been explored. To this end, MFI zeolites have been developed as titanium alloy coatings and tested in vitro. Nevertheless, the effect of the MFI coating of biomaterials in vivo has not yet been addressed. The aim of the present work is to evaluate the effects of MFI-coated Ti6Al4V implants in vitro and in vivo. After surface modification, the surface was investigated using field emission scanning electron microscopy (FE-SEM) and energy dispersive spectroscopy (EDS). No difference was observed regarding the proliferation of MC3T3-E1 cells on the Ti6Al4V (Ti) and MFI-coated Ti6Al4V (M−Ti) (p > 0.05). However, the attachment of MC3T3-E1 cells was found to be better in the M−Ti group. Additionally, ALP staining and activity assays and quantitative real-time RT-PCR indicated that MC3T3-E1 cells grown on the M−Ti displayed high levels of osteogenic differentiation markers. Moreover, Van-Gieson staining of histological sections demonstrated that the MFI coating on Ti6Al4V scaffolds significantly enhanced osteointegration and promoted bone regeneration after implantation in rabbit femoral condylar defects at 4 and 12 weeks. Therefore, this study provides a method for modifying Ti6Al4V to achieve improved osteointegration and osteogenesis. - Highlights: • Osteointegration is a crucial factor for orthopedic implants. • We coated MFI zeolite on Ti6Al4V substrates and investigated the effects in vitro and in vivo. • The MFI coating displayed good biocompatibility and promoted osteogenic differentiation in vitro. • The MFI coating promoted osteointegration and osteogenesis peri-implant in vivo.

  14. Interaction of Cesium Ions with Calix[4]arene-bis(t-octylbenzo-18-crown-6): NMR and Theoretical Study

    SciTech Connect (OSTI)

    Kriz, Jaroslav; Dybal, Jiri; Vanura, Petr; Moyer, Bruce A

    2011-01-01

    Using 1H, 13C, and 133Cs NMR spectra, it is shown that calix[4]arene-bis (t-octylbenzo-18-crown-6) (L) forms complexes with one (L 3 Cs ) and two (L 3 2Cs ) Cs ions offered by cesium bis(1,2-dicarbollide) cobaltate (CsDCC) in nitrobenzene-d5. The ions interact with all six oxygen atoms in the crown-ether ring and the electrons of the calixarene aromatic moieties. According to extraction technique, the stability constant of the first complex is log nb(L 3 Cs ) = 8.8 ( 0.1. According to 133Cs NMR spectra, the value of the equilibrium constant of the second complex is log Knb (2)(L 3 2Cs ) = 6.3(0.2, i.e., its stabilization constant is log nb(L 3 2Cs ) = 15.1 ( 0.3. Self-diffusion measurements by 1H pulsed-field gradient (PFG) NMRcombined with density functional theory (DFT) calculations suggest that one DCC ion is tightly associated with L 3 Cs , decreasing its positive charge and consequently stabilizing the second complex, L 3 2Cs . Using a saturation-transfer 133Cs NMR technique, the correlation times ex of chemical exchange between L 3 Cs and L 3 2Cs as well as between L 3 2Cs and free Cs ions were determined as 33.6 and 29.2 ms, respectively.

  15. CASL Plan of Record 2 (1/11-6/11)

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

    8-2014-0231-001 VERA Problem 10: Restart and Shuffling in MPACT Revision 1 February 26, 2015 Brendan Kochunas Daniel Jabaay Thomas Downar CASL-U-2014-0231-001 L3: RTM.PRT.P9.04 - VERA Problem 10: Restart and Shuffling in MPACT Consortium for Advanced Simulation of LWRs ii REVISION LOG Revision Date Affected Pages Revision Description 0 12/4/2014 All Initial version 1 2/27/2015 All Fixed typos from copy-paste in Appendix A, added section 3.3, updated results in Section 5. Additions to Section

  16. High antiferromagnetic transition temperature of a honeycomb compound SrRu2O6

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

    Tian, Wei; Svoboda, Chris; Ochi, M.; Matsuda, M.; Cao, Huibo; Cheng, J. -G.; Sales, B. C.; Mandrus, D.; Arita, R.; Trivedi, Nandini; et al

    2015-09-14

    We study the high-temperature magnetic order in a quasi-two-dimensional honeycomb compound SrRu2O6 by measuring magnetization and neutron powder diffraction with both polarized and unpolarized neutrons. SrRu2O6 crystallizes into the hexagonal lead antimonate (PbSb2O6, space group P31m) structure with layers of edge-sharing RuO6 octahedra separated by Sr2+ ions. SrRu2O6 is found to order at TN = 565 K with Ru moments coupled antiferromagnetically both in plane and out of plane. The magnetic moment is 1.30(2) μB/Ru at room temperature and is along the crystallographic c axis in the G-type magnetic structure. We perform density functional calculations with constrained random-phase approximation (RPA)more » to obtain the electronic structure and effective intra- and interorbital interaction parameters. The projected density of states shows strong hybridization between Ru 4d and O 2p. By downfolding to the target t2g bands we extract the effective magnetic Hamiltonian and perform Monte Carlo simulations to determine the transition temperature as a function of interand intraplane couplings. We find a weak interplane coupling, 3% of the strong intraplane coupling, permits three-dimensional magnetic order at the observed TN .« less

  17. ESnet4_USA_Map_V2

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

    Network Requirements Report of the Nuclear Physics Network Requirements Workshop Conducted May 6 and 7, 2008 Nuclear Physics Network Requirements Workshop Nuclear Physics Program Office, DOE Office of Science Energy Sciences Network Bethesda, MD - May 6 and 7, 2008 ESnet is funded by the US Department of Energy, Office of Science, Advanced Scientific Computing Research (ASCR) program. Vince Dattoria is the ESnet Program Manager. ESnet is operated by Lawrence Berkeley National Laboratory, which

  18. Crystal structure and phase transition mechanisms in CsFe{sub 2}F{sub 6}

    SciTech Connect (OSTI)

    Molokeev, M.S.; Bogdanov, E.V.; Misyul, S.V.; Tressaud, A.; Flerov, I.N.

    2013-04-15

    For the first time, structural phase transitions induced by the temperature were found in A{sub x}M{sub x}{sup II}M{sub (1?x)}{sup III}F{sub 3} fluorides with the defect pyrochlore structure (Fd3{sup }m, Z=8). The room temperature structure of CsFe{sub 2}F{sub 6} was determined using X-ray powder diffraction technique. This phase was found to be ordered with the Pnma space group. The study of the temperature stability of orthorhombic structure by differential scanning calorimeter between 100 K and 700 K has shown a succession of phase transitions. The Pnma (Z=4)?Imma (Z=4)?I4{sub 1}/amd (Z=4)?Fd3{sup }m (Z=8) structural sequence was proposed to occur within a rather narrow temperature range 500560 K. The mechanism of structural transition has been mainly associated with the rotation of (MF{sub 6}) octahedra and small displacements of some Fe atoms. This assumption is in good agreement with the low experimental entropy value, which is characteristic for displacive transformations. - Graphical abstract: Mechanism of phase transition between the HT cubic form of CsFe{sub 2}F{sub 6} at 573 K (left) and the room temperature orthorhombic form at 298 K (right). The grey rectangles are clusters of five FeF{sub 6} octahedra. Highlights: ? Structural transition found for the first time in CsFe{sub 2}F{sub 6} with defect pyrochlore type. ? Fe{sup II} and Fe{sup III} atoms are ordered in room temperature Pnma form of CsFe{sub 2}F{sub 6}. ? Pnma(Z=4)?Imma(Z=4)?I4{sub 1}/amd(Z=4)?Fd-3m(Z=8) transition sequence is proposed. ? Structural transition due to rotation of MF{sub 6} groups+small displacements of Fe atoms. ? The low value of the entropy is in agreement with a displacive-type transition.

  19. RSAC 6.2 with WinRP 2.0 User Manual

    SciTech Connect (OSTI)

    Bradley Schrader

    2005-09-01

    The Radiological Safety Analysis Computer Program (RSAC-6.2) calculates the consequences of a release of radionuclides to the atmosphere. Using a personal computer, a user can generate a fission product inventory from either reactor operating history or a nuclear criticality accident. RSAC-6.2 models the effects of high-efficiency particulate air filters or other cleanup systems and calculates decay and ingrowth during transport through processes, facilities, and the environment. Doses are calculated for resuspension, inhalation, immersion, ground surface, and ingestion pathways. WinRP 2.0, a windows based overlay to RSAC-6.2, assists users in creating and running RSAC-6.2 input files. This users manual contains the mathematical models and operating instructions for RSAC-6.2 and WinRP 2.0. Instructions, screens, and examples are provided to guide the user through the functions provided by RSAC-6.2 and WinRP 2.0. These programs are designed for users who are familiar with radiological dose assessment methods.

  20. The magnetic origin of multiferroic Y{sub 2}CoMnO{sub 6}

    SciTech Connect (OSTI)

    Jia, Ting; Zeng, Zhi; Li, X. G.; Lin, H. Q.

    2015-05-07

    It has been found experimentally that the ferroelectricity in Y{sub 2}CoMnO{sub 6} is driven by a magnetic ordering of collinear up-up-down-down (↑↑↓↓). Here, the origin of the magnetism and thereby ferroelectricity is studied using first-principles calculations. We first confirm that the experimentally observed ↑↑↓↓ antiferromagnetic structure is the ground state of Y{sub 2}CoMnO{sub 6}. Additionally, both the Co{sup 2+} and Mn{sup 4+} are in the high-spin state. By analyzing the exchange coupling and corresponding pathways, we conclude that the ↑↑↓↓ spin order in Y{sub 2}CoMnO{sub 6} originates from a subtle competition between the ferromagnetic Co-O-Mn super-exchange and antiferromagnetic Co-Mn direct-exchange along c axis.

  1. CI-ON Ex A (Rev. 0.2, 6/14/13) Exhibit A General Conditions

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

    2, 6/14/13) Exhibit A General Conditions Page 1 of 12 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-A1 COMMERCIAL ITEMS (Mar 2012)............................................................................................ 2 GC-1B DEFINITIONS (Mar 2012) ......................................................................................................... 4 GC-2B CORRESPONDENCE AND SUBCONTRACT INTERPRETATION (Jan 2010) ....................... 4 GC-5 NOTICE TO

  2. Assessment of RELAP/MOD3 using BETHSY 6.2TC 6-inch cold leg side break comparative test

    SciTech Connect (OSTI)

    Chung, Young-Jong; Jeong, Jae-Jun; Chang, Won-Pyo; Kim, Dong-Su

    1996-10-01

    This report presents the results of the RELAP5/MOD3 Version 7j assessment on BETHSY 6.2TC. BETHSY 6.2TC test corresponding to a six inch cold leg break LOCA of the Pressurizer Water Reactor(PWR). The primary objective of the test was to provide reference data of two facilities of different scales (BETHSY and LSTF facility). On the other hand, the present calculation aims at analysis of RELAP5/N4OD3 capability on the small break LOCA simulation, The results of calculation have shown that the RELAP5/MOD3 reasonably predicts occurrences as well as trends of the major phenomena such as primary pressure, timing of loop seal clearing, liquid hold up, etc. However, some disagreements also have been found in the predictions of loop seal clearing, collapsed core water level after loop seal clearing, and accumulator injection behaviors. For better understanding of discrepancies in same predictions, several sensitivity calculations have been performed as well. These include the changes of two-phase discharge coefficient at the break junction and some corrections of the interphase drag term. As result, change of a single parameter has not improved the overall predictions and it has been found that the interphase drag model has still large uncertainties.

  3. CsBi4Te6: A High-Performance Thermoelectric Material for Low-Temperature

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

    Applications | Energy Frontier Research Centers CsBi4Te6: A High-Performance Thermoelectric Material for Low-Temperature Applications Home Author: D.Y. Chung, T. Hogan, P. Brazis, M. Rocci-Lane, C. Kannawurf, M. Bastea, C. Uher, M. Kanatzidis Year: 2000 Abstract: Thermoelectric (Peltier) heat pumps are capable of refrigerating solid or fluid objects, and unlike conventional vapor compressor systems, they can be miniaturized without loss of efficiency. More efficient thermoelectric materials

  4. Effect of cryogenic treatment on the plastic property of Ti-6Al-4V titanium alloy

    SciTech Connect (OSTI)

    Gu, K. X.; Wang, J. J.; Yuan, Z.; Zhang, H.; Li, Z. Q.; Zhao, B.

    2014-01-27

    The effect of cryogenic treatment on the plastic property of Ti-6Al-4V plate was studied in the present work. After cryogenic treatment, the low temperature temper at 180 ▭ was conducted in one of the groups and the results were compared with that of the untreated and cryotreated ones. The SLX series program controlled cryogenic equipment was used for the cryogenic treatment. The tensile tests were conducted by universal tensile testing machine and parameters of elongation and area reduction were used to evaluate plastic property. The scanning electron microscope was used to study the morphology of microstructure and fracture surface. The results show that after cryogenic treatment alone the elongation increased 10.6% and the area reduction increased 13.5% while the strength reduced to a small extent. Cryogenic treatment followed with low temperature temper increased the elongation and area reduction just by the extent of 4.7% and 9.5%. It means that the additional low temperature temper after cryogenic is not beneficial to the tensile properties of Ti-6Al-4V alloy. The examination of microstructure by scanning electron microscopy revealed that cryogenic treatment reduced the content of β phase particles which is the main reason for the improvement in plasticity.

  5. Criticality Safety Review of 2 1/2-, 10-, and 14-Ton UF(Sub 6) Cylinders

    SciTech Connect (OSTI)

    Broadhead, B.L.

    1991-01-01

    Currently, UF{sub 6} cylinders designed to contain 2 1/2 tons of UF{sub 6} are classified as Fissile Class II packages with a transport index (TI) of 5 for the purpose of transportation. The 10-ton UF{sub 6} cylinders are classified as Fissile Class I with no TI assigned for transportation. The 14-ton cylinders, although not certified for transport with enrichments greater than 1 wt % because they have no approved overpack, can be used in on-site operations for enrichments greater than 1 wt %. The maximum 235U enrichments for these cylinders are 5.0 wt % for the 2 1/2-ton cylinder and 4.5 wt % for the 10- and 14-ton cylinders. This work reviews the suitability for reclassification of the 2 1/2-ton UF{sub 6} packages as Fissile Class I with a maximum {sup 235}U enrichment of 5 wt %. Additionally, the 10- and 14-ton cylinders are reviewed to address a change in maximum {sup 235}U enrichment from 4.5 to 5 wt %. Based on this evaluation, the 2 1/2-ton UF{sub 6} cylinders meet the 10 CFR.71 criteria for Fissile Class I packages, and no TI is needed for criticality safety purposes; however, a TI may be required based on radiation from the packages. Similarly, the 10- and 14-ton UF{sub 6} packages appear acceptable for a maximum enrichment rating change to 5 wt % {sup 235}U.

  6. Crystal structure of Tb5Ni2In4 and Y5Ni2In4, and magnetic properties of

    Office of Scientific and Technical Information (OSTI)

    Dy5Ni2In4 (Journal Article) | SciTech Connect Crystal structure of Tb5Ni2In4 and Y5Ni2In4, and magnetic properties of Dy5Ni2In4 Citation Details In-Document Search Title: Crystal structure of Tb5Ni2In4 and Y5Ni2In4, and magnetic properties of Dy5Ni2In4 The crystal structure of the R5Ni2In4 intermetallic compounds was earlier reported for R Ho, Er, Tm, and Lu (Lu5Ni2In4-type, oP22, Pbam); more recently the isostructural phases Dy5Ni2In4 and Sc5Ni2In4 have also been identified. Three

  7. Study of the dielectric breakdown properties of hot SF{sub 6}CF{sub 4} mixtures at 0.011.6 MPa

    SciTech Connect (OSTI)

    Li, Xingwen; Zhao, Hu; Jia, Shenli; Murphy, Anthony B.

    2013-08-07

    The dielectric breakdown properties of SF{sub 6}CF{sub 4} mixtures were investigated at different ratios of SF{sub 6}, 0.011.6 MPa, and gas temperatures up to 3000 K. Initially, the equilibrium compositions of SF{sub 6}CF{sub 4} mixtures were calculated by minimizing the Gibbs free energy under the assumptions of local thermodynamic and chemical equilibrium. Then the electron energy distribution function was obtained based on those data by solving the Boltzmann equation under the zero-dimensional two-term spherical harmonic approximation. Finally, the critical reduced electric field strength (E/N){sub cr} of SF{sub 6}CF{sub 4} mixtures, which is defined as the value for which total ionization reaction is equal to total attachment reaction, were determined and analyzed. The results confirm the superior breakdown properties of pure SF{sub 6} at relatively low gas temperatures. However, for higher gas temperatures (i.e., T > 2200 K at 0.4 MPa), the (E/N){sub cr} in SF{sub 6}CF{sub 4} mixtures are obviously higher than that in pure SF{sub 6} and the values of (E/N){sub cr} increase with the reduction of the ratio of SF{sub 6}.

  8. L3:THM.CFD.P6.01 Report: Newton-Krylov Based P2 Projection Solver...

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

    ... Momentum conservation . . . . . . . . . . . . . . . . . . . . . . . . . . 6 3.3 Energy conservation . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6 3.4 Scalar transport ...

  9. Ferromagnetic superexchange in insulating Cr2MoO6 by controlling orbital hybridization

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

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

    2015-09-11

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

  10. High magnetic-refrigeration performance of plate-shaped La{sub 0.5}Pr{sub 0.5}Fe{sub 11.4}Si{sub 1.6} hydrides sintered in high-pressure H{sub 2} atmosphere

    SciTech Connect (OSTI)

    Sun, N. K. Guo, J.; Zhao, X. G. Zhang, Z. D.; Si, P. Z.; Huang, J. H.

    2015-03-02

    La(Fe, Si){sub 13} hydride is regarded as one of the most promising room-temperature refrigerants. However, to use the alloys in an active magnetic regenerator machine, it is vital to prepare thin refrigerants. In this work, a high H{sub 2} gas pressure of 50 MPa was employed to suppress the desorption of hydrogen atoms during the sintering process of plate-shaped La{sub 0.5}Pr{sub 0.5}Fe{sub 11.4}Si{sub 1.6} hydrides. At 330 K, a high-density sintered thin plate shows a large magnetic-entropy change ΔS{sub m} of 15.5 J/kg K (106 mJ/cm{sup 3 }K) for a field change of 2 T. The volumetric ΔS{sub m} is almost twice as large as that of bonded La(Fe,Si){sub 13} hydrides. Favorably, hysteresis is almost absent due to the existence of micropores with a porosity of 0.69% which has been analyzed with high-resolution X-ray microtomography.

  11. Pressure-enhanced superconductivity in Eu 3 Bi 2 S 4 F 4 (Journal...

    Office of Scientific and Technical Information (OSTI)

    Title: Pressure-enhanced superconductivity in Eu 3 Bi 2 S 4 F 4 The pressure effect on the newly discovered charge-transferred BiS2-based superconductor, Eu3Bi2S4F4, with a Tc of ...

  12. Silicon etch using SF{sub 6}/C{sub 4}F{sub 8}/Ar gas mixtures

    SciTech Connect (OSTI)

    Bates, Robert L.; Stephan Thamban, P. L.; Goeckner, Matthew J.; Overzet, Lawrence J.

    2014-07-01

    While plasmas using mixtures of SF{sub 6}, C{sub 4}F{sub 8}, and Ar are widely used in deep silicon etching, very few studies have linked the discharge parameters to etching results. The authors form such linkages in this report. The authors measured the optical emission intensities of lines from Ar, F, S, SF{sub x}, CF{sub 2}, C{sub 2}, C{sub 3}, and CS as a function of the percentage C{sub 4}F{sub 8} in the gas flow, the total gas flow rate, and the bias power. In addition, the ion current density and electron temperature were measured using a floating Langmuir probe. For comparison, trenches were etched of various widths and the trench profiles (etch depth, undercut) were measured. The addition of C{sub 4}F{sub 8} to an SF{sub 6}/Ar plasma acts to reduce the availability of F as well as increase the deposition of passivation film. Sulfur combines with carbon in the plasma efficiently to create a large optical emission of CS and suppress optical emissions from C{sub 2} and C{sub 3}. At low fractional flows of C{sub 4}F{sub 8}, the etch process appears to be controlled by the ion flux more so than by the F density. At large C{sub 4}F{sub 8} fractional flows, the etch process appears to be controlled more by the F density than by the ion flux or deposition rate of passivation film. CF{sub 2} and C{sub 2} do not appear to cause deposition from the plasma, but CS and other carbon containing molecules as well as ions do.

  13. Oxygen trapped by rare earth tetrahedral clusters in Nd4FeOS6: Crystal structure, electronic structure, and magnetic properties

    SciTech Connect (OSTI)

    Lin, Qisheng; Taufour, Valentin; Zhang, Yuemei; Wood, Max; Drtina, Thomas; Bud’ko, Sergey L.; Canfield, Paul C.; Miller, Gordon J.

    2015-05-22

    Single crystals of Nd4FeOS6 were grown from an Fe-S eutectic solution. Single crystal X-ray diffraction analysis revealed a Nd4MnOSe6-type structure (P63mc, a = 9.2693(1) Å, c = 6.6650(1) Å, V = 495.94(1) Å3, Z = 2), featuring parallel chains of face-sharing [FeS6x1/2]4- trigonal antiprisms and interlinked [Nd4OS3]4+ cubane-like clusters. Oxygen atoms were found to be trapped by Nd4 clusters in the [Nd4OS3]4+ chains. Structural differences among Nd4MnOSe6-type Nd4FeOS6 and the related La3CuSiS7- and Pr8CoGa3-type structures have been described. Magnetic susceptibility measurements on Nd4FeOS6 suggested the dominance of antiferromagnetic interactions at low temperature, but no magnetic ordering down to 2 K was observed. Spin-polarized electronic structure calculations revealed magnetic frustration with dominant antiferromagnetic interactions.

  14. An Experimental and Theoretical Study of Ti-6Al-4V to Multi-mbar Pressures

    SciTech Connect (OSTI)

    MacLeod, S G; Tegner, B E; Cynn, H; Evans, W J; Proctor, J; McMahon, M I; Ackland, G J

    2012-03-14

    We report results from an experimental and theoretical study of the ternary alloy Ti-6Al-4V to 221 GPa. We observe a phase transition to the hexagonal {omega}-phase at approximately 30 GPa, and then a further transition to the cubic {beta}-phase starting at 94-99 GPa. We do not observe the orthorhombic {gamma} and {delta} phases reported previously in pure Ti. Computational studies show that this sequence is possible only if there is significant local atomic ordering during the compression process, yet insufficient atomic diffusion to reach the phase separated thermodynamic equilibrium state.

  15. Table 6.2 Natural Gas Production, 1949-2011 (Million Cubic Feet)

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

    Natural Gas Production, 1949-2011 (Million Cubic Feet) Year Natural Gas Gross Withdrawals Repressuring Nonhydrocarbon Gases Removed Vented and Flared Marketed Production Extraction Loss 1 Dry Gas Production Natural Gas Wells Crude Oil Wells Coalbed Wells Shale Gas Wells Total 1949 4,986,126 2,560,699 NA NA 7,546,825 1,273,205 NA 853,884 5,419,736 224,332 5,195,404 1950 5,603,200 2,876,450 NA NA 8,479,650 1,396,546 NA 801,044 6,282,060 259,862 6,022,198 1951 6,481,452 3,207,920 NA NA 9,689,372

  16. 4

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

    (a) OECD ................................................. 26.64 26.43 26.81 27.07 26.77 25.86 25.72 25.93 25.96 25.99 25.83 26.15 26.74 26.07 25.98 U.S. (50 States) ............................... 14.81 15.10 15.13 15.12 14.87 14.62 14.18 14.20 14.19 14.37 14.33 14.55 15.04 14.47 14.36 Canada ............................................ 4.69 4.16 4.56 4.62 4.63 4.12 4.66 4.81 4.88 4.85 4.88 4.91 4.51 4.56 4.88 Mexico ............................................. 2.68 2.58 2.62 2.62 2.57 2.53

  17. CASL Milestone L2.VRI.P6.01

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

    ... The analytical methods of XSProc are based on methods ... of the ICE module of SCALE (SCALE User Manual Section F8). ... Analysis and Design, ORNLTM-200539, Version 6.1, Oak ...

  18. CASL Milestone L2.VRI.P6.01

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

    3.1 Protected under CASL Master NDA Official Use Only ... of the ICE module of SCALE (SCALE User Manual Section F8). ... Analysis and Design, ORNLTM-200539, Version 6.1, Oak ...

  19. EVMS Training Snippet Library: 6.2 Applied Predictive Analysis...

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

    Notes More Documents & Publications EVMS Training Snippet: 5.7 PARSII Analysis: OAPM Red Yellow Report EVMS Training Snippet: 6.1 Predictive Analysis EVMS Training Snippet: 5.1...

  20. Magnetic properties of Fe{sub 2}P-type R{sub 6}CoTe{sub 2} compounds...

    Office of Scientific and Technical Information (OSTI)

    Magnetic properties of Fesub 2P-type Rsub 6CoTesub 2 compounds (RGd-Er) Citation Details In-Document Search Title: Magnetic properties of Fesub 2P-type Rsub 6CoTesub 2 ...

  1. CESP Tool 4.2: SWOT Worksheet | Department of Energy

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

    SWOT Worksheet CESP Tool 4.2: SWOT Worksheet CESP Tool 4.2: SWOT Worksheet from Step 4: Assess the Current Energy Profile, Guide to Community Energy Strategic Planning. File CESP Tool 4.2: SWOT Worksheet More Documents & Publications CESP Tool 5.1: Goals, Strategies, and Actions Planning Worksheet Guide to Community Energy Strategic Planning Guide to Community Energy Strategic Planning: Step 4

  2. Trinity Capability Improvement v2.4

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

    Trinity C apability I mprovement M etric June 2 1, 2 013 Trinity C apability I mprovement M etric Introduction The p urpose o f t his d ocument i s t o p rovide a d etailed d escription a nd r un r ules f or the a pplications t o b e u sed f or t he T rinity C apability I mprovement ( CI) m etric. There will be three (3) applications used, o ne f rom e ach o f t he t hree N NSA laboratories: S IERRA ( SNL), P ARTISN ( LANL) a nd Q box ( LLNL). T hese a pplications were s elected a s r

  3. Pressure-enhanced superconductivity in Eu 3 Bi 2 S 4 F 4 (Journal...

    Office of Scientific and Technical Information (OSTI)

    The pressure effect on the newly discovered charge-transferred BiS2-based superconductor, Eu3Bi2S4F4, with a Tc of 1.5 K at ambient pressure, is investigated by transport and ...

  4. Microsoft Word - Chapter 4_2-10-11

    National Nuclear Security Administration (NNSA)

    ... Figure 4.3.1-1. Road Network around Y-12. 4.3.2 Electrical Power Electric power is ... precipitation (DOE 2008). In 2007 wind speeds at ORNL Tower C (MT2) measured at ...

  5. Ab-initio structure determination of {beta}-La{sub 2}WO{sub 6}

    SciTech Connect (OSTI)

    Chambrier, M-H.; Kodjikian, S.; Ibberson, R.M.; Goutenoire, F.

    2009-02-15

    The structure of the low-temperature form of {beta}-La{sub 2}WO{sub 6} has been determined from laboratory X-ray, neutron time-of-flight and electron diffraction data. This tungstate crystallizes in the non-centrosymmetric orthorhombic space group (no. 19) P2{sub 1}2{sub 1}2{sub 1}, with Z=8, a=7.5196(1) A, b=10.3476(1) A, c=12.7944(2) A, and a measured density 7.37(1) g cm{sup -3}. The structure consists of tungsten [WO{sub 6}] octahedra and tetrahedral [OLa{sub 4}]. Tungsten polyhedra are connected such that [W{sub 2}O{sub 11}]{sup 10-} units are formed. - Graphical abstract: Projection of La{sub 2}WO{sub 6} structure along [100]. The structure could be described by [W{sub 2}O{sub 11}]{sup -10} structural unit formed by two corner-sharing octahedra.

  6. Metallicity of Ca2Cu6P5 with single and double copper-pnictide layers

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

    Li, Li; Parker, David; Chi, Miaofang; Tsoi, Georgiy M.; Vohra, Yogesh K.; Sefat, Athena S.

    2016-02-16

    Here, we report thermodynamic and transport properties, and also theoretical calculations, for Cu-based compound Ca2Cu6P5 and compare with CaCu2-dP2. Both materials have layers of edge-sharing copper pnictide tetrahedral CuP4, similar to Fe–As and Fe–Se layers (with FeAs4, FeSe4) in the iron-based superconductors. Despite the presence of this similar transition-metal pnictide layer, we find that both Ca2Cu6P5 and CaCu2-δP2 have temperature-independent magnetic susceptibility and show metallic behavior with no evidence of either magnetic ordering or superconductivity down to 1.8 K CaCu2-δP2 is slightly off-stoichiometric, with δ = 0.14. Theoretical calculations suggest that unlike Fe 3d-based magnetic materials with a large densitymore » of states (DOS) at the Fermi surface, Cu have comparatively low DOS, with the majority of the 3d spectral weight located well below Fermi level. The room-temperature resistivity value of Ca2Cu6P5 is only 9 μΩ-cm, due to a substantial plasma frequency and an inferred electron-phonon coupling λ of 0.073 (significantly smaller than that of metallic Cu). Also, microscopy result shows that Cu–Cu distance along the c-axis within the double layers can be very short (2.5 Å), even shorter than metallic elemental copper bond (2.56 Å). The value of dρ/dT for CaCu2-δP2 at 300 K is approximately three times larger than in Ca2Cu6P5, which suggests the likelihood of stronger electron-phonon coupling. This study shows that the details of Cu-P layers and bonding are important for their transport characteristics. In addition, it emphasizes the remarkable character of the DOS of ‘122’ iron-based materials, despite much structural similarities.« less

  7. Structure determination of {alpha}-La{sub 6}W{sub 2}O{sub 15}

    SciTech Connect (OSTI)

    Chambrier, M-H.; Ibberson, R.M.; Goutenoire, F.

    2010-06-15

    The structure of the high temperature alpha form of La{sub 6}W{sub 2}O{sub 15} has been determined ab-initio from high temperature laboratory X-ray and neutron time-of-flight data. This tungstate crystallizes in the non-centrosymmetric orthorhombic space group (No. 20) C222{sub 1}, with Z=2, a=12.6250(2) A, b=9.1875(1) A, c=5.9688(1) A. The structure comprises [O{sub 2}La{sub 3}] infinite ribbons and is better described by the structural formula [O{sub 2}La{sub 3}]{sub 2}[WO{sub 5.5}]{sub 2}. Using this description we can understand the strong structural similarity of the present compound with compounds of the general composition BiM{sub 2}AO{sub 6} (M=Cu, Mg, Zn, Mn, Cd, Ca, Pb; A=P, As, V) described as [O{sub 2}M{sub 2}Bi][AO{sub 4}]. The [WO{sub 5.5}] entity implies oxygen disorder in the material. - Graphical abstract: Projection of the polyhedra around the tungsten atom. Atoms labelled in grey are occupied at 50%. Short oxygen-oxygen distances are marked. The polyhedra represents WO{sub 5.5} that is related to the structural unit W{sub 2}O{sub 11} unit. Alpha-La{sub 6}W{sub 2}O{sub 15} could be described as [O{sub 2}La{sub 3}]{sub 2}[WO{sub 5.5}]{sub 2}.

  8. AcqGuide4pt2.doc

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

    2 (August 2004) Requirements for Contracting with Public Relations Firms Overview This section discusses the Department of Energy's procedures when obtaining contractual services from public relations firms. Background The Office of Public Affairs is responsible for collecting and disseminating information about the Department's programs, missions, and activities. The Office of Public Affairs establishes guidelines for the review and coordination of activities for that mission. These activities

  9. CASL Plan of Record 2 (1/11-6/11)

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

    L2:AMA.P9.01 Update to Industry Test Stand Experience Using VERA Stephen M. Hess, EPRI .........1 2. Westinghouse Test Stand ......

  10. Second-harmonic generation of TEA CO2 10. 6-micrometer laser light in AgGaS2 crystals

    SciTech Connect (OSTI)

    Bangmin, Z.; Dinghua, W.

    1991-05-03

    Characteristics of AgGaS2 crystal for frequency doubling of TEA CO2 10.6 micrometer laser light were investigated. When the crystal was 4.3mm long, the maximum conversion frequency was 0.122 percent. In recent years, much progress was made in expanding the range of laser wavebands by utilizing the nonlinear effects. In the medium-infrared waveband, the CO2 laser is a relatively ideal light source and can output tens of laser spectral lines within the range 8.7 to 11.8 micrometers. With double frequency, tunable output can be obtained within the range 4.3 to 5.9 micrometers. Since the advent of CO2 lasers, researchers have conducted numerous research tasks in this area. However, since it is relatively difficult to obtain high-quality and large infrared nonlinear optical crystals, such work still remains at the laboratory research stage without practical applications.

  11. "Table HC4.6 Air Conditioning Characteristics by Renter-Occupied Housing Units, 2005"

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

    6 Air Conditioning Characteristics by Renter-Occupied Housing Units, 2005" " Million U.S. Housing Units" ,," Renter-Occupied Housing Units (millions)","Type of Renter-Occupied Housing Unit" ," Housing Units (millions)" ,,,"Single-Family Units",,"Apartments in Buildings With--" "Air Conditioning Characteristics",,,"Detached","Attached","2 to 4 Units","5 or More Units","Mobile

  12. Microsoft Word - U Isotope Report_4-8-14 to 1-6-15_Revised.docx

    Office of Legacy Management (LM)

    Rocky Flats Water Samples Collected Over the Period 4/8/14 to 1/6/15 and Submitted to LBNL John N. Christensen Report date 2/26/15 Seven surface water samples were submitted by Stoller Newport News Nuclear to Lawrence Berkeley National Laboratory for uranium (U) isotopic analysis. The samples include three composite samples from the WALPOC location; three composite samples from GS10; and one composite sample from the SW093 location. These samples were collected during the period from April 2014

  13. Molecular Simulation Studies of Separation of CO2/N2, CO2/CH4...

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

    do this, we first identified a suitable force field for describing CO2, N2, and CH4 adsorption in ZIFs. On the basis of the validated force field, adsorption selectivities of the...

  14. NCIPO Ex A (Rev. 2.1, 4/9/13) Exhibit A General Conditions

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

    1, 4/9/13) Exhibit A General Conditions Page 1 of 24 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1B DEFINITIONS (Jan 2010) .......................................................................................................... 2 GC-2B CORRESPONDENCE AND SUBCONTRACT INTERPRETATION (Jan 2010) ....................... 2 GC-6A ORDER OF PRECEDENCE (Jan 2010) ................................................................................... 2 GC-8A COMPLIANCE WITH

  15. NCIPO Ex A (Rev. 2.4, 8/20/14) Exhibit A General Conditions

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

    4, 8/20/14) Exhibit A General Conditions Page 1 of 12 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1B DEFINITIONS (Jan 2010) .......................................................................................................... 2 GC-2B CORRESPONDENCE AND SUBCONTRACT INTERPRETATION (Jan 2010) ....................... 2 GC-5 NOTICE TO PROCEED (Jul 2011) ........................................................................................... 2 GC-6A ORDER OF

  16. The 21st LH Gray Conference (June 4-6, 2008)

    SciTech Connect (OSTI)

    West, C. M.L.; Martin, C. J.; Sutton, D. G.; Wright, E. G.

    2009-01-12

    The 21st LH Gray Conference, organised by the LH Gray Trust with the Society for Radiological Protection, brought together international experts in radiobiology, epidemiology and risk assessment, and scientists involved in diagnostic and therapeutic radiation exposure. The meeting - held in Edinburgh, Scotland 4?6 June 2008 - aimed to raise awareness, educate and share knowledge of important issues in radiation protection. A distinguished group of speakers discussed topics which included: non-targeted effects of radiation, exposure to high natural background radiation, non-cancer effects in Japanese bomb survivors, lessons learnt from Chernobyl, radiation in the workplace, biokinetic modelling, uncertainties in risk estimation, issues in diagnostic medical exposures, lessons leant from the polonium-210 incidence and how the radiobiology-radiation oncology community is needed to help society prepare for potential future acts of radiation terrorism. The conference highlighted the importance, relevance and topicality of radiobiology today.

  17. Two lead(II) 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate complexes exhibiting different topologies and fluorescent properties

    SciTech Connect (OSTI)

    Chen Zilu; Yan Jiehua; Xing Huihui; Zhang Zhong; Liang Fupei

    2011-05-15

    The reactions of PbCl{sub 2} with 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid (H{sub 3}iso) gave two complexes [Pb(H{sub 2}iso){sub 2}(H{sub 2}O)]{sub n} (1) and [Pb(Hiso)(H{sub 2}O)]{sub n} (2), which were characterized by IR spectroscopy, elemental analysis, thermogravimetric analysis, powder X-ray diffraction and single crystal X-ray diffraction analysis. The two complexes display different topologies. 1 shows a three-dimensional framework with the Schlaefli symbol (4.8{sup 5})(4.8{sup 2}) no matter if the weak Pb-O bonds are included or not. However, 2 presents a 3,3-connected two-dimensional sheet with the Schlaefli symbol (4.8{sup 2})(4.8{sup 2}) based on the calculation of only the normal Pb-O bonds and a 5,5-connected 3D network with the Schlaefli symbol (4{sup 15}.6{sup 4})(4{sup 4}.6{sup 8}.8{sup 2}) when the weak Pb-O bonds are also included. The fluorescent studies reveal an emission attributed to intraligand emission for 1 and an emission assigned to LMCT for 2. -- Graphical abstract: The reactions of PbCl{sub 2} with 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid (H{sub 3}iso) gave two complexes [Pb(H{sub 2}iso){sub 2}(H{sub 2}O)]{sub n} (1) and [Pb(Hiso)(H{sub 2}O)]{sub n} (2), which display different topologies and fluorescent properties. Display Omitted Highlights: {yields} Two Pb(II) complexes were prepared from the reactions of PbCl{sub 2} with the same ligand. {yields} The two title complexes display different topologies. {yields} Both normal and weak Pb-O bonds are discussed in the manuscript.{yields} The title two complexes show different fluorescent properties.

  18. Preparation of MgH{sub 2} composite with a composition of 40%MgH{sub 2} + 30%LiBH{sub 4} + 30%(2LiBH{sub 4} + MgF{sub 2})

    SciTech Connect (OSTI)

    Hong, Seong-Hyeon; Song, Myoung Youp

    2012-09-15

    Graphical abstract: Hydrogen content vs. desorption time curves for consecutive 1st desorptions of 40 wt%MgH{sub 2} + 30 wt%LiBH{sub 4} + 30 wt%(2LiBH{sub 4} + MgF{sub 2}) at 533–873 K. Highlights: ► Addition of MgF{sub 2} and LiBH{sub 4} with a higher hydrogen storage capacity to MgH{sub 2}. ► Preparation of 40%MgH{sub 2} + 30%LiBH{sub 4} + 30% (2LiBH{sub 4} + MgF{sub 2}) composite. ► Examination of desorption properties of the composite. ► Total desorbed hydrogen quantity for consecutive 1st desorptions of 7.07 wt%. ► Reactions of LiBH{sub 4} → LiH + B + (3/2)H{sub 2}, and 2LiBH{sub 4} + MgF{sub 2} → 2LiF + MgB{sub 2} + 4H{sub 2}. -- Abstract: A mixture of containing two chemical equivalents of lithium borohyride and one equivalent of magnesium fluoride is known to yield hydrogen in an amount of about 7.6 wt% of the mixture when heated to about 150 °C at atmospheric pressure by the following reaction; 2LiBH{sub 4} + MgF{sub 2} = 2LiF + MgB{sub 2} + 4H{sub 2}. In order to increase hydrogen storage capacity of Mg-based materials, a mixture with a composition of 2LiBH{sub 4} + MgF{sub 2} and LiBH{sub 4}with a higher hydrogen storage capacity of 18.4 wt% were added to MgH{sub 2}. MgH{sub 2} composite with a composition of 40 wt%MgH{sub 2} + 30 wt%LiBH{sub 4} + 30 wt%(2LiBH{sub 4} + MgF{sub 2}) was prepared by reactive mechanical grinding. The hydrogen storage properties of the sample were then examined. Hydrogen content vs. desorption time curves for consecutive 1st desorptions of 40 wt%MgH{sub 2} + 30 wt%LiBH{sub 4} + 30 wt%(2LiBH{sub 4} + MgF{sub 2}) at 533–873 K showed that the total desorbed hydrogen quantity for consecutive 1st desorptions is 7.07 wt%.

  19. Epidemilogical Simulation System, Version 2.4

    Energy Science and Technology Software Center (OSTI)

    2004-01-30

    EpiSims uses a detailed simulation of disease spread to evaluate demographically and geographically targeted biological threat reduction strategies. Abstract: EpiSims simulates the spread of disease and analyzes the consequences of intervention strategies in a large urban area at the level of individuals. The simulation combines models of three dynamical systems: urban social networks, disease transmission, and within-host progression of a disease. Validated population mobility and activity generation technology provides the social network models, Disease modelsmore » are based on fusion of expert opinion and available data. EpiSims provides a previously unavailable detailed representation of the course of an outbreak in urban area. A letter of August 16, 2002 from the Office of Homeland Security states: "Ability of EpiSims to provide comprehensive data on daily activity patterns of individuals makes it far superior to traditional SIR models — clearly had an impact on pre-attack smallpox vaccination policy." EpiSims leverages a unique Los Alamos National Laboratory resource — the population mobility and activity data developed by TRANSIMS (Transportation Analysis and SiMulation System) — to create epidemiological analyses at an unprecedented level of detail. We create models of microscopic (individual-level) physical and biological processes from which, through simulation, emerge the macroscopic (urban regional level) quantities that are the inputs to alternative models. For example, the contact patterns of individuals in different demographic groups determine the overall mixing rates those groups. The characteristics of a person-to-person transmission together with their contact patterns determine the reproductive numbers — how many people will be infected on average by each case. Mixing rates and reproductive numbers are the basic parameters of other epidemiological models. Because interventions — and people’s reactions to them — are ultimately applied at the individual level, EpiSims is uniquely suited to evaluate their macroscopic consequences. For example, the debate over the logistics of targeted vaccination for smallpox, and thus the magnitude of the threat it poses, can best be resolved through an individual- based approach. EpiSims is the only available analytical tool using the individual-based approach that can scale to populations of a million or more without introducing ad-hoc assumptions about the nature of the social network. Impact: The first study commissioned for the EpiSims project was to analyze the effectiveness of targeted vaccination and isolation strategies in the aftermath of a covert release of smallpox at a crowded urban location. In particular we compared casualties and resources required for targeted strategies with those in the case of large-scale quarantine and/or mass vaccination campaigns. We produced this analysis in a sixty-day effort, while prototype software was still under development and delivered it to the Office of Homeland Security in June 2002. More recently, EpiSims provided casualty estimates and cost/benefit analyses for various proposed responses to an attack with pneumonic plague during the TOPOFF-2 exercise. Capabilities: EpiSims is designed to simulate human-human transmissible disease, but it is part of a suite of tools that naturally allow it to estimate individual exposures to air-borne or water-borne spread. Combined with data on animal density and mobility, EpiSims could simulate diseases spread by non-human vectors. EpiSims incorporates reactions of individuals, and is particularly powerful if those reactions are correlated with demographics. It provides a standard for modeling scenarios that cuts across agencies.« less

  20. [PATCHED] python/2.7.4 gzip package fails

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

    [PATCHED] python/2.7.4 gzip package fails [PATCHED] python/2.7.4 gzip package fails September 24, 2013 by Doug Jacobsen The modules version of python (python/2.7.4) had a bug in the default gzip python package. This was due to problems introduced in python 2.7.4 and fixed in python 2.7.5. Receiving a TypeError or structError upon opening and reading a gzip'ped file were the phenotypes of this bug. This has been corrected by installing the python 2.7.5 version of gzip.py into our python

  1. CONTINUOUS PROCESS FOR THE CONVERSION OF UF$sub 6$ TO UF$sub 4$

    DOE Patents [OSTI]

    Smiley, S.H.; Brater, D.C.; Nimmo, R.H.

    1959-10-01

    A method is presented for reducing UF/sub 6/ to UF/sub 6/ with hydrogen. A preheated mixture of UF/sub 6/ and fluorine is contacted with a stoichiometric excess of preheated hydrogen in a reaction chamber thereby producing UF/sub 6/. The UF/sub 6/ reacts quantitatively and the UF/sub 6/ produced is of high purity and high density.

  2. Magnetic Transitions in the Spin-5/2 Frustrated Magnet BiMn2PO6 and Strong Lattice Softening in BiMn2PO6 and BiZn2PO6 Below 200 K

    SciTech Connect (OSTI)

    Nath, R; Ranjith, K M; Roy, B; Johnston, D C; Furukawa, Y; Tsirlin, A A

    2014-07-01

    The crystallographic, magnetic, and thermal properties of polycrystalline BiMn2PO6 and its nonmagnetic analog BiZn2PO6 are investigated by x-ray diffraction, magnetization M, magnetic susceptibility ?, heat capacity Cp, and P31 nuclear magnetic resonance (NMR) measurements versus applied magnetic field H and temperature T as well as by density-functional band theory and molecular-field calculations. Both compounds show a strong monotonic lattice softening on cooling, where the Debye temperature decreases by a factor of two from ?D?650 K at T=300 K to ?D?300 K at T=2 K. The ?(T) data for BiMn2PO6 above 150 K follow a Curie-Weiss law with a Curie constant consistent with a Mn+2 spin S=5/2 with g factor g=2 and an antiferromagnetic (AFM) Weiss temperature ?CW??78 K. The ? data indicate long-range AFM ordering below TN?30 K, confirmed by a sharp ?-shaped peak in Cp(T) at 28.8 K. The magnetic entropy at 100 K extracted from the Cp(T) data is consistent with spin S=5/2 for the Mn+2 cations. The band-theory calculations indicate that BiMn2PO6 is an AFM compound with dominant interactions J1/kB?6.7 K and J3/kB?5.6 K along the legs and rungs of a Mn two-leg spin-ladder, respectively. However, sizable and partially frustrating interladder couplings lead to an anisotropic three-dimensional magnetic behavior with long-range AFM ordering at TN?30 K observed in the ?, Cp, and NMR measurements. A second magnetic transition at ?10 K is observed from the ? and NMR measurements but is not evident in the Cp data. The Cp data at low T suggest a significant contribution from AFM spin waves moving in three dimensions and the absence of a spin-wave gap. A detailed analysis of the NMR spectra indicates commensurate magnetic order between 10 and 30 K, while below 10 K additional features appear that may arise from an incommensurate modulation and/or spin canting. The commensurate order is consistent with microscopic density functional calculations that yield a collinear Nel-type AFM spin arrangement both within and between the ladders, despite the presence of multiple weak interactions frustrating this magnetic structure of the Mn spins. Frustration for AFM ordering and the one-dimensional spatial anisotropy of the three-dimensional spin interactions are manifested in the frustration ratio f=|?CW|/TN?2.6, indicating a suppression of TN from 68 K in the absence of these effects to the observed value of about 30 K in BiMn2PO6.

  3. Metastability in the MgAl2O4-Al2O3 System

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

    Wilkerson, Dr. Kelley R.; Smith, Jeffrey D; Hemrick, James Gordon

    2014-01-01

    Aluminum oxide must take a spinel form ( -Al2O3) at elevated temperatures in order for extensive solid solution to form between MgAl2O4 and -Al2O3. The solvus line between MgAl2O4 and Al2O3 has been dened at 79.6 wt% Al2O3 at 1500C, 83.0 wt% Al2O3 at 1600C, and 86.5 wt% Al2O3 at 1700C. A metastable region has been dened at temperatures up to 1700C which could have signicant implications for material processing and properties. Additionally, initial processing could have major implications on nal chemistry. The spinel solid solution region has been extended to form an innite solid solution with Al2O3 at elevatedmore » temperatures. A minimum in melting at 1975C and a chemistry of 96 wt% Al2O3 rather than a eutectic is present, resulting in no eutectic crystal formation during solidication.« less

  4. CASL Plan of Record 2 (1/11-6/11)

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

    ... the Standard k-e Low Re model(Re 31,577) and the 'AKN Low Re' model (Re 230,460) . ... 31, 577 230, 460 1, 023, 800 Reference Temperature (K) 3.0012E+02 2.9794E+02 2.9840E+02 ...

  5. Buildings Energy Data Book: 2.6 Residential Home Improvement

    Buildings Energy Data Book [EERE]

    4 2007 and 2009 Do-It-Yourself Home Improvements, by Project ($2010) Total Mean Total Mean Projects Expenditures Expenditures Projects Expenditures Expenditures Repair/Improvement (thousand) ($million) ($) (thousand) ($million) ($) Room Additions, Alterations, and Remodelings Kitchen Bathroom Bedroom Other Systems and Equipment Plumbing (Pipes and Fixtures) Electrical System HVAC Appliance/Major Equipment Exterior Additions and Replacements Roof Siding Windows/Doors Interior Additions and

  6. Summary of Decisions - March 2, 2015 - March 6, 2015 | Department of

    Energy Savers [EERE]

    Energy , 2015 - March 6, 2015 Summary of Decisions - March 2, 2015 - March 6, 2015 March 6, 2015 - 1:53pm Addthis No decisions were issued during this week. Addthis Related Articles Summary of Decisions - March 16, 2015 - March 20, 2015 Summary of Decisions - November 2, 2015 - November 6, 2015 Summary of Decisions - December 24, 2012 - December 28, 2012

  7. Title 14 CCR, Division 2, Chapter 4 - Development, Regulation...

    Open Energy Info (EERE)

    4 CCR, Division 2, Chapter 4 - Development, Regulation, and Conservation of Oil and Gas Resources Jump to: navigation, search OpenEI Reference LibraryAdd to library Legal Document-...

  8. b)(4

    National Nuclear Security Administration (NNSA)

    (b)(4) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(4) (b)(4) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6) (b)(6)...

  9. SSQ V1 N2_6june11_FINAL

    National Nuclear Security Administration (NNSA)

    2 2011 Comments Questions or comments regarding the Stockpile Stewardship Quarterly should be directed to Terri.Batuyong@nnsa.doe.gov Technical Editor: Douglas Drake, Publication Editor: Millicent Mischo Inside This Issue Stockpile Stewardship Quarterly Defense Programs Stockpile Stewardship in Action Volume 1, Number 2 What do physicists and paparazzi have in common? They know that a picture is worth a thousand words! For this issue of the Stockpile Stewardship Quarterly, the theme is advances

  10. Buildings Energy Data Book: 2.6 Residential Home Improvement

    Buildings Energy Data Book [EERE]

    7 2009 Home Improvement Spending by Household Income ($2010) Income Under $40,000 $40-79,999 $80-119,999 120,000 and Over Note(s): Source(s): 13,005 4,097 16,531 67,731 Home improvements include room additions, remodeling, replacements of household systems and appliances, porches and garages, additions and replacements of roofing, siding, window/doors, insulation, flooring/paneling/ceiling, and disaster repairs. Joint Center for Housing Studies of Harvard University, A New Decade of Growth for

  11. The Equation of State of LLM-105 (2,6-diamino-3,5-dinitropyrazine...

    Office of Scientific and Technical Information (OSTI)

    The Equation of State of LLM-105 (2,6-diamino-3,5-dinitropyrazine-1-oxide) Citation Details In-Document Search Title: The Equation of State of LLM-105 (2,6-diamino-3,5-dinitropyraz...

  12. NMAC 20.6.2 Ground and Surface Water Protection | Open Energy...

    Open Energy Info (EERE)

    6.2 Ground and Surface Water Protection Jump to: navigation, search OpenEI Reference LibraryAdd to library Legal Document- RegulationRegulation: NMAC 20.6.2 Ground and Surface...

  13. Broken Symmetry in the Pseudogap State of YBa2Cu3O6+x (Technical...

    Office of Scientific and Technical Information (OSTI)

    Technical Report: Broken Symmetry in the Pseudogap State of YBa2Cu3O6+x Citation Details In-Document Search Title: Broken Symmetry in the Pseudogap State of YBa2Cu3O6+x You are ...

  14. Title 18 CFR 6.2 Surrender of License | Open Energy Information

    Open Energy Info (EERE)

    Title 18 CFR 6.2 Surrender of License Jump to: navigation, search OpenEI Reference LibraryAdd to library Legal Document- RegulationRegulation: Title 18 CFR 6.2 Surrender of...

  15. Buildings Energy Data Book: 2.6 Residential Home Improvement

    Buildings Energy Data Book [EERE]

    2 2007 Professional and Do-It-Yourself Improvements, by Project ($2010) Total Mean Total Mean Projects Expenditures Expenditures Projects Expenditures Expenditures Repair/Improvement (thousand) ($million) ($) (thousand) ($million) ($) Room Additions, Alterations, and Remodelings Kitchen Bathroom Bedroom Other Systems and Equipment Plumbing (Pipes and Fixtures) Electrical System HVAC Appliance/Major Equipment Exterior Additions and Replacements Roof Siding Windows/Doors Interior Additions and

  16. ADMINISTRATIVE RECORDS SCHEDULE 4: PROPERTY DISPOSAL RECORDS (Revision 2) |

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

    Department of Energy 4: PROPERTY DISPOSAL RECORDS (Revision 2) ADMINISTRATIVE RECORDS SCHEDULE 4: PROPERTY DISPOSAL RECORDS (Revision 2) These records pertain to the sales by agencies of real and personal property surplus to the needs of the Government. PDF icon ADMINISTRATIVE RECORDS SCHEDULE 4: PROPERTY DISPOSAL RECORDS (Revision 2) More Documents & Publications PROPERTY DISPOSAL RECORDS ADMINISTRATIVE RECORDS: PROCUREMENT, SUPPLY, AND GRANT RECORDS ADMINISTRATIVE RECORDS SCHEDULE 3:

  17. ARM - VAP Product - visstgridm2rv4minnis

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

    Productsvisstvisstgridm2rv4minnis Documentation visst : XDC documentation Data Management Facility Plots (Quick Looks) ARM Data Discovery Browse Data Comments? We would love to hear from you! Send us a note below or call us at 1-888-ARM-DATA. Send VAP Output : VISSTGRIDM2RV4MINNIS VISST-derived gridded products from satellite MTSAT-2, version 4 Active Dates 2011.12.26 - 2012

  18. ARM - VAP Product - visstpx04m2rv4minnis

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

    m2rv4minnis Documentation visst : XDC documentation Data Management Facility Plots (Quick Looks) ARM Data Discovery Browse Data Comments? We would love to hear from you! Send us a note below or call us at 1-888-ARM-DATA. Send VAP Output : VISSTPX04M2RV4MINNIS VISST-derived pixel-level products from satellite MTSAT-2, version 4 Active Dates 2011.01.01 - 2014.10.31

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

    Office of Scientific and Technical Information (OSTI)

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

  20. Laser spectroscopy of the 4s4p {sup 3}P{sub 2} - 4s3d {sup 1}D{sub 2} transition on magnetically trapped calcium atoms

    SciTech Connect (OSTI)

    Dammalapati, U.; Norris, I.; Burrows, C.; Riis, E.

    2011-06-15

    Laser excitation of the 4s4p {sup 3}P{sub 2} - 4s3d {sup 1}D{sub 2} transition in atomic calcium has been observed and the wavelength determined to 1530.5298(6) nm. The metastable 4s4p {sup 3}P{sub 2} atoms were magnetically trapped in the quadrupole magnetic field of a magneto-optical trap. This state represents the only ''loss'' channel for the calcium atoms when laser cooled on the 4s{sup 2} {sup 1}S{sub 0} - 4s4p {sup 1}P{sub 1} transition. A rate equation model shows that an order of magnitude more atoms are trapped in this state compared with those taking part in the main cooling cycle. Excitation of the {sup 3}P{sub 2} atoms back up to the 4s3d {sup 1}D{sub 2} state provides a means of accessing these atoms. Efficient repumping is achieved if the 1530-nm laser is used in conjunction with a 672-nm laser driving the 4s3d {sup 1}D{sub 2} - 4s5p {sup 1}P{sub 1} transition. In the present experiment, we detected about 4.5x10{sup 4} trapped {sup 3}P{sub 2} atoms, a relatively low atom density, and measured a lifetime of approximately 1 s, which is limited by background collisions.

  1. January 6, 2014 SEAB FracFocus 2.0 Task Force Meeting

    Broader source: Energy.gov [DOE]

    SECRETARY OF ENERGY ADVISORY BOARDFRACFOCUS 2.0 TASK FORCE MEETINGJanuary 6, 20141000 Independence Avenue, SW, Washington, DC

  2. Quality Assurance Exchange October 2008 Volume 4 Issue 2

    Broader source: Energy.gov [DOE]

    Quality Assurance Exchange October 2008 Volume 4 Issue 2 U.S. Department of Energy Office of Quality Assurance Policy and Assistance

  3. CASL Plan of Record 2 (1/11-6/11)

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

    VERA Core Physics Benchmark Progression Problem Specifications Revision 2 March 29, 2013 Andrew T. Godfrey Advanced Modeling Applications Oak Ridge National Laboratory A. Godfrey, VERA Core Physics Benchmark Progression Problem Specifications, CASL Technical Report: CASL-U-2012-0131-002 VERA Core Physics Benchmark Problems CASL-U-2012-0131-002 i Consortium for Advanced Simulation of LWRs This report was prepared as an account of work sponsored by an agency of the United States government.

  4. Microsoft Word - PSRP Updates 6-25-10_v2

    Office of Environmental Management (EM)

    PART 970 - DOE MANAGEMENT AND OPERATING CONTRACTS Subpart 970.01 - Management and Operating Contract Regulatory System Sec. 970.0100 Scope of part. 970.0103 Publication and codification. Subpart 970.03 - Improper Business Practices and Personal Conflicts of Interest 970.0309 Whistleblower protection of contractor employees. 970.0309-1 Applicability. 970.0370 Management controls and improvements. 970.0370-1 Policy. 970.0370-2 Contract clause. 970.0371 Conduct of employees of DOE management and

  5. 4

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

    -4 -3 -2 -1 0 1 2 3 4 -4 -3 -2 -1 0 1 2 3 4 px x -0.006 -0.004 -0.002 0 0.002 0.004 0.006 -0.02 -0.015 -0.01 -0.005 0 0.005 0.01 0.015 0.02 px x(m) 50 100 50 100 0 10000 20000 30000 50 100

  6. STAR FORMATION AT 4 < z < 6 FROM THE SPITZER LARGE AREA SURVEY WITH HYPER-SUPRIME-CAM (SPLASH)

    SciTech Connect (OSTI)

    Steinhardt, Charles L.; Capak, Peter; Masters, Dan; Petric, Andreea; Speagle, Josh S.; Silverman, John D.; Carollo, Marcella; Dunlop, James; Hashimoto, Yasuhiro; Hsieh, Bau-Ching; Lin, Lihwai; Lin, Yen-Ting; Le Floc'h, Emeric; Lee, Nicholas; Sanders, Dave; McCracken, Henry J.; Nagao, Tohru; Salvato, Mara; and others

    2014-08-20

    Using the first 50% of data collected for the Spitzer Large Area Survey with Hyper-Suprime-Cam observations on the 1.8deg{sup 2} Cosmological Evolution Survey we estimate the masses and star formation rates of 3398 M {sub *} > 10{sup 10} M {sub ?} star-forming galaxies at 4 < z < 6 with a substantial population up to M {sub *} ? 10{sup 11.5} M {sub ?}. We find that the strong correlation between stellar mass and star formation rate seen at lower redshift (the ''main sequence'' of star-forming galaxies) extends to z ? 6. The observed relation and scatter is consistent with a continued increase in star formation rate at fixed mass in line with extrapolations from lower-redshift observations. It is difficult to explain this continued correlation, especially for the most massive systems, unless the most massive galaxies are forming stars near their Eddington-limited rate from their first collapse. Furthermore, we find no evidence for moderate quenching at higher masses, indicating quenching either has not occurred prior to z ? 6 or else occurs rapidly, so that few galaxies are visible in transition between star-forming and quenched.

  7. Mo{sub 6}Se{sub 8}-cluster-based superconducting compounds Cs{sub 2}Mo{sub 12}Se{sub 14} and Rb{sub 4}Mo{sub 18}Se{sub 20}: Evidence for a strongly correlated and anisotropic electron system

    SciTech Connect (OSTI)

    Brusetti, R.; Laborde, O.; Sulpice, A.; Calemczuk, R.; Potel, M.; Gougeon, P.

    1995-08-01

    We studied the normal and superconducting states of the title compounds by measuring the conductivity and magnetization of single crystals and powder samples. From the upper and lower critical fields we deduced the characteristic lengths and thermodynamical fields. These results are borne out by our specific-heat measurements. We recognize in these compounds many features of the Chevrel-phase superconductors, including very small coherence lengths and strong-coupling-like effects. However, we show that the electron system is much more anisotropic and still less delocalized in these materials where the Mo{sub 6}Se{sub 8} clusters have condensed in Mo{sub 6{ital n}}Se{sub 6{ital n}+2} finite chains. This condensation is accompanied by an enhancement of the magnetic response whereas the lengthening of the chains leads to a counteracting reduction of the density of carriers. This indicates that superconductivity is built upon highly correlated molecular states. Reviewing the available data on the other Chevrel-cluster-based superconductors confirms this picture and suggests that the small coherence lengths reflect the local character of the electron pairing. This comparison also shows that forming finite chains of Mo{sub 6}Se{sub 8} clusters makes the electron correlations more repulsive and pushes the electron system near the borderline between superconductivity and magnetism. In this respect these compounds could provide valuable complementary information on issues which are at the center of the research upon high-{ital Y}{sub {ital c}} superconductivity.

  8. Experimental Station 4-2 | Stanford Synchrotron Radiation Lightsource

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

    2 Beam line 4-2 is a small-angle scatteringdiffraction station dedicated to structural biology studies primarily on non-crystalline systems. The instrument covers the range of...

  9. Crystal structure of 4-[benzylideneamino]-3-thiophen-2-yl-methyl-4,5-dihydro-1H-[1,2,4] triazole-5-one

    SciTech Connect (OSTI)

    Tanak, H.

    2013-12-15

    The crystal structure of the title compound C{sub 14}H{sub 12}N{sub 4}OS was determined by the X-ray diffraction method. The compound crystallizes in the triclinic space group P-bar1 with Z = 2. The molecule is not planar: the dihedral angle between the triazole and thiophene rings is 73.98(2)°, and that between the triazole and benzene rings is 4.05(2)°. The thiophene ring is disordered over two positions, which are approximately parallel and oppositely oriented. The major component refined to a site-occupancy factor of 0.573(3). An intramolecular C-H...O hydrogen bond generates an S(6) ring motif. In the crystal, molecules are linked together by two pairs of N-H...O interactions (to the same O atom as acceptor), forming inversion dimers. The crystal packing is also stabilized by π-π interactions [centroid-centroid distance is 3.978 Å].

  10. Magnetic order in RBa/sub 2/Cu/sub 2/O/sub 6+//sub x/ (invited)

    SciTech Connect (OSTI)

    Lynn, J.W.; Li, W.

    1988-11-15

    Neutron scattering results on the RBa/sub 2/ Cu/sub 3/ O/sub 6+//sub x/ (R = rare earth) class of systems are reviewed. For the oxygen-deficient systems (x<0.5), which are semiconducting, the Cu ions are observed to order with Neel temperatures as high as 500 K. The magnetic structure consists of strong nearest-neighbor antiferromagnetic couplings of the Cu spins within the Cu-O/sub 2/ layers, while nearest-neighbor spins in adjacent layers are also aligned antiferromagnetically. The moments are constrained in the tetragonal plane. At lower temperatures the Cu moments in the oxygen-deficient ''chain'' layers also order antiferromagnetically, with a moment that can be quite substantial (approx. 1/2 ..mu../sub B/). Both transition temperatures are very sensitive to the oxygen concentration. The magnetic heavy rare-earth compounds, on the other hand, order antiferromagnetically at very low temperatures, analogous to the ''conventional'' magnetic-superconductor systems such as RMo/sub 6/ S/sub 8/ and RRh/sub 4/ B/sub 4/. The ordering is not very sensitive to the oxygen concentration, and the antiferromagnetic state coexists with superconductivity. Differences in the ordering behavior are ascribed to crystal-field effects, which are briefly discussed. Finally, small-angle neutron scattering results in the vicinity of the superconducting transition temperature are also discussed.

  11. CI-OFF Ex A (Rev. 0.2, 4/9/13) Exhibit A General Conditions

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

    2, 4/9/13) Exhibit A General Conditions Page 1 of 22 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-A1 COMMERCIAL ITEMS (Mar 2012)............................................................................................ 2 GC-1B DEFINITIONS (Mar 2012) ......................................................................................................... 4 GC-2B CORRESPONDENCE AND SUBCONTRACT INTERPRETATION (Jan 2010) ....................... 4 GC-6A ORDER OF

  12. Surface Quality of Ti-6%Al-4%V ELI When Machined Using CVD-Carbide Tools at High Cutting Speed

    SciTech Connect (OSTI)

    Gusri, A. I.; Che Hassan, C. H.; Jaharah, A. G.; Yasir, A.; Zaid, Y.; Yanuar, B.

    2011-01-17

    Machining of Ti-6Al-4V ELI becomes more interested topic due to extremely weight-to-strength ratio and resistance to corrosion at elevated temperature. Quality of machined surface is presented by surface roughness, surface texture and damages of microstructure of titanium alloys. The turning parameters evaluated are cutting speed of 55-95 m/min, feed rate of 0.15-0.35 mm/rev, depth of cut of 0.10-0.20 mm and tool grade of CVD carbide tools. The results show the trend lines of surface roughness value are higher at the initial machining and the surface texture profile has a strong correlation with the feed rate. At the machining condition of cutting speed of 95 m/min, feed rate of 0.35 mm/rev and depth of cut of 0.10 mm produced the with layer with thickness of 2.0 {mu}m.

  13. Synthesis and crystal structure of a copper complex with (E)-2-(4-(1H-1,2,4-triazol-1-yl)benzylidene)-3, 4-dihydronaphthalen-1(2H)-one ligand

    SciTech Connect (OSTI)

    Sun, Shu-Wen; Zhang, Xiao; Wang, Gao-Feng

    2015-12-15

    The title compound, C{sub 35}H{sub 23}CuF{sub 6}N{sub 3}O{sub 5}S{sub 2} (1), was synthesized by the reaction of Cu(tta){sub 2} and L{sup 1}, (L{sup 1} = (E)-2-(4-(1H-1,2,4-triazol-1-yl)benzylidene)-3, 4-dihydronaphthalen-1(2H)-one) in the dichloromethane solution. It crystallizes in the monoclinic, space group P2{sub 1}/c with a = 33.8388(5), b = 9.3874(2), c = 21.8194(4) Å, β = 95.522(2), V = 6898.9(2) Å{sup 3}, Z = 8, D{sub x} = 1.554 Mg/m{sup 3}, F(000) = 3272, µ = 0.834 mm{sup –1}, R{sub 1} = 0.0639, wR{sub 2} = 0.1637. The copper(II) ion of 1 is in a distorted square-pyramidal environment with four O atoms of the two tta ligands and one N atom of triazole ligand L{sup 1}. Single-crystal X-ray diffraction data revealed that the hydrogen bonds, weak C–H···π and π···π interactions in the crystals link the coordination units to form 3D supramolecular structures.

  14. Buildings Energy Data Book: 6.4 Electric and Generic Quad Carbon Emissions

    Buildings Energy Data Book [EERE]

    1 Emissions of Carbon Dioxide from Electric Utilities (Million Metric Tons) 1990 1,831 1991 1,830 1992 1,843 1993 1,919 1994 1,944 1995 1,960 1996 2,033 1997 2,101 1998 2,192 1999 2,204 2000 2,310 2001 2,273 2002 2,288 2003 2,319 2004 2,352 2005 2,417 2006 2,359 2007 2,426 2008 2,374 2009 2,160 2010 2,271 2011 2,240 2012 2,140 2013 2,094 2014 2,059 2015 2,039 2016 2,053 2017 2,088 2018 2,108 2019 2,130 2020 2,136 2021 2,148 2022 2,165 2023 2,189 2024 2,203 2025 2,234 2026 2,250 2027 2,270 2028

  15. Table 4

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

    ght... 16.6 0.7 3.3 5.1 2.6 1.7 1.6 1.7 8.87 Automatic Control... 18.2 0.3 2.2 4.7 3.3 2.5 2.3 2.9 8.90 High...

  16. Preparation and photocatalytic activity for water splitting of Pt-Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays

    SciTech Connect (OSTI)

    Liu, Jing; Liu, Jiawen; Li, Zhonghua

    2013-02-15

    Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays were prepared by hydrothermal method from Ta{sub 2}O{sub 5} nanotube arrays, obtained by anodization of Ta foils, in Na{sub 2}CO{sub 3} solution at 150 Degree-Sign C. The as-synthesized samples were characterized by X-ray diffraction (XRD), scanning electron microscope (SEM), UV-vis diffuse reflectance spectra (UV-DRS) and X-ray photoelectron spectroscopy (XPS). Analysis results show that pyrochlore structure Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays have been successfully fabricated. The diameters and lengths of Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays are 50 nm and 4 {mu}m, respectively. The photocatalytic hydrogen production activities of the as-synthesized Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays are highly dependent on the hydrothermal reaction time and Na{sub 2}CO{sub 3} concentration, optimized reaction parameters are obtained. To further improve the photocatalytic activity for hydrogen evolution, Pt loaded Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays are prepared by photochemical reduction method. The Pt loaded samples exhibit much higher activity for hydrogen evolution than pure Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays. Moreover, the photocatalytic hydrogen properties are rather stable. - Graphical abstract: Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays were synthesized by hydrothermal method using Ta{sub 2}O{sub 5} nanotube arrays as a precursor. The loaded Pt enhances the photocatalytic activity for water splitting of Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays. Highlights: Black-Right-Pointing-Pointer Novel Na{sub 2}Ta{sub 2}O{sub 6} nanotube array films with pyrochlore structure were synthesized. Black-Right-Pointing-Pointer Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays are active for H{sub 2} evolution from aqueous CH{sub 3}OH solution. Black-Right-Pointing-Pointer The effect of hydrothermal conditions on photocatalytic activity was investigated. Black-Right-Pointing-Pointer Pt loading can improve the photocatalytic activities of Na{sub 2}Ta{sub 2}O{sub 6} nanotube arrays. Black-Right-Pointing-Pointer Photocatalytic mechanism is proposed based on the experimental results.

  17. Structure of a Bud6/Actin Complex Reveals a Novel WH2-like Actin...

    Office of Scientific and Technical Information (OSTI)

    of a Bud6Actin Complex Reveals a Novel WH2-like Actin Monomer Recruitment Motif Citation Details In-Document Search Title: Structure of a Bud6Actin Complex Reveals a Novel ...

  18. Mixtures of SF6 CO2 as working fluids for geothermal power plants...

    Office of Scientific and Technical Information (OSTI)

    13 and 15% mole content of SF6 in a CO2- SF6 mixture for a Brayton cycle and a Rankine cycle, respectively. Authors: Yin, Hebi 1 ; Sabau, Adrian S 1 ; Conklin, Jim...

  19. Structural and conductivity studies of CsK(SO{sub 4}){sub 0.32}(SeO{sub 4}){sub 0.68}Te(OH){sub 6}

    SciTech Connect (OSTI)

    Djemel, M.; Abdelhedi, M.; Dammak, M.; Kolsi, A.W.

    2012-12-15

    The compound CsK(SO{sub 4}){sub 0.32}(SeO{sub 4}){sub 0.68}Te(OH){sub 6} crystallizes in the monoclinic P2{sub 1}/n space group. It was analyzed, at room temperature, using X-ray diffractometer data. The main feature of these atomic arrangements is the coexistence of three and different anions (SO{sub 4}{sup 2-}, SeO{sub 4}{sup 2-} and TeO{sub 6}{sup 6-}groups) in the unit cell, connected by hydrogen bonds which make the building of the crystal. The thermal analysis of the title compound shows three distinct endothermal peaks at 435, 460 and 475 K. Complex impedance measurements are performed on this material as a function of both temperature and frequency. The electric conduction has been studied. The temperature dependence on the conductivity indicates that the sample became an ionic conductor at high temperature. - Graphical abstract: Projection of crystal structure CsK(SO{sub 4}){sub 0.32}(SeO{sub 4}){sub 0.68}Te(OH){sub 6} on the ab plane. Highlights: Black-Right-Pointing-Pointer We have studied the results of the crystal structure of the new mixed compound. Black-Right-Pointing-Pointer We have characterized the phase transition observed in DSC curve. Black-Right-Pointing-Pointer The protonic conduction in our material is probably due to a hopping mechanism.

  20. Buildings Energy Data Book: 2.4 Residential Environmental Data

    Buildings Energy Data Book [EERE]

    7 2009 Methane Emissions for U.S. Residential Buildings Energy Production, by Fuel Type Fuel Type Petroleum 1.0 Natural Gas 38.8 Coal 0.0 Wood 2.6 Electricity (2) 51.6 Total 94.0 Note(s): Source(s): MMT CO2 Equivalent (1) 1) Sources of emissions include oil and gas production, processing, and distribution; coal mining; and utility and site combustion. Carbon Dioxide equivalent units are calculated by converting methane emissions to carbon dioxide emissions (methane's global warming potential is

  1. The role of the isolated 6s states in BiVO{sub 4} on the electronic and atomic structures

    SciTech Connect (OSTI)

    Ma, Jie; Wang, Lin-Wang

    2014-10-27

    BiVO{sub 4} is one of the most promising photoanodes for water-splitting applications. Similar to many d{sup 10} materials, where the full-shell d electrons are not directly involved in the bonding, the Bi 6s electrons form isolated low-energy bands in BiVO{sub 4}. By systematically altering the energy of the Bi 6s states, we find direct evidences that the isolated s states, through the s-p coupling, affect the BiVO{sub 4} properties, including valence band maximum position, charge density, and atomic structural distortion. We find that many good properties of BiVO{sub 4} for water splitting are related to the s-p coupling due to the existence of Bi 6s states. Based on this understanding, we propose that alloying Bi with Sb can enhance these properties, and hence improve the water-splitting efficiency.

  2. The Vapor Pressure of 1-(2,2,3,3-Tetrafluoropropoxy)-3-(4-sec-butylphenoxy)-2-prop anol

    SciTech Connect (OSTI)

    Steele, W.V.

    2002-01-29

    The vapor pressure of the compound 1-(2,2,3,3-tetrafluoropropoxy)-3-(4-sec-butylphenoxy)-2-propanol was measured over the temperature range 62 to 92 C using a Knudsen effusion technique. This compound, known as Cs-7SB, is the modifier component in the caustic-side solvent extraction process solvent. The vapor pressure is related to temperature by the equation ln(p/Pa) = (32.202 {+-} 0.265) - (12154 {+-} 93)/T, where p is the pressure, expressed in pascals; Pa is the reference pressure of 1 pascal; and T is the temperature, expressed in degrees kelvin. The derived heat of vaporization is 101.1 {+-} 0.8{sup kJ{center_dot}mol{sup 1} at 351 K. Because the vapor pressures over the temperature range of 15 to 50 C were lower than the design capabilities of the Knudsen effusion apparatus, the vapor pressures at these temperature limits were obtained by extrapolation. The estimated values are 4.6 {+-} 0.3E-05 (3.5 {+-} 0.2E-07 mm Hg) and 4.5 {+-} 0.1E-03 Pa (3.4 {+-} 0.1E-05 mm Hg) for 15 C and 50 C, respectively.

  3. SAPO-34 Membranes for N-2/CH4 separation: Preparation, characterization, separation performance and economic evaluation

    SciTech Connect (OSTI)

    Li, SG; Zong, ZW; Zhou, SJ; Huang, Y; Song, ZN; Feng, XH; Zhou, RF; Meyer, HS; Yu, M; Carreon, MA

    2015-08-01

    SAPO-34 membranes were synthesized by several routes towards N-2/CH4 separation. Membrane synthesis parameters including water content in the gel, crystallization time, support pore size, and aluminum source were investigated. High performance N-2-selective membranes were obtained on 100-nm-pore alumina tubes by using Al(i-C3H7O)(3) as aluminum source with a crystallization time of 6 h. These membranes separated N-2 from CH, with N-2 permeance as high as 500 GPU with separation selectivity of 8 at 24 degrees C. for a 50/50 N-2/CH4 mixture. Nitrogen and CH, adsorption isotherms were measured on SAPO-34 crystals. The N-2 and CH, heats of adsorption were 11 and 15 kJ/mol, respectively, which lead to a preferential adsorption of CE-H-4 over N-2 in the N-2/CH4 mixture. Despite this, the SAPO-34 membranes were selective for N-2 over CH4 in the mixture because N-2 diffuses much faster than CH4 and differences in diffusivity played a more critical role than the competitive adsorption. Preliminary economic evaluation indicates that the required N-2/CH4 selectivity would be 15 in order to maintain a CH4 loss below 10%. For small nitrogen-contaminated gas wells, our current SAPO-34 membranes have potential to compete with the benchmark technology cryogenic distillation for N-2 rejection. (C) 2015 Elsevier B.V. All rights reserved,

  4. Interaction of the cesium cation with calix[4]arene-bis(t-octylbenzo-18-crown-6): Extraction and DFT study

    SciTech Connect (OSTI)

    Makrlik, Emanuel; Toman, Petr; Vanura, Petr; Moyer, Bruce A

    2013-01-01

    From extraction experiments and c-activity measurements, the extraction constant corresponding to the equilibrium Cs+ (aq) + I (aq) + 1 (org),1Cs+ (org) + I (org) taking place in the two-phase water-phenyltrifluoromethyl sulfone (abbrev. FS 13) system (1 = calix[4]arene-bis(t-octylbenzo-18-crown-6); aq = aqueous phase, org = FS 13 phase) was evaluated as logKex (1Cs+, I) = 2.1 0.1. Further, the stability constant of the 1Cs+ complex in FS 13 saturated with water was calculated for a temperature of 25 C: log borg (1Cs+) = 9.9 0.1. Finally, by using quantum mechanical DFT calculations, the most probable structure of the cationic complex species 1Cs+ was derived. In the resulting 1Cs+ complex, the central cation Cs+ is bound by eight bond interactions to six oxygen atoms of the respective 18-crown-6 moiety and to two carbons of the corresponding two benzene rings of the parent ligand 1 via cation p interaction.

  5. Alkali metal cation complexation by 1,3-alternate, mono-ionisable calix[4]arene-benzocrown-6 compounds

    SciTech Connect (OSTI)

    Surowiec, Malgorzata A.; Custelcean, Radu; Surowiec, Kazimierz; Bartsch, Richard A.

    2014-04-23

    Alkali metal cation extraction behavior for two series of 1,3-alternate, mono-ionizable calix[4]arene-benzocrown-6 compounds is examined. In Series 1, the proton-ionizable group is a substituent on the benzo group of the polyether ring that directs it away from the crown ether cavity. In Series 2, the proton-ionizable group is attached to one para position in the calixarene framework, thus positioning it over the crown ether ring. Competitive solvent extraction of alkali metal cations from aqueous solutions into chloroform shows high Cs+ efficiency and selectivity. Single-species extraction pH profiles of Cs+ for Series 1 and 2 ligands with the same proton-ionizable group are very similar. Thus, association of Cs+ with the calixcrown ring is more important than the the proton-ionizable group’s position in relation to the crown ether cavity. Solid-state structures are presented for two unionized ligands from Series 2, as is a crystal containing two different ionized ligand–Cs+ complexes.

  6. Alkali metal cation complexation by 1,3-alternate, mono-ionisable calix[4]arene-benzocrown-6 compounds

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

    Surowiec, Malgorzata A.; Custelcean, Radu; Surowiec, Kazimierz; Bartsch, Richard A.

    2014-04-23

    Alkali metal cation extraction behavior for two series of 1,3-alternate, mono-ionizable calix[4]arene-benzocrown-6 compounds is examined. In Series 1, the proton-ionizable group is a substituent on the benzo group of the polyether ring that directs it away from the crown ether cavity. In Series 2, the proton-ionizable group is attached to one para position in the calixarene framework, thus positioning it over the crown ether ring. Competitive solvent extraction of alkali metal cations from aqueous solutions into chloroform shows high Cs+ efficiency and selectivity. Single-species extraction pH profiles of Cs+ for Series 1 and 2 ligands with the same proton-ionizable groupmore » are very similar. Thus, association of Cs+ with the calixcrown ring is more important than the the proton-ionizable group’s position in relation to the crown ether cavity. Solid-state structures are presented for two unionized ligands from Series 2, as is a crystal containing two different ionized ligand–Cs+ complexes.« less

  7. HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3...

    Office of Scientific and Technical Information (OSTI)

    ...6Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel Citation Details In-Document Search Title: HRTEM Study of Oxide Nanoparticles in 16Cr-4Al-2W-0.3Ti-0.3Y2O3 ODS Steel You are accessing a ...

  8. Labeled ALPHA4BETA2 ligands and methods therefor

    DOE Patents [OSTI]

    Mukherjee, Jogeshwar; Pichika, Ramaiah; Potkin, Steven; Leslie, Frances; Chattopadhyay, Sankha

    2013-02-19

    Contemplated compositions and methods are employed to bind in vitro and in vivo to an .alpha.4.beta.2 nicotinic acetylcholine receptor in a highly selective manner. Where such compounds are labeled, compositions and methods employing such compounds can be used for PET and SPECT analysis. Alternatively, and/or additionally contemplated compounds can be used as antagonists, partial agonists or agonists in the treatment of diseases or conditions associated with .alpha.4.beta..beta.2 dysfunction.

  9. SSQ V2 N4_Final_28feb13.indd

    National Nuclear Security Administration (NNSA)

    4 * February 2013 Message from the Assistant Deputy Administrator for Stockpile Stewardship, Chris Deeney Defense Programs Stockpile Stewardship in Action Volume 2, Number 4 Inside this Issue 2 Accounting for Energy Changes in Hydro- dynamic Mixing: The Role of Enthalpy Diffusion 3 Fracture Model for Beryllium and Other Materials 5 Nuclear Plasma Interactions on the National Ignition Facility 7 Knudsen Layer Reduction of Fusion Reactivity 9 Awards and Highlights A number of years ago, Dr.

  10. Extraction of Cesium by a Calix[4]arene-Crown-6 Ether Bearing a Pendant amine Group

    SciTech Connect (OSTI)

    Harmon, Ben; Ensor, Dale; Delmau, Laetitia Helene; Moyer, Bruce A

    2007-01-01

    The goal of this work was to evaluate the role of the amino group of 5-aminomethylcalix[4]arene-[bis-4-(2-ethylhexyl)benzo-crown-6] (AMBEHB) in the extraction of cesium from acidic and basic mixtures of sodium nitrate and other concentrated salts. The extraction of cesium from nitrate media was measured as a function of extractant concentration, nitrate concentration, cesium concentration, and pH over the range 1-13. The initial studies showed a moderate decrease in the extraction of cesium in acidic media, which indicated the binding of cesium by the calixarene-crown was weakened by the protonation of the amine group. The results also indicated that a 1:1:1 Cs-ligand-nitrate complex is formed in the organic phase. To further evaluate AMBEHB, the empirical data were mathematically modeled to determine the formation constants of the complexes formed in the organic phase. The resulting formation constants showed that the attachment of the amine group to the calixarene-crown molecule reduced the binding stability for the cesium ion upon contact with an acidic solution. This supports the hypothesis of charge repulsion as the basis for more efficient stripping of cesium via pH-switching.

  11. Worker Safety and Health Training at Hanford - May 2-6, 2016 | Department

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

    of Energy Hanford - May 2-6, 2016 Worker Safety and Health Training at Hanford - May 2-6, 2016 March 17, 2016 - 11:59am Addthis Worker Safety and Health Training at Hanford - May 2-6, 2016 Worker Safety and Health Program Implementation Assistance - Worker Safety and Health Training at Hanford: On May 2-6, the Office of Worker Safety and Health Policy will provide OSHA 30-hour General Industry outreach training to 30 individuals at Hanford. Site participants will include DOE employees from

  12. Microsoft Word - PSRP Updates 6-25-10_v2 | Department of Energy

    Office of Environmental Management (EM)

    of Environmental Management Non-Defense Environmental Cleanup The Office of Environmental Management (EM) Defense Environmental Cleanup Microsoft Word - PSRP Updates 6-25-10v2...

  13. Minimal unitary representation of 5d superconformal algebra F(4) and AdS6/CFT5 higher spin (super)-algebras

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

    Fernando, Sudarshan; Gnaydin, Murat

    2014-11-28

    We study the minimal unitary representation (minrep) of SO(5, 2), obtained by quantization of its geometric quasiconformal action, its deformations and supersymmetric extensions. The minrep of SO(5, 2) describes a massless conformal scalar field in five dimensions and admits a unique deformation which describes a massless conformal spinor. Scalar and spinor minreps of SO(5, 2) are the 5d analogs of Diracs singletons of SO(3, 2). We then construct the minimal unitary representation of the unique 5d supercon-formal algebra F(4) with the even subalgebra SO(5, 2) SU(2). The minrep of F(4) describes a massless conformal supermultiplet consisting of two scalar andmoreone spinor fields. We then extend our results to the construction of higher spin AdS6/CFT5 (super)-algebras. The Joseph ideal of the minrep of SO(5, 2) vanishes identically as operators and hence its enveloping algebra yields the AdS6/CFT5 bosonic higher spin algebra directly. The enveloping algebra of the spinor minrep defines a deformed higher spin algebra for which a deformed Joseph ideal vanishes identically as operators. These results are then extended to the construction of the unique higher spin AdS6/CFT5 superalgebra as the enveloping algebra of the minimal unitary realization of F(4) obtained by the quasiconformal methods.less

  14. Solvent extraction of Li+, H3O+ and NH4+ into nitrobenzene by using sodium dicarbollylcobaltate and calix[4]arene-bis(t-octylbenzo-18-crown-6)

    SciTech Connect (OSTI)

    Makrlik, Emanuel; Selucky, P.; Vanura, Petr; Moyer, Bruce A

    2013-01-01

    From extraction experiments and c-activity measurements, the exchange extraction constants corresponding to the general equilibrium M+ (aq) + NaL+ (nb) , ML+ (nb) + Na+ (aq) taking place in the two-phase water nitrobenzene system (M+ = Li+, H3O+, NH+4; L = calix[4]arene-bis(t-octylbenzo-18-crown-6); aq = aqueous phase, nb = nitrobenzene phase) were evaluated. Furthermore, the stability constants of the ML+ complexes in nitrobenzene saturated with water were calculated; they were found to increase in the following cation order: zH3O+ < Li+ < NH+4.

  15. SYSTEM FOR CONVERSION OF UF$sub 4$ TO UF$sub 6$

    DOE Patents [OSTI]

    Brater, D.G.; Pike, J.W.

    1958-12-01

    Method and apparatus are presented for rapid and complete conversion of solid, powdered uranium tetrafiuorlde to uranlum hexafluorlde by treating the UF/ sub 4/ with fluorine gas at a temperature of about 800 icient laborato C.

  16. Crystal structure of Tb5Ni2In4, and magnetic properties of Dy5Ni2In4...

    Office of Scientific and Technical Information (OSTI)

    SciTech Connect Search Results Journal Article: Crystal structure of Tb5Ni2In4, and ... DOE Contract Number: DE-AC02-07CH11358 Resource Type: Journal Article Resource Relation: ...

  17. The rare earth silicon phosphides LnSi{sub 2}P{sub 6} (Ln = La, Ce, Pr, and Nd)

    SciTech Connect (OSTI)

    Kaiser, P.; Jeitschko, W.

    1996-07-01

    The title compounds were prepared in well-crystallized form from a tin flux and their crystal structure was determined from single-crystal diffractometer data of LaSi{sub 2}P{sub 6}: Cmc2{sub 1}, a = 1012.9(3) pm, b = 2817.5(7) pm, c = 1037.4(5) pm, Z = 16, R = 0.034 for 3303 structure factors and 181 variable parameters. The structure of the isotypic compound CeSi{sub 2}P{sub 6} was also refined from single-crystal X-ray data: a = 1011.8(4) pm, b = 2803.1(8) pm, c = 1031.1(4) pm, R = 0.035 for 2132 F values and 181 variables. The silicon and the phosphorus atoms could be distinguished by comparing their occupancy parameters obtained from both structure refinements. The assignments agree with those deduced by structure-chemical arguments. These atoms form a three-dimensionally infinite framework polyanion, which accommodates four different kinds of rare earth atoms: three with nine and one with ten phosphorus neighbors. The silicon atoms are all in tetrahedral phosphorus coordination. There are phosphorus atoms which have only two rare earth and two silicon neighbors, but most phosphorus atoms have--in addition to the rare earth and silicon atoms--phosphorus neighbors, thus forming P{sub 3}, P{sub 4}, P{sub 5}, and P{sub 6} units. Using oxidation numbers, the compounds can be rationalized with the formulas Ln{sup 3+}(Si{sub 2}P{sub 6}){sub 3-} and Ln{sup 3+}(Si{sup 4+}){sub 2}(P{sub 6}){sup 11-}, where the octet rule is obeyed for the silicon and phosphorus atoms and two electrons are counted for each Si-P and P-P interaction.

  18. Materials Data on CaH20C4S4(NO6)2 (SG:2) 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

  19. Materials Data on CdH20C4S4(NO6)2 (SG:2) 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. app_c6

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

    6 Project Information C.6-iii DOE/EIS-0287 Idaho HLW & FD EIS TABLE OF CONTENTS Section Page Appendix C.6 Project Information C.6-1 C.6.1 Projects and Facilities Associated with the Alternatives C.6-1 C.6.1.1 No Action Alternative C.6-1 C.6.1.2 Continued Current Operations Alternative C.6-1 C.6.1.3 Separations Alternative C.6-1 C.6.1.4 Non-Separations Alternative C.6-10 C.6.1.5 Minimum INEEL Processing Alternative C.6-14 C.6.1.6 Direct Vitrification Alternative C.6-14 C.6.1.7 Facility

  1. Adhesion evaluation of TiN and (Ti, Al)N coatings on titanium 6Al-4V

    SciTech Connect (OSTI)

    James, R.D.; Gruss, K.A.; Horie, Y.; Davis, R.F.; Paisley, D.L.; Parthasarthi, S.; Tittmann, B.R.

    1996-12-31

    The metallic components of gas turbine engines are continually subjected to hostile atmospheres. Nitride coatings improve the performance of the metallic compressor blades in these engines. To assess the adhesion of nitride coatings on metals, titanium 6% aluminum 4% vanadium substrates were coated with titanium nitride (TiN) using both cathodic arc and electron beam evaporation. Titanium aluminum nitride ((Ti, Al)N) was also deposited using cathodic arc evaporation. The interfaces of the coated samples were loaded in tension using a high speed shock wave which caused spallation either at the interface, in the coating or in the metal. Scanning acoustic microscopy analysis of the spalled samples detected delaminations at the interface in the samples deposited by cathodic arc evaporation. DYNA2D modeling of plate impact spallation experiments revealed the tensile adhesion strength for TiN deposited by both techniques was {approx} 2.0 GPa. The tensile adhesion strength for (Ti, Al)N was less than 1.5 GPa.

  2. Method for preparation of 7-hydroxy-1,2,3,4-tetrahydroquinoline from 1,2,3,4-tetrahydroquinoline

    DOE Patents [OSTI]

    Field, George; Hammond, Peter R.

    1994-01-01

    Methods for the efficient preparation of 7-hydroxy-1,2,3,4-tetrahydroquinoline include a first method in which the acylation of m-aminophenol obtains a lactam which is reduced to give the desired quinoline and a second method in which tetrahydroquinoline is nitrated and hydrogenated and then hydrolyzed to obtain the desire quinoline. 7-hydroxy-1,2,3,4-tetrahydroquinoline is used in the efficient synthesis of four lasing dyes of the rhodamine class.

  3. Method for preparation of 7-hydroxy-1,2,3,4-tetrahydroquinoline from 1,2,3,4-tetrahydroquinoline

    DOE Patents [OSTI]

    Field, G.; Hammond, P.R.

    1994-02-01

    Methods for the efficient preparation of 7-hydroxy-1,2,3,4-tetrahydroquinoline include a first method in which the acylation of m-aminophenol obtains a lactam which is reduced to give the desired quinoline and a second method in which tetrahydroquinoline is nitrated and hydrogenated and then hydrolyzed to obtain the desire quinoline. 7-hydroxy-1,2,3,4-tetrahydroquinoline is used in the efficient synthesis of four lasing dyes of the rhodamine class.

  4. Combustion Properties of Amino-Substituted Guanidinium 4,4',5,5'-Tetranitro-2,2'-biimidazolate(N4BIM) Salts

    SciTech Connect (OSTI)

    Tappan, Bryce C.; Chavez, David E.

    2014-12-02

    This paper describes the combustion properties of the amino-substituted guanidinium 4,4,5,5-tetranitro-2,2-biimidazolate (N4BIM) series, including the bis-mono, di and triaminoguanidinium salts. These salts are of interest as propellant ingredient additives, and in particular, the bis-triaminoguanidinium salt of N4BIM displays excellent burn rate and combustion behavior. Our combustion studies have shown that TAGN4-BIM displays a fast burning rate and has the lowest pressure dependence exponent yet measured for a triaminoguanidinium salt.

  5. Combustion Properties of Amino-Substituted Guanidinium 4,4',5,5'-Tetranitro-2,2'-biimidazolate(N4BIM) Salts

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

    Tappan, Bryce C.; Chavez, David E.

    2014-12-02

    This paper describes the combustion properties of the amino-substituted guanidinium 4,4’,5,5’-tetranitro-2,2’-biimidazolate (N4BIM) series, including the bis-mono, di and triaminoguanidinium salts. These salts are of interest as propellant ingredient additives, and in particular, the bis-triaminoguanidinium salt of N4BIM displays excellent burn rate and combustion behavior. Our combustion studies have shown that TAGN4-BIM displays a fast burning rate and has the lowest pressure dependence exponent yet measured for a triaminoguanidinium salt.

  6. Impedance studies of the thin film LiMn2O4/electrolyteinterface

    SciTech Connect (OSTI)

    Striebel, Kathryn A.; Sakai, E.; Cairns, Elton J.

    2001-04-07

    Room-temperature impedance measurements of a thin-film LiMn2O4/LiPF6-EC-DMC interface have been used to identify the spontaneous formation Li2Mn2O4 at the interface at room temperature at voltages of 3.7 and higher. The impedance of the LiMn2O4 films exhibited two time constants: at about 14 kHz and 60 to 200 Hz. The high frequency loop is dependent on film morphology and was attributed to the substrate/oxide interface. The low frequency behavior was dependent on both state-of-charge (SOC) and time at a given SOC. At full charge the impedance in this electrolyte was stable at room temperature over several days. At high lithium contents, film OCV and impedance tended to grow logarithmically with time, with lower rates for lower Mn3+ content in the film. The increased impedance was removed by oxidation of the film to 4.5V vs. Li/Li+. The observations are consistent with a reversible disproportionation of part of the LiMn2O4 into Li2Mn2O4 and a lithium-deficient spinel. With extended constant current cycling part of the Li2Mn2O4 degrades to the Mn2O3 and the process is no longer reversible.

  7. Microsoft PowerPoint - Boice NEAC Dec 6 2012 rev4 [Compatibility Mode]

    Energy Savers [EERE]

    Nuclear Energy Advisory Committee 6 December 2012 - Washington, D.C. NCRP d th Milli W k St d NCRP and the Million Worker Study John D Boice Jr National Council on Radiation Protection and Measurements (NCRP) ( ) Vanderbilt University, Dept of Medicine John.Boice@ncrponline.org http://NCRPonline.org Outline NCRP Million U.S. Radiation Worker and Veteran Study  DOE Manhattan Project Workers  NRC Nuclear Utility Workers  DOD Atomic Veteran  Medical Workers Opportunities National

  8. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.2.9

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.2.9 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  9. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.1.2

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.1.2 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  10. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.2.7

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.2.7 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  11. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.2.8

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.2.8 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  12. Building Technologies Program: Tax Deduction Qualified Software- TRACE 700 version 6.2.5

    Broader source: Energy.gov [DOE]

    Provides required documentation that TRACE 700 version 6.2.5 meets Internal Revenue Code §179D, Notice 2006-52, dated June 2, 2006, for calculating commercial building energy and power cost savings.

  13. Summary of Decisions - June 2, 2014 - June 6, 2014 | Department of Energy

    Energy Savers [EERE]

    2, 2014 - June 6, 2014 Summary of Decisions - June 2, 2014 - June 6, 2014 June 6, 2014 - 8:42am Addthis Personnel Security (10 CFR Part 710) On June 5, 2014, an OHA Administrative Judge issued a decision in which he concluded that an individual's security clearance should not be restored. The individual was originally granted access authorization following a favorable administrative review decision in 2004. Prior to the 2004 hearing, the individual had been twice convicted of Boating Under the

  14. Table 4

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

    ... 17.2 8.7 15.2 18.5 20.6 17.6 18.9 17.8 8.25 Automatic Control... 18.8 4.4 10.1 17.0 26.2 25.9 28.2 31.2 8.37 High...

  15. Metabolism of bilirubin by human cytochrome P450 2A6

    SciTech Connect (OSTI)

    Abu-Bakar, A'edah; Arthur, Dionne M.; Cooperative Research Centre for Contamination Assessment and Remediation of the Environment, Adelaide ; Wikman, Anna S.; Department of Pharmaceutical Biosciences, Uppsala University, SE-75123 Uppsala ; Rahnasto, Minna; Juvonen, Risto O.; Vepslinen, Jouko; Raunio, Hannu; Ng, Jack C.; Cooperative Research Centre for Contamination Assessment and Remediation of the Environment, Adelaide ; Lang, Matti A.

    2012-05-15

    The mouse cytochrome P450 (CYP) 2A5 has recently been shown to function as hepatic Bilirubin Oxidase (Abu-Bakar, A., et al., 2011. Toxicol. Appl. Pharmacol. 257, 1422). To date, no information is available on human CYP isoforms involvement in bilirubin metabolism. In this paper we provide novel evidence for human CYP2A6 metabolising the tetrapyrrole bilirubin. Incubation of bilirubin with recombinant yeast microsomes expressing the CYP2A6 showed that bilirubin inhibited CYP2A6-dependent coumarin 7-hydroxylase activity to almost 100% with an estimated K{sub i} of 2.23 ?M. Metabolite screening by a high-performance liquid chromatography/electrospray ionisation mass spectrometry indicated that CYP2A6 oxidised bilirubin to biliverdin and to three other smaller products with m/z values of 301, 315 and 333. Molecular docking analyses indicated that bilirubin and its positively charged intermediate interacted with key amino acid residues at the enzyme's active site. They were stabilised at the site in a conformation favouring biliverdin formation. By contrast, the end product, biliverdin was less fitting to the active site with the critical central methylene bridge distanced from the CYP2A6 haem iron facilitating its release. Furthermore, bilirubin treatment of HepG2 cells increased the CYP2A6 protein and activity levels with no effect on the corresponding mRNA. Co-treatment with cycloheximide (CHX), a protein synthesis inhibitor, resulted in increased half-life of the CYP2A6 compared to cells treated only with CHX. Collectively, the observations indicate that the CYP2A6 may function as human Bilirubin Oxidase where bilirubin is potentially a substrate and a regulator of the enzyme. -- Highlights: ? Human CYP2A6 interacts with bilirubin with a high affinity. ? Bilirubin docking to the CYP2A6 active site is more stable than biliverdin docking. ? Recombinant CYP2A6 microsomes metabolised bilirubin to biliverdin. ? Bilirubin increased the hepatic CYP2A6 protein and activity levels but not mRNA. ? Co-treatment with a protein synthesis inhibitor prolongs CYP2A6 half-life.

  16. PRODUCTIOR"OF TRORI~JW~IETALIWES PROCESS F6R RB)IJCIRO T&Old 2 ':

    Office of Legacy Management (LM)

    PRODUCTIOR"OF TRORI~JW~IETALIWES PROCESS F6R RB)IJCIRO T&Old 2 ': am wm ..,. :I.::. ? ; \: :.:, .,, : ,. / 1. ..ri:,:,.:, :/ I 8yblBOLa PPaJPT i: >. ,,;.;~:,,; ,;.. !,., ,ip; ,,,:. ;., -. , ^ , . . 3 '>) ! .,:<;:,,..,. ; : :..,, ,,.+ -../ ,:,; I,:;?: ..: : ,, ,,: ; !. (' '; ::, Durine,~~~v%eit'to Amae &8Htate~Coliegd on Mar6h 4 and 2 to dl&ni& prinalpally~~asl~~prd~ess~~~1 also r&&&d wltlvDii 8. Wilhelm and Dr. D. Peterson of An~?e Iowa State College

  17. Preliminary evaluation of SF/sub 6/ conversion to SO/sub 2/ using existing chemical processing facilities

    SciTech Connect (OSTI)

    Reiner, R.H.; VanLaethem, L.M.; Partin, H.B.

    1984-06-01

    Conversion of SF/sub 6/ to SO/sub 2/ has been demonstrated using equipment compatible with existing pilot plant facilities. However, while reduction of SF/sub 6/ to iron sulfide has been demonstrated as an efficient, economic, and scalable process operation, oxidation of the sulfide to SO/sub 2/ causes serious compatibility problems in existing (and commonly used) reactor materials. Further characterization of the sulfide oxidation is necessary to determine the usefulness of this conversion process. 13 refs., 4 tabs.

  18. Crystal structure of 3,4-dihydroxy-2-butanone 4-phosphate synthase of riboflavin biosynthesis

    SciTech Connect (OSTI)

    Liao, D.-I.; Calabrese, J.C.; Wawrzak, Z.; Viitanen, P.V.; Jordan, D.B.

    2010-03-05

    3,4-Dihydroxy-2-butanone-4-phosphate synthase catalyzes a commitment step in the biosynthesis of riboflavin. On the enzyme, ribulose 5-phosphate is converted to 3,4-dihydroxy-2-butanone 4-phosphate and formate in steps involving enolization, ketonization, dehydration, skeleton rearrangement, and formate elimination. The enzyme is absent in humans and an attractive target for the discovery of antimicrobials for pathogens incapable of acquiring sufficient riboflavin from their hosts. The homodimer of 23 kDa subunits requires Mg{sup 2+} for activity. The first three-dimensional structure of the enzyme was determined at 1.4 {angstrom} resolution using the multiwavelength anomalous diffraction (MAD) method on Escherichia coli protein crystals containing gold. The protein consists of an {alpha} + {beta} fold having a complex linkage of {beta} strands. Intersubunit contacts are mediated by numerous hydrophobic interactions and three hydrogen bond networks. A proposed active site was identified on the basis of amino acid residues that are conserved among the enzyme from 19 species. There are two well-separated active sites per dimer, each of which comprise residues from both subunits. In addition to three arginines and two threonines, which may be used for recognizing the phosphate group of the substrate, the active site consists of three glutamates, two aspartates, two histidines, and a cysteine which may provide the means for general acid and base catalysis and for coordinating the Mg{sup 2+} cofactor within the active site.

  19. Webinar August 6: H2 Refuel H-Prize Safety Guidance | Department of Energy

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

    August 6: H2 Refuel H-Prize Safety Guidance Webinar August 6: H2 Refuel H-Prize Safety Guidance August 3, 2015 - 1:11pm Addthis The Fuel Cell Technologies Office will present a live webinar entitled "H2 Refuel H-Prize Safety Guidance" on Thursday, August 6, from 1 to 2 p.m. Eastern Daylight Time. Safe practices for the production, storage, distribution, and use of hydrogen are essential to establish public confidence and for reducing barriers to widespread acceptance of hydrogen

  20. January 6, 2014 SEAB FracFocus 2.0 Task Force Meeting Minutes | Department

    Energy Savers [EERE]

    of Energy January 6, 2014 SEAB FracFocus 2.0 Task Force Meeting Minutes January 6, 2014 SEAB FracFocus 2.0 Task Force Meeting Minutes The SEAB FracFocus 2.0 Task Force, chaired by John Deutch, held its first meeting on January 6, 2014. The Task Force is charged with reviewing how FracFocus 2.0 houses the information Federal and State regulatory agencies require as part of their regulatory functions with regard to disclosure of the composition and quantities of fracturing fluids injected into

  1. Microsoft Word - BTO_MYPP_Oct6_Draft For RFI Release_v4

    Energy Savers [EERE]

    B U I L D I N G T E C H N O L O G I E S O F F I C E Multi-Year Program Plan PRELIMINARY DRAFT B T O M u l t i - Y e a r P r o g r a m P l a n DRAFT - DO NOT CITE OR DISTRIBUTE P a g e | i Table of Contents List of Tables.......................................................................................................................................................................... 4 List of Figures

  2. (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl)Strontium(II)

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl)Strontium(II) Citation Details In-Document Search Title: (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl)Strontium(II) In the title compound, the Sr-N distances are 2.624 (3) and 2.676 (3) Angstroms. The Sr-centroid distances are 2.571 and 2.561 Angstroms. The N-C-C-N torsion angle in the bipyridine ligand is 2.2 (4){sup o}. Interestingly, the bipyridine ligand is tilted. The

  3. " East North Central",21.3,"NA",26,27.6,29,32.4

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

    Number of Vehicles, Selected Survey Years (Millions)" ,"Survey Years" ,1983,1985,1988,1991,1994,2001 "Total",129.3,137.3,147.5,151.2,156.8,191 "Household Characteristics" "Census...

  4. Ferromagnetic superexchange in insulating Cr2MoO6 by controlling orbital hybridization

    SciTech Connect (OSTI)

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

    2015-09-11

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

  5. Experimental and theoretical study of the ion-ion mutual neutralization reactions Ar{sup +}+SF{sub n}{sup -} (n=6, 5, and 4)

    SciTech Connect (OSTI)

    Bopp, Joseph C.; Miller, Thomas M.; Viggiano, Albert A.; Troe, Juergen

    2008-08-21

    The ion-ion mutual neutralization reactions Ar{sup +}+SF{sub n}{sup -}{yields}Ar+SF{sub n} (n=6, 5, and 4) have been studied in a flowing afterglow-Langmuir probe (FALP) apparatus at 300 K and 1 Torr of He buffer gas. Electron concentrations and product ion fractions were measured, and neutralization rate constants of 4.0x10{sup -8}, 3.8x10{sup -8}, and 4x10{sup -8} cm{sup 3} s{sup -1} for SF{sub 6}{sup -}, SF{sub 5}{sup -}, and SF{sub 4}{sup -}, respectively, were derived, with uncertainties of {+-}25% ({+-}35% for SF{sub 4}{sup -}). During the neutralization process, excited neutrals are generated that are able to dissociate to neutral fragments. In the case of SF{sub 6}, the formation of SF{sub 5} and SF{sub 4}, and similarly in the case of SF{sub 5}, the formation of SF{sub 4} and SF{sub 3} were observed and quantified. The mechanism of primary and secondary reaction was analyzed in detail, and rate constants for the dissociative electron attachments e{sup -}+SF{sub 5}{yields}F{sup -}+SF{sub 4} (k=3x10{sup -9} cm{sup 3} s{sup -1},{+-}40%) and e{sup -}+SF{sub 3}{yields}F{sup -}+SF{sub 2} (k=2x10{sup -8} cm{sup 3} s{sup -1},+400%,-75%) were also derived. The experimental ion-ion neutralization rate constants were found to be in good agreement with estimates from an optimum two-state double-passage Landau-Zener model. It was also found that energy partitioning in the neutralization is related to the extent of electronic excitation of Ar generated by the electron transfer processes.

  6. Data:C9125b18-da0a-4612-b0c6-3eb6421ac6c2 | Open Energy Information

    Open Energy Info (EERE)

    b0c6-3eb6421ac6c2 No revision has been approved for this page. It is currently under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic...

  7. A Fundamental Study on the [(μ-Cl)3Mg2(THF)6]+ Dimer Electrolytes for

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

    Rechargeable Mg Batteries - Joint Center for Energy Storage Research 5, 2015, Research Highlights A Fundamental Study on the [(μ-Cl)3Mg2(THF)6]+ Dimer Electrolytes for Rechargeable Mg Batteries (a) Proposed formation of the Mg-dimer and its equilibrium with Mg-monomers (b) The M/Z isotopic distribution of the [MgCl(THF)3]+ peak in the positive mode of SPIN MS of [(µ-Cl)3Mg2(THF)6]AlPh3Cl. Inset gives the calculated isotopic pattern (c) 25Mg NMR spectra of [(µ-Cl)3Mg2(THF)6]AlPh3Cl in the

  8. Microsoft Word - PSRP Updates 6-25-10_v2 | Department of Energy

    Office of Environmental Management (EM)

    PSRP Updates 6-25-10_v2 Microsoft Word - PSRP Updates 6-25-10_v2 PDF icon Microsoft Word - PSRP Updates 6-25-10_v2 More Documents & Publications The Office of Environmental Management (EM) Defense Environmental Cleanup Above on the left is K-25, at Oak Ridge before and after the 844,000 sq-ft demolition. In addition, on the right: K Cooling Tower at Savannah River Site demolition. Deactivation & Decommissioning (D&D) Program Map Assistant Secretray Triay's Written Statement before

  9. A novel organic–inorganic hybrid with Anderson type polyanions as building blocks: (C{sub 6}H{sub 10}N{sub 3}O{sub 2}){sub 2}Na(H{sub 2}O){sub 2}[Al(OH){sub 6}Mo{sub 6}O{sub 18}]·6H{sub 2}O

    SciTech Connect (OSTI)

    Thabet, Safa; Ayed, Brahim; Haddad, Amor

    2012-11-15

    Graphical abstract: Display Omitted Highlights: ► Synthesis of a novel inorganic–organic hybrid compound based on Anderson polyoxomolybdates. ► Characterization by X-ray diffraction, IR and UV–Vis spectroscopies of the new compound. ► Potential applications in catalysis, biochemical analysis and electrical conductivity of the organic–inorganic compound. -- Abstract: A new organic–inorganic hybrid compound based on Anderson polyoxomolybdates, (C{sub 6}H{sub 10}N{sub 3}O{sub 2}){sub 2}Na(H{sub 2}O){sub 2}[Al(OH){sub 6}Mo{sub 6}O{sub 18}]·6H{sub 2}O (1) have been isolated by the conventional solution method and characterized by single-crystal X-ray diffraction, infrared, ultraviolet spectroscopy and Thermogravimetric Analysis (TGA). This compound crystallized in the triclinic system, space group P−1, with a = 94.635(1) Å, b = 10.958(1) Å, c = 11.602(1) Å, α = 67.525(1)°, β = 71.049(1)°, γ = 70.124(1)° and Z = 1. The crystal structures of the compounds exhibit three-dimensional supramolecular assembly based on the extensive hydrogen bonding interactions between organic cations, sodium cations, water molecules and Anderson polyoxoanions. The infrared spectrum fully confirms the X-ray crystal structure and the UV spectrum of the title compound exhibits an absorption peak at 210 nm.

  10. Methanogenic Conversion of CO2 Into CH4

    SciTech Connect (OSTI)

    Stevens, S.H., Ferry, J.G., Schoell, M.

    2012-05-06

    This SBIR project evaluated the potential to remediate geologic CO2 sequestration sites into useful methane gas fields by application of methanogenic bacteria. Such methanogens are present in a wide variety of natural environments, converting CO2 into CH4 under natural conditions. We conclude that the process is generally feasible to apply within many of the proposed CO2 storage reservoir settings. However, extensive further basic R&D still is needed to define the precise species, environments, nutrient growth accelerants, and economics of the methanogenic process. Consequently, the study team does not recommend Phase III commercial application of the technology at this early phase.

  11. Electrochemical Investigation of Al–Li/LixFePO4 Cells in Oligo(ethylene glycol) Dimethyl Ether/LiPF6

    SciTech Connect (OSTI)

    Wang, X.J.; Zhou, Y.N.; Lee, H.S.; Nam, K.W.; Yang, X.Q.; Haas, O.

    2011-02-01

    1 M LiPF{sub 6} dissolved in oligo(ethylene glycol) dimethyl ether with a molecular weight, 500 g mol{sup -1} (OEGDME500, 1 M LiPF{sub 6}), was investigated as an electrolyte in experimental Al-Li/LiFePO{sub 4} cells. More than 60 cycles were achieved using this electrolyte in a Li-ion cell with an Al-Li alloy as an anode sandwiched between two Li x FePO{sub 4} electrodes (cathodes). Charging efficiencies of 96-100% and energy efficiencies of 86-89% were maintained during 60 cycles at low current densities. A theoretical investigation revealed that the specific energy can be increased up to 15% if conventional LiC{sub 6} anodes are replaced by Al-Li alloy electrodes. The specific energy and the energy density were calculated as a function of the active mass per electrode surface (charge density). The results reveal that for a charge density of 4 mAh cm{sup -2} about 160 mWh g{sup -1} can be reached with Al-Li/LiFePO{sub 4} batteries. Power limiting diffusion processes are discussed, and the power capability of Al-Li/LiFePO{sub 4} cells was experimentally evaluated using conventional electrolytes.

  12. Recyclability study on Inconel 718 and Ti-6Al-4V powders for use in electron beam melting

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

    Nandwana, Peeyush; Peter, William H.; Lowe, Larry E.; Dehoff, Ryan R.; Medina, Francisco; Babu, Sudarsanam Suresh; Kirka, Michael M.

    2015-10-20

    In this study, powder bed based additive manufacturing technologies offer a big advantage in terms of reusability of the powders over multiple cycles that result in cost savings. However, currently there are no standards to determine the factors that govern the powder reuse times. This work presents the results from a recyclability study conducted on Inconel 718 and Ti-6Al-4V powders. It has been found that the Inconel 718 powders are chemically stable over a large number of cycles and their reuse time is limited by physical characteristics of powders such as flowability. Ti-6Al-4V, on the other hand, finds its reusemore » time governed by the oxygen pick up that occurs during and in between build cycles. The detailed results have been presented.« less

  13. Recyclability study on Inconel 718 and Ti-6Al-4V powders for use in electron beam melting

    SciTech Connect (OSTI)

    Nandwana, Peeyush; Peter, William H.; Lowe, Larry E.; Dehoff, Ryan R.; Medina, Francisco; Babu, Sudarsanam Suresh; Kirka, Michael M.

    2015-10-20

    In this study, powder bed based additive manufacturing technologies offer a big advantage in terms of reusability of the powders over multiple cycles that result in cost savings. However, currently there are no standards to determine the factors that govern the powder reuse times. This work presents the results from a recyclability study conducted on Inconel 718 and Ti-6Al-4V powders. It has been found that the Inconel 718 powders are chemically stable over a large number of cycles and their reuse time is limited by physical characteristics of powders such as flowability. Ti-6Al-4V, on the other hand, finds its reuse time governed by the oxygen pick up that occurs during and in between build cycles. The detailed results have been presented.

  14. Fusion Cross Section in the {sup 4,6}He+{sup 64}Zn Collisions Around the Coulomb Barrier

    SciTech Connect (OSTI)

    Fisichella, M.; Di Pietro, A.; Figuera, P.; Marchetta, C.; Lattuada, M.; Musumarra, A.; Pellegriti, M. G.; Scuderi, V.; Strano, E.; Torresi, D.; Milin, M.; Skukan, N.; Zadro, M.

    2011-10-28

    New fusion data for the {sup 4}He+{sup 64}Zn system at sub-barrier energies are measured to cover the same energy region of previous measurements for {sup 6}He+{sup 64}Zn. Aim of the experiment was to compare the fusion excitation functions for the two system to investigate on the effects of the {sup 6}He neutron-halo structure on the fusion reaction mechanism at energies around the Coulomb barrier. The fusion cross section was measured by using an activation technique. Comparing the two systems, we observe an enhancement of the fusion cross section in the reaction induced by {sup 6}He, at and below the Coulomb barrier.

  15. Broken Symmetry in the Pseudogap State of YBa2Cu3O6+x (Technical...

    Office of Scientific and Technical Information (OSTI)

    Title: Broken Symmetry in the Pseudogap State of YBa2Cu3O6+x Authors: Ramshaw, Brad 1 + Show Author Affiliations Los Alamos National Laboratory Los Alamos National Laboratory ...

  16. Energy Department Awards $2.6 Million to Boost Combustion Efficiency in Industrial Boilers

    Broader source: Energy.gov [DOE]

    WASHINGTON, DC-- The U.S. Department of Energy (DOE) today announced the selection of three new combustion technology research and development (R&D) projects that will receive nearly $2.6...

  17. Three tetranuclear copper(II) cluster-based complexes constructed from 4-amino-1,2,4-triazole and different aromatic carboxylates: Assembly, structures, electrochemical and magnetic properties

    SciTech Connect (OSTI)

    Wang, Xiu-Li; Zhao, Wei; Zhang, Ju-Wen; Lu, Qi-Lin

    2013-02-15

    Three new tetranuclear copper(II) cluster-based complexes constructed from 4-amino-1,2,4-triazole (atrz) and three types of aromatic carboxylates, [Cu{sub 4}({mu}{sub 3}-OH){sub 2}(atrz){sub 2}(DNBA){sub 6}] (1), [Cu{sub 4}({mu}{sub 3}-OH){sub 2}(atrz){sub 2}(1,3-BDC){sub 3}]{center_dot}2H{sub 2}O (2) and [Cu{sub 4}({mu}{sub 3}-OH){sub 2}(atrz){sub 2}(SIP){sub 2}]{center_dot}4H{sub 2}O (3) (HDNBA=3,5-dinitrobenzoic acid, 1,3-H{sub 2}BDC=1,3-benzenedicarboxylic acid and NaH{sub 2}SIP=sodium 5-sulfoisophthalate), have been hydrothermally synthesized and structurally characterized. Complex 1 displays a single-molecular Cu{sup II}{sub 4} cluster structure, which is further connected by the intermolecular hydrogen-bonding interactions to form a 2D supramolecular layer. In 2, there also exist tetranuclear Cu{sup II}{sub 4} clusters, which are linked by the 1,3-BDC anions to give a 3D NaCl-type framework. In 3, the Cu{sup II}{sub 4} clusters are connected by the carboxyl and sulfo groups of SIP anions to generate 3D (4,8)-connected framework with a (4{sup 10}{center_dot}6{sup 14}{center_dot}8{sup 4})(4{sup 5}{center_dot}6){sub 2} topology. The atrz ligand conduces to the construction of tetranuclear copper(II) clusters and the carboxylates with different non-carboxyl substituent show important effects on the final structures of the title complexes. The electrochemical and magnetic properties of 1-3 have been investigated. - Graphical abstract: Three tetranuclear copper(II) cluster-based complexes based on different carboxylates have been synthesized under hydrothermal conditions. The carboxylate anions play a key role in the formation of three different structures. Highlights: Black-Right-Pointing-Pointer Three new tetranuclear copper(II) cluster-based complexes have been obtained. Black-Right-Pointing-Pointer The atrz conduces to the construction of tetranuclear copper(II) clusters. Black-Right-Pointing-Pointer Carboxylates show important effect on the structures of title complexes. Black-Right-Pointing-Pointer Magnetic properties and electrochemical behaviors have been reported.

  18. Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6 Citation Details In-Document Search Title: Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6 Authors: Kono, Yoshio ; Kenney-Benson, Curtis ; Ikuta, Daijo ; Shibazaki, Yuki ; Wang, Yanbin ; Shen, Guoyin Publication Date: 2016-03-14 OSTI Identifier: 1249225 Resource Type: Journal Article Resource Relation: Journal Name: Proceedings of the National

  19. Photoluminescence performance of thulium doped Li{sub 4}SrCa(SiO{sub 4}){sub 2} under irradiation of ultraviolet and vacuum ultraviolet lights

    SciTech Connect (OSTI)

    Wang, Zhaofeng; Li, Yezhou; Liu, Xiong; Wei, Xingmin; Chen, Yueling; Zhou, Fei; Wang, Yuhua

    2014-11-15

    Highlights: A novel blue-emitting phosphor Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tm{sup 3+} was reported. Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tm{sup 3+} exhibited excellent thermal and irradiation stability. Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tm{sup 3+} was found to possess high color purity. - Abstract: In this work, we synthesized Tm{sup 3+} doped Li{sub 4}SrCa(SiO{sub 4}){sub 2} phosphors and investigated their photoluminescence properties under the excitation of ultraviolet and vacuum ultraviolet lights. The crystal structure analysis and variation of cell parameters confirm that Tm{sup 3+} ions have been successfully doped in the structure of Li{sub 4}SrCa(SiO{sub 4}){sub 2} host by occupying the sites of Ca{sup 2+} with the coordination number of 6. The luminescence results suggest that Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tm{sup 3+} is a good blue-emitting phosphor when excited by ultraviolet and vacuum ultraviolet irradiations. In addition, it is observed that there is nearly no degradation for Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tm{sup 3+} after undergoing thermal and irradiation treatments. Possible mechanisms for the luminescence processes are proposed on the basis of the discussion of excitation and emission spectra. In particular, the emission color of Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tm{sup 3+} by excitation of 147 and 172 nm irradiations is very close to the standard blue color, suggesting that it could be potentially applied in plasma display panels and mercury-free fluorescence lamps.

  20. Fundamental Understanding of Methane-Carbon Dioxide-Water (CH4-CO2-H2O)

    Office of Scientific and Technical Information (OSTI)

    Interactions in Shale Nanopores under Reservoir Conditions. (Conference) | SciTech Connect Fundamental Understanding of Methane-Carbon Dioxide-Water (CH4-CO2-H2O) Interactions in Shale Nanopores under Reservoir Conditions. Citation Details In-Document Search Title: Fundamental Understanding of Methane-Carbon Dioxide-Water (CH4-CO2-H2O) Interactions in Shale Nanopores under Reservoir Conditions. Abstract not provided. Authors: Wang, Yifeng Publication Date: 2014-12-01 OSTI Identifier: 1242810

  1. Buildings Energy Data Book: 6.4 Electric and Generic Quad Carbon Emissions

    Buildings Energy Data Book [EERE]

    2 Electric Quad Average Carbon Dioxide Emissions with Average Utility Fuel Mix (Million Metric Tons) (1) Petroleum Natural Gas Coal Nuclear Renewable Total 2010 0.83 10.14 46.45 0.00 0.30 57.72 2011 0.00 0.21 0.00 0.00 0.00 0.21 2012 0.00 0.65 0.00 0.00 0.00 0.65 2013 0.00 0.16 0.00 0.00 0.00 0.16 2014 0.00 0.61 0.00 0.00 0.00 0.61 2015 0.00 1.04 0.00 0.00 0.00 1.04 2016 0.00 0.83 0.00 0.00 0.00 0.83 2017 0.00 0.58 0.00 0.00 0.00 0.58 2018 0.00 0.62 0.00 0.00 0.00 0.62 2019 0.00 0.70 0.00 0.00

  2. Improvement of the photoluminescent intensity of ZnTa{sub 2}O{sub 6}:Pr{sup 3+} phosphor

    SciTech Connect (OSTI)

    Noto, L.L. Ntwaeaborwa, O.M.; Yagoub, M.Y.A.; Swart, H.C.

    2014-07-01

    Highlights: The optimal luminescence intensity was obtained for 0.4 mol% Pr{sup 3+} doped ZnTa{sub 2}O{sub 6}. The ZnTa{sub 2}O{sub 6}:Pr{sup 3+} has a colour index matching an ideal red emission. The cross relaxation process led to a decrease in red emission at higher Pr{sup 3+} concentrations. The blue emission continues to increase at higher Pr{sup 3+} concentrations. The persistent luminescent increases with an increase in Pr{sup 3+} concentration. - Abstract: A red emitting ZnTa{sub 2}O{sub 6}:Pr{sup 3+} phosphor with Commission Internationale de lEclairage coordinates that match those of an ideal red emission was prepared by solid state chemical reaction. X-ray diffraction confirmed that a pure orthorhombic phase of ZnTa{sub 2}O{sub 6} was crystallized. A homogeneous distribution of the Pr{sup 3+} ions was confirmed from the analysis of the time of flight secondary ion mass spectroscopy overlay images. In addition to the reflectance at 259 nm associated with band-to-band absorption, minor reflectance peaks associated with f-f transitions of Pr{sup 3+} were observed at 420500 nm. The main red emission peak was split into minor peaks located at 608, 619 and 639 nm that were assigned to {sup 1}D{sub 2} ? {sup 3}H{sub 4}, {sup 3}P{sub 0} ? {sup 3}H{sub 6} and {sup 3}P{sub 0} ? {sup 3}F{sub 2} transitions of Pr{sup 3+}, respectively. With increasing concentration of Pr{sup 3+}, a relatively weak blue emission was observed at 488 nm and this phenomenon maybe attributed to virtual charge transfer or/and inter cross relaxation effects. The decay characteristics of the persistent emission were also calculated.

  3. Effect of Structural Stress on the Laser Quality of Highly Doped Yb:KY(WO4)2/KY(WO4)2 and Yb:KLu(WO4)2/KLu(WO4)2 Epitaxial Structures

    SciTech Connect (OSTI)

    Carvajal, J.; Raghothamachar, B; Silvestre, O; Chen, H; Pujol, M; Petrov, V; Dudley, M; Aguilo, M; Diaz, F

    2009-01-01

    In this communication we demonstrate how the difference in laser performance of two highly doped (20 at %) epitaxial layers of Yb-doped KY(WO4)2 (KYW) grown on a KYW substrate and Yb-doped KLu(WO4)2 (KLuW) grown on a KLuW substrate, respectively, is related to the presence of structural stress in the epilayers, investigated by synchrotron white beam X-ray topography. From the results obtained, it is clear that the samples that show a larger amount of structural stress, Yb:KYW/KYW epitaxies, lead to lower efficiency in laser operation, giving a direct correlation between the existence and magnitude of such structural stress and the loss in efficiency of laser performance in such epitaxial layers which, from a spectroscopical point of view, are otherwise equivalent.

  4. Structure of a Bud6/Actin Complex Reveals a Novel WH2-like Actin Monomer

    Office of Scientific and Technical Information (OSTI)

    Recruitment Motif (Journal Article) | SciTech Connect SciTech Connect Search Results Journal Article: Structure of a Bud6/Actin Complex Reveals a Novel WH2-like Actin Monomer Recruitment Motif Citation Details In-Document Search Title: Structure of a Bud6/Actin Complex Reveals a Novel WH2-like Actin Monomer Recruitment Motif Authors: Park, Eunyoung ; Graziano, Brian R. ; Zheng, Wei ; Garabedian, Mikael ; Goode, Bruce L. ; Eck, Michael J. [1] ; Harvard-Med) [2] ; Brandeis) [2] + Show Author

  5. Information management fiscal year 1996 site support program plan, WBS 6.4. Revision 1

    SciTech Connect (OSTI)

    1995-09-01

    In the recent past, information resource management (IRM) was a neatly separable component of the overall DOE mission, concerned primarily with procuring and implementing automatic data processing (ADP) systems. As the DOE missions have shifted from producing product to managing processes, those clear lines have blurred. Today, IRM is firmly embedded in all aspects of the DOE mission. BCS Richland, Inc., (BCSR) provides IRM for the Hanford Site. The main focus in executing this mission is to meet customer goals by providing high-quality, timely, and cost-effective electronic communication, computing, and information services. Information resources provide the US Department of Energy, Richland Operations Office (RL) and the Hanford Site contractors the ability to generate, store, access, and communicate information quickly, reliably, and cost effectively. BCSR plans, implements, and operates electronic communication, computing and information management systems that enable effective operation of the Hanford Site. Five strategic initiatives to encompass the vision provide guidance and focus to the information technology (IT) direction for developing the BCSR program plan. These strategic initiatives are the program vision and are as follows: primary focus; fast response; accessible information; world class information management infrastructure; powerful desktop. The business directions that guide the development of the BCSR Program Plan are: (1) emphasize providing cost-effective and value-added communication, computing, and information systems products and services to the Site missions; (2) strengthen the alignment of products and services with Site projects and programs and eliminate duplications Sitewide; (3) focus on the effective resolution of critical Site information management (IM) issues.

  6. October 2011 Energy Assurance Planning Bulletin Volume 2 No 4

    Energy Savers [EERE]

    3, 2011 THE AMERICAN RECOVERY AND REINVESTMENT ACT VOLUME 2, NUMBER 4 Need to Know Fourth DOE/OE Regional Tabletop Exercise Action Items DOE to Request Sharing of State EA Plans Exercise and Reporting Deadlines News from the States Revolving Loan Funded Hydro Projects Help to Power Nevada Energy Assurance Success Stories Midwest Regional Exercise Recap Other Useful Information and Links New PTI Resources DOE/OE Year-in-Review: 2010 Report Upcoming Events Winter Fuels Outlook NARUC Annual Meeting

  7. Pressure-enhanced superconductivity in Eu3Bi2S4F4

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

    Luo, Yongkang; Zhai, Hui -Fei; Zhang, Pan; Xu, Zhu -An; Cao, Guang -Han; Thompson, J. D.

    2014-12-17

    The pressure effect on the newly discovered charge-transferred BiS2-based superconductor, Eu3Bi2S4F4, with a Tc of 1.5 K at ambient pressure, is investigated by transport and magnetic measurements. Accompanied with the enhancement of metallicity under pressures, the onset superconducting transition temperature increases abruptly around 1.0 GPa, reaching ~10.0 K at 2.26 GPa. Alternating current magnetic susceptibility measurements indicate that a new superconducting phase with a higher Tc emerges and dominates at high pressures. In the broad pressure window of 0.68GPa≤p≤2.00 GPa, the high-Tc phase coexists with the low-Tc phase. Hall effect measurements reveal a significant difference in electronic structures between themore » two superconducting phases. As a result, our work devotes the effort to establish the commonality of pressure effect on the BiS2-based superconductors, and also uncovers the importance of electron carrier density in the high-Tc phase.« less

  8. Experimental investigations of material models for Ti-6A1-4V and 2024-T3

    SciTech Connect (OSTI)

    Leseur, D

    1999-05-03

    This report describes studies of the deformation and failure behavior of Ti-6Al-4V and 2024-T3 aluminum. Data was obtained at high strain rates and large strains using the split Hopkinson pressure bar technique. This information, plus additional data from the literature, was used to critically evaluate the ability of the Johnson Cook material model to represent the deformation and failure response of Ti-6AMV and 2024-T3 under conditions relevant to simulations of engine containment and the influence of uncontained engine debris on aircraft structures. This model is being used in the DYNA3D finite element code, which is being developed/validated for evaluating aircraft/engine designs relative to the federal airworthiness standards and for improving mitigation/containment technology. The results of the experimental work reported here were used to define a new set of material constants for the strength component of the Johnson Cook model for Ti-6Al-4V and 2024-T3. The capabilities and limitations of the model are reviewed. The model can accurately represent the stress-strain response of the materials. The major concern with the Johnson Cook material model is its ability to accurately represent the stress - strain rate response at strain rates greater than 10{sup 3}-10{sup 4} s{sup {minus}1}. Additional work is also needed to adequately account for failure via shear localization, which was the dominant failure mode at high strain rates in both materials. Failure modeling in both Ti-6Al-N and 2024-T3 will be considered further in future reports.

  9. Table 2.6 Household End Uses: Fuel Types, Appliances, and Electronics, Selected Years, 1978-2009

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

    6 Household End Uses: Fuel Types, Appliances, and Electronics, Selected Years, 1978-2009 Appliance Year Change 1978 1979 1980 1981 1982 1984 1987 1990 1993 1997 2001 2005 2009 1980 to 2009 Total Households (millions) 77 78 82 83 84 86 91 94 97 101 107 111 114 32 Percent of Households<//td> Space Heating - Main Fuel 1 Natural Gas 55 55 55 56 57 55 55 55 53 52 55 52 50 -5 Electricity 2 16 17 18 17 16 17 20 23 26 29 29 30 35 17 Liquefied Petroleum Gases 4 5 5 4 5 5 5 5 5 5 5 5 5 0 Distillate

  10. Table 4

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

    Night... 16.6 3.4 5.1 3.1 2.9 1.3 0.8 7.89 Automatic Control... 18.2 3.1 6.9 3.4 3.2 1.1 0.5 7.89 High...

  11. Crystal structure and antiferromagnetic ordering of quasi-2D [Cu(HF{sub 2})(pyz){sub 2}]TaF{sub 6} (pyz = pyrazine).

    SciTech Connect (OSTI)

    Manson, J. L.; Schlueter, J. A.; McDonald, R. D.; Singleton, J.; Materials Science Division; Eastern Washington Univ.; LANL

    2010-04-01

    The crystal structure of the title compound was determined by X-ray diffraction at 90 and 295 K. Copper(II) ions are coordinated to four bridging pyz ligands to form square layers in the ab-plane. Bridging HF{sub 2}{sup -} ligands join the layers together along the c-axis to afford a tetragonal, three-dimensional (3D) framework that contains Taf{sub 6}{sup -} anions in every cavity. At 295 K, the pyz rings lie exactly perpendicular to the layers and cooling to 90 K induces a canting of those rings. Magnetically, the compound exhibits 2D antiferromagnetic correlations within the 2D layers with an exchange interaction of -13.1(1) K. Weak interlayer interactions, as mediated by Cu-F-H-F-Cu, leads to long-range magnetic order below 4.2 K. Pulsed-field magnetization data at 0.5 K show a concave curvature with increasing B and reveal a saturation magnetization at 35.4 T.

  12. High antiferromagnetic transition temperature of a honeycomb compound SrRu2O6

    SciTech Connect (OSTI)

    Tian, Wei; Svoboda, Chris; Ochi, M.; Matsuda, M.; Cao, Huibo; Cheng, J. -G.; Sales, B. C.; Mandrus, D.; Arita, R.; Trivedi, Nandini; Yan, Jiaqiang

    2015-09-14

    We study the high-temperature magnetic order in a quasi-two-dimensional honeycomb compound SrRu2O6 by measuring magnetization and neutron powder diffraction with both polarized and unpolarized neutrons. SrRu2O6 crystallizes into the hexagonal lead antimonate (PbSb2O6, space group P31m) structure with layers of edge-sharing RuO6 octahedra separated by Sr2+ ions. SrRu2O6 is found to order at TN = 565 K with Ru moments coupled antiferromagnetically both in plane and out of plane. The magnetic moment is 1.30(2) ?B/Ru at room temperature and is along the crystallographic c axis in the G-type magnetic structure. We perform density functional calculations with constrained random-phase approximation (RPA) to obtain the electronic structure and effective intra- and interorbital interaction parameters. The projected density of states shows strong hybridization between Ru 4d and O 2p. By downfolding to the target t2g bands we extract the effective magnetic Hamiltonian and perform Monte Carlo simulations to determine the transition temperature as a function of interand intraplane couplings. We find a weak interplane coupling, 3% of the strong intraplane coupling, permits three-dimensional magnetic order at the observed TN .

  13. High temperature-induced phase transitions in Sr{sub 2}GdRuO{sub 6} complex perovskite

    SciTech Connect (OSTI)

    Triana, C.A.; Corredor, L.T.; Landinez Tellez, D.A.; Roa-Rojas, J.

    2011-12-15

    Highlights: Black-Right-Pointing-Pointer Crystal structure, thermal expansion and phase transitions at high-temperature of Sr{sub 2}GdRuO{sub 6} perovskite has been investigated. Black-Right-Pointing-Pointer X-ray diffraction pattern at 298 K of Sr{sub 2}GdRuO{sub 6} corresponds to monoclinic perovskite-type structure with P2{sub 1}/n space group. Black-Right-Pointing-Pointer Evolution of X-ray diffraction patterns at high-temperature shows that the Sr{sub 2}GdRuO{sub 6} perovskite suffers two-phase transitions. Black-Right-Pointing-Pointer At 573 K the X-ray diffraction pattern of Sr{sub 2}GdRuO{sub 6} corresponds to monoclinic perovskite-type structure with I2/m space group. Black-Right-Pointing-Pointer At 1273 K the Sr{sub 2}GdRuO{sub 6} perovskite suffers a complete phase-transition from monoclinic I2/m (no. 12) to tetragonal I4/m (no. 87). -- Abstract: The crystal structure behavior of the Sr{sub 2}GdRuO{sub 6} complex perovskite at high-temperature has been investigated over a wide temperature range between 298 K {<=} T {<=} 1273 K. Measurements of X-ray diffraction at room-temperature and Rietveld analysis of the experimental patterns show that this compound crystallizes in a monoclinic perovskite-like structure, which belongs to the P2{sub 1}/n (no. 14) space group and 1:1 ordered arrangement of Ru{sup 5+} and Gd{sup 3+} cations over the six-coordinate M sites. Experimental lattice parameters were obtained to be a =5.8103(5) Angstrom-Sign , b =5.8234(1) Angstrom-Sign , c =8.2193(9) Angstrom-Sign , V = 278.11(2) Angstrom-Sign {sup 3} and angle {beta} = 90.310(5) Degree-Sign . The high-temperature analysis shows the occurrence of two-phase transitions on this material. First, at 573 K it adopts a monoclinic perovskite-type structure with I2/m (no. 12) space group with lattice parameters a = 5.8275(6) Angstrom-Sign , b = 5.8326(3) Angstrom-Sign , c = 8.2449(2) Angstrom-Sign , V = 280.31(3) Angstrom-Sign {sup 3} and angle {beta} = 90.251(3) Degree-Sign . Close to 1273 K it undergoes a complete phase-transition from monoclinic I2/m (no. 12) to tetragonal I4/m (no. 87), with lattice parameters a = 5.8726(1) Angstrom-Sign , c = 8.3051(4) Angstrom-Sign , V = 286.39(8) Angstrom-Sign {sup 3} and angle {beta} = 90.0 Degree-Sign . The high-temperature phase transition from monoclinic I2/m (no. 12) to tetragonal I4/m (no. 87) is characterized by strongly anisotropic displacements of the anions.

  14. Table 4

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

    ... 16.6 0.5 1.5 1.9 1.8 1.3 2.8 2.8 2.2 1.8 9.27 Automatic Control... 18.2 0.4 0.8 1.3 1.7 1.5 2.5 3.9 3.4 2.6 9.51 High...

  15. Agenda_4-6

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

    Summer School on Synchrotron X-Ray Absorption Spectroscopy & Imaging Monday, July 18 - Friday, July 22, 2016 Monday, 18 July 2016, Building 48, Room 112 : Redwood Rooms 8:30 - 8:55 AM Registration -Refreshments 8:55 - 9:00 AM Introductory Remarks - Ritimukta Sarangi 9:00 - 10:00 AM Introduction to XAS at SSRL - Britt Hedman 10:00 - 11:00 AM Introduction to Theoretical Aspects of XAS/EXAFS - Matthew Newville 11:00 AM - 12:00 PM Introduction to Experimental Aspects of XAS/EXAFS - John Bargar

  16. table6.xls

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

    .4 9.9 10.2 10.6 11.4 12.0 Household Characteristics Census Region and Division Northeast... 9.5 NA 10.3 10.9 11.3 11.9...

  17. Two-fermion-four-boson description of {sup 198}Hg within the U{sub {nu}}(6/12) x U{sub {pi}}(6/4) extended nuclear structure supersymmetry

    SciTech Connect (OSTI)

    Bernards, C.; Heinze, S.; Jolie, J.; Fransen, C.; Linnemann, A.; Radeck, D.

    2009-05-15

    Using the U{sub {nu}}(6/12) x U{sub {pi}}(6/4) extended supersymmetry, we constructed the energy spectrum and electromagnetic transition properties of the supermultiplet member {sup 198}Hg with two proton fermions coupled to a neutron boson core. Consistency between the supersymmetric interacting boson fermion fermion approximation (IBFFA) description and the F-spin symmetric interacting boson approximation (IBA-2) description is shown for this two-fermion-N-boson multiplet member. The data of a {gamma}{gamma} angular correlation experiment using the HORUS cube {gamma}-ray spectrometer--determining new multipole mixing ratios, level spins, {gamma} transitions, and energy states--shows quite a good agreement, also for the low-energy part of the spectrum, when comparing theoretical predictions and experimental data. This is contrary to the usual assumption that a two-fermion-N-boson constellation should describe just the excited two-quasiparticle states.

  18. Synthesis and Characterization of PhotocatalyticTiO2-ZnFe2O4Nanoparticles

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

    Srinivasan, Sesha S.; Wade, Jeremy; Stefanakos, Elias K.

    2006-01-01

    A new coprecipitation/hydrolysis synthesis route is used to create aTiO2-ZnFe2O4nanocomposite that is directed towards extending the photoresponse ofTiO2from UV to visible wavelengths (>400?nm). The effect ofTiO2's accelerated anatase-rutile phase transformation due to the presence of the coupledZnFe2O4narrow-bandgap semiconductor is evaluated. The transformation's dependence on pH, calcinations temperature, particle size, andZnFe2O4concentration has been analyzed using XRD, SEM, and UV-visible spectrometry. The requirements for retaining the highly photoactive anatase phase present in aZnFe2O4nanocomposite are outlined. The visible-light-activated photocatalytic activity of theTiO2-ZnFe2O4nanocomposites has been compared to an AldrichTiO2reference catalyst, using a solar-simulated photoreactor formorethe degradation of phenol.less

  19. Synthesis and Characterization of Photocatalytic TiO 2 -ZnFe 2 O 4 Nanoparticles

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

    Srinivasan, Sesha S.; Wade, Jeremy; Stefanakos, Elias K.

    2006-01-01

    A new coprecipimore » tation/hydrolysis synthesis route is used to create a TiO 2 -ZnFe 2 O 4 nanocomposite that is directed towards extending the photoresponse of TiO 2 from UV to visible wavelengths ( > 400   nm ). The effect of TiO 2 's accelerated anatase-rutile phase transformation due to the presence of the coupled ZnFe 2 O 4 narrow-bandgap semiconductor is evaluated. The transformation's dependence on pH, calcinations temperature, particle size, and ZnFe 2 O 4 concentration has been analyzed using XRD, SEM, and UV-visible spectrometry. The requirements for retaining the highly photoactive anatase phase present in a ZnFe 2 O 4 nanocomposite are outlined. The visible-light-activated photocatalytic activity of the TiO 2 -ZnFe 2 O 4 nanocomposites has been compared to an Aldrich TiO 2 reference catalyst, using a solar-simulated photoreactor for the degradation of phenol.« less

  20. Adaptation of HepG2 cells to a steady-state reduction in the content of protein phosphatase 6 (PP6) catalytic subunit

    SciTech Connect (OSTI)

    Boylan, Joan M.; Salomon, Arthur R.; Tantravahi, Umadevi; Gruppuso, Philip A.

    2015-07-15

    Protein phosphatase 6 (PP6) is a ubiquitous Ser/Thr phosphatase involved in an array of cellular processes. To assess the potential of PP6 as a therapeutic target in liver disorders, we attenuated expression of the PP6 catalytic subunit in HepG2 cells using lentiviral-transduced shRNA. Two PP6 knock-down (PP6KD) cell lines (90% reduction of PP6-C protein content) were studied in depth. Both proliferated at a rate similar to control cells. However, flow cytometry indicated G2/M cell cycle arrest that was accounted for by a shift of the cells from a diploid to tetraploid state. PP6KD cells did not show an increase in apoptosis, nor did they exhibit reduced viability in the presence of bleomycin or taxol. Gene expression analysis by microarray showed attenuated anti-inflammatory signaling. Genes associated with DNA replication were downregulated. Mass spectrometry-based phosphoproteomic analysis yielded 80 phosphopeptides representing 56 proteins that were significantly affected by a stable reduction in PP6-C. Proteins involved in DNA replication, DNA damage repair and pre-mRNA splicing were overrepresented among these. PP6KD cells showed intact mTOR signaling. Our studies demonstrated involvement of PP6 in a diverse set of biological pathways and an adaptive response that may limit the effectiveness of targeting PP6 in liver disorders. - Highlights: • Lentiviral-transduced shRNA was used to generate a stable knockdown of PP6 in HepG2 cells. • Cells adapted to reduced PP6; cell proliferation was unaffected, and cell survival was normal. • However, PP6 knockdown was associated with a transition to a tetraploid state. • Genomic profiling showed downregulated anti-inflammatory signaling and DNA replication. • Phosphoproteomic profiling showed changes in proteins associated with DNA replication and repair.

  1. {sup 16}O resonances near 4? threshold through {sup 12}C({sup 6}Li,d) reaction

    SciTech Connect (OSTI)

    Rodrigues, M. R. D.; Borello-Lewin, T.; Miyake, H.; Horodynski-Matsushigue, L. B.; Duarte, J. L. M.; Rodrigues, C. L.; Faria, P. Neto de; Cunsolo, A.; Cappuzzello, F.; Foti, A.; Agodi, C.; Cavallaro, M.; Napoli, M. di; Ukita, G. M.

    2014-11-11

    Several narrow alpha resonant {sup 16}O states were detected through the {sup 12}C({sup 6}Li,d) reaction, in the range of 13.5 to 17.5 MeV of excitation energy. The reaction was measured at a bombarding energy of 25.5 MeV employing the So Paulo Pelletron-Enge-Spectrograph facility and the nuclear emulsion technique. Experimental angular distributions associated with natural parity quasi-bound states around the 4? threshold are presented and compared to DWBA predictions. The upper limit for the resonance widths obtained is near the energy resolution (15 keV)

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

    Energy Savers [EERE]

    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:

  3. Completion Report for the Well ER-6-2 Site Corrective Action Unit 97: Yucca Flat - Climax Mine

    SciTech Connect (OSTI)

    NSTec Environmental Management

    2008-03-01

    Well ER-6-2 and its satellite hole, Well ER-6-2 No.1, were drilled for the U.S. Department of Energy, National Nuclear Security Administration Nevada Site Office in support of the Nevada Environmental Restoration Project at the Nevada Test Site, Nye County, Nevada. Well ER-6-2 was drilled in two stages in 1993 and 1994; the satellite hole, Well ER-6-2 No.1 was drilled nearby in 1993 but was abandoned. The wells were drilled as part of a hydrogeologic investigation program for the Yucca Flat-Climax Mine Corrective Action Unit Number 97, in the northeastern portion of the Nevada Test Site. The wells are located in Yucca Flat, within Area 6 of the Nevada Test Site. The wells provided information regarding the radiological and hydrogeological environment in a potentially down-gradient position from tests conducted in northern and central Yucca Flat. Construction of Well ER-6-2 began with a 1.2-meter-diameter surface conductor hole, which was drilled and cased off to a depth of 30.8 meters below the surface. A 50.8-centimeter diameter surface hole was then rotary drilled to the depth of 578.5 meters and cased off to the depth of 530.4 meters. The hole diameter was then reduced to 27.0 centimeters, and the borehole was advanced to a temporary depth of 611.4 meters. The borehole was conventionally cored to a total depth of 1,045 meters with a diameter of 14.0 centimeters. Borehole sloughing required cementing and re-drilling of several zones. The open-hole completion accesses the lower carbonate aquifer, the CP thrust fault, and the upper clastic confining unit. A fluid level depth of 543.2 meters was most recently measured in the open borehole in September 2007. No radionuclides were encountered during drilling. The satellite hole Well ER-6-2 No.1 was drilled approximately 15.2 meters north of Well ER-6-2 on the same drill pad. This was planned to be used as an observation well during future hydrologic testing at Well ER-6-2; however, the satellite hole was abandoned at the depth of 399 meters due to stuck drill pipe, and was subsequently cemented to the surface. Detailed lithologic descriptions with stratigraphic assignments in this report are based on composite drill cuttings samples collected every 3 meters, cores taken between the depths of 619.3 and 1,042.4 meters, and geophysical log data. Stratigraphic assignments within the Paleozoic section are based on paleontological analyses. The well was collared in alluvium and at 30.8 meters penetrated Paleozoic carbonate rocks. These consisted of dolostone with minor shale and limestone of the Bonanza King Formation, and limestone with minor quartzite, sandstone, and dolostone assigned to the Guilmette Formation. The borehole reached total depth in a shale unit assigned to the Chainman Shale. The units below the Bonanza King Formation are overturned due to faulting and folding and, therefore, are stratigraphically upside-down.

  4. Probing The Electrode/Electrolyte Interface in The Lithium Excess Layered Oxide Li1.2Ni0.2Mn0.6O2

    SciTech Connect (OSTI)

    Carroll, Kyler J; Qian, Danna; Fell, Chris; Calvin, Scott; Veith, Gabriel M; Chi, Miaofang; Dudney, Nancy J; Meng, Ying Shirley

    2013-01-01

    A detailed surface investigation of the lithium-excess nickel manganese layered oxide Li1.2Ni0.2Mn0.6O2 structure was carried out using x-ray photoelectron spectroscopy (XPS), total electron yield and transmission x-ray absorption spectroscopy (XAS), and electron energy loss spectroscopy (EELS) during the first two electrochemical cycles. All spectroscopy techniques consistently showed the presence of Mn4+ in the pristine material and a surprising reduction of Mn at the voltage plateau during the first charge. The Mn reduction is accompanied by the oxygen loss revealed by EELS. Upon the first discharge, the Mn at the surface never fully returns back to Mn4+. The electrode/electrolyte interface of this compound consists of the reduced Mn at the crystalline defect-spinel inner layer and an oxidized Mn species simultaneously with the presence of a superoxide species in amorphous outer layer. This proposed model signifies that oxygen vacancy formation and lithium removal result in electrolyte decomposition and superoxide formation, leading to Mn activation/dissolution and surface layer-spinel phase transformation. The results also indicate that the role of oxygen is complex and significant in contributing to the extra capacity of this class of high energy density cathode materials.

  5. A Comparison of Modifications to MELCOR versions 1.8.2 and 1.8.6 for ITER Safety Analysis

    SciTech Connect (OSTI)

    B. J. Merrill; P. W. Humrickhouse

    2010-06-01

    During the Engineering Design Activity of the International Thermonuclear Experimental Reactor (ITER), the MELCOR 1.8.2 code was selected as one of several codes to be used to perform ITER safety analyses [1]. MELCOR was chosen because it has the capability of predicting coolant pressure, temperature, mass flow rate, and radionuclide and aerosol transport in nuclear facilities and reactor cooling systems. MELCOR can also predict structural temperatures (e.g. first wall, blanket, divertor, and vacuum vessel) resulting from energy produced by radioactive decay heat and/or chemical reactions (oxidation). The Idaho National Laboratory (INL) Fusion Safety Program (FSP) made fusion specific modifications to the MELCOR 1.8.2 code [2-6], including models for water freezing, air condensation, beryllium, carbon, and tungsten oxidation in steam and air environments, flow boiling in coolant loops, and radiation in enclosures, that allowed MELCOR to assess the thermal hydraulic response of ITER cooling systems and the transport of radionuclides as aerosols during accident conditions. Recently, the ITER International Organization (IO) used a “pedigreed” version of MELCOR 1.8.2 [7] to perform accident analyses for ITER’s “Rapport Préliminaire de Sûreté” (Report Preliminary on Safety - RPrS). The MELCOR thermal-hydraulics code [8] is currently under development at the Sandia National Laboratory (SNL) for the US Nuclear Regulatory Commission (NRC). MELCOR is used to model the progression of severe accidents in light water fission reactors. Because MELCOR has undergone many improvements between version 1.8.2 and 1.8.6, the INL FSP decided to introduce fusion modifications into MELCOR 1.8.6, and thereby produce a version of MELCOR 1.8.6 with similar capabilities to the pedigreed version of MELCOR 1.8.2 used for the ITER RPrS. We have applied this version of MELCOR 1.8.6 to the same set of problems used in the MELCOR 1.8.2 pedigree analysis [7]. Section 2 describes a non-regression analysis that involves comparing the results from the modified version of MELCOR 1.8.6 against those predicted by the original, unmodified version of MELCOR 1.8.6. The purpose of this non-regression analysis is to demonstrate that the modifications made to the MELCOR 1.8.6 code do not drastically alter the intended functions of the MELCOR base code, and if they do to explain why the departure occurs and if the change is needed. The analysis was performed using the demonstration problem that came with the MELCOR 1.8.6 source distribution. Section 3 makes a comparison between the pedigreed version of MELCOR 1.8.2 and the new modified version of MELCOR 1.8.6 on a set of accident problems used by the ITER Joint Central Team (JCT) in the Generic Site Safety Report (GSSR) [9]. Finally, in section 4, the two versions of the code are compared on a series of developmental test problems described in the change documents [2-4, 6].

  6. Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect SciTech Connect Search Results Journal Article: Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6 Citation Details In-Document Search This content will become publicly available on September 29, 2016 Title: Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6 Authors: Kono, Yoshio ; Kenney-Benson, Curtis ; Ikuta, Daijo ; Shibazaki, Yuki ; Wang, Yanbin ; Shen, Guoyin Publication Date: 2016-03-14 OSTI

  7. A Reversible Structural Phase Transition in ZnV2O6 at High Pressures

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect A Reversible Structural Phase Transition in ZnV2O6 at High Pressures Citation Details In-Document Search Title: A Reversible Structural Phase Transition in ZnV2O6 at High Pressures Authors: Tang, R. ; Li, Y. ; Han, D. ; Li, H. ; Zhao, Y. ; Gao, C. ; Zhu, P. ; Wang, X. Publication Date: 2014-05-22 OSTI Identifier: 1162417 Report Number(s): BNL--106361-2014-JA Journal ID: ISSN 1932--7447 DOE Contract Number: DE-AC02-98CH10886 Resource Type: Journal Article

  8. Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | DOE PAGES Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6 This content will become publicly available on September 29, 2016 Title: Ultrahigh-pressure polyamorphism in GeO 2 glass with coordination number >6 Authors: Kono, Yoshio ; Kenney-Benson, Curtis ; Ikuta, Daijo ; Shibazaki, Yuki ; Wang, Yanbin ; Shen, Guoyin Publication Date: 2016-03-14 OSTI Identifier: 1241555 Grant/Contract Number: FG02-99ER45775; NA0001974 Type: Published Article

  9. Photocatalytic pure water splitting activities for ZnGa{sub 2}O{sub 4} synthesized by various methods

    SciTech Connect (OSTI)

    Zeng, Chunmei; Hu, Tao; Hou, Nianjun; Liu, Siyao; Gao, Wenliang; Cong, Rihong; Yang, Tao

    2015-01-15

    Highlights: High temperature solid state reaction, hydrothermal, sol-gel methods were applied. All ZnGa{sub 2}O{sub 4} samples show UV-light catalytic activities on pure water splitting. Bulk ZnGa{sub 2}O{sub 4} has a good photocatalytic activity per specific surface area. Sol-gel is a superior method to prepare nanosized ZnGa{sub 2}O{sub 4} with a high activity. The AQY for SG-ZnGa{sub 2}O{sub 4} is 2.6% for pure water splitting under 313 nm irradiation. - Abstract: We studied and compared the photocatalytic water splitting performances for ZnGa{sub 2}O{sub 4} prepared by high temperature solid state reaction (HTSSR), hydrothermal (HY) and sol-gel (SG) methods. HTSSR-ZnGa{sub 2}O{sub 4} has a relative large photocatalytic activity per surface area (1.6 ?mol/h/m{sup 2}) in pure water by UV irradiation due to its high crystallinity. The HY- and SG-samples both have small particle sizes (20?30 nm) and therefore high surface area (20 and 29 m{sup 2}/g, respectively), which leads to superior photocatalytic H{sub 2} evolution rates per unit mass (11.5 and 28.5 ?mol/h/g). The apparent quantum yield of SG-ZnGa{sub 2}O{sub 4} for pure water splitting under 313 nm irradiation is 2.6%. The existence of substantial surface defects is the major problem for HY- and SG-ZnGa{sub 2}O{sub 4}. Consequently, the usage of sacrificial agents could greatly enhance the activities and indeed the H{sub 2} evolution rates in 20 Vol. % methanol aqueous solution increase to 100 and 142 ?mol/h/g for HY- and SG-ZnGa{sub 2}O{sub 4}, respectively.

  10. Equine cytochrome P450 2B6 Genomic identification, expression and functional characterization with ketamine

    SciTech Connect (OSTI)

    Peters, L.M.; Demmel, S.; Pusch, G.; Buters, J.T.M.; Zielinski, J.; Leeb, T.; Mevissen, M.; Schmitz, A.

    2013-01-01

    Ketamine is an anesthetic and analgesic regularly used in veterinary patients. As ketamine is almost always administered in combination with other drugs, interactions between ketamine and other drugs bear the risk of either adverse effects or diminished efficacy. Since cytochrome P450 enzymes (CYPs) play a pivotal role in the phase I metabolism of the majority of all marketed drugs, drugdrug interactions often occur at the active site of these enzymes. CYPs have been thoroughly examined in humans and laboratory animals, but little is known about equine CYPs. The characterization of equine CYPs is essential for a better understanding of drug metabolism in horses. We report annotation, cloning and heterologous expression of the equine CYP2B6 in V79 Chinese hamster fibroblasts. After computational annotation of all CYP2B genes, the coding sequence (CDS) of equine CYP2B6 was amplified by RT-PCR from horse liver total RNA and revealed an amino acid sequence identity of 77% and a similarity of 93.7% to its human ortholog. A non-synonymous variant c.226G>A in exon 2 of the equine CYP2B6 was detected in 97 horses. The mutant A-allele showed an allele frequency of 82%. Two further variants in exon 3 were detected in one and two horses of this group, respectively. Transfected V79 cells were incubated with racemic ketamine and norketamine as probe substrates to determine metabolic activity. The recombinant equine CYP2B6 N-demethylated ketamine to norketamine and produced metabolites of norketamine, such as hydroxylated norketamines and 5,6-dehydronorketamine. V{sub max} for S-/and R-norketamine formation was 0.49 and 0.45 nmol/h/mg cellular protein and K{sub m} was 3.41 and 2.66 ?M, respectively. The N-demethylation of S-/R-ketamine was inhibited concentration-dependently with clopidogrel showing an IC{sub 50} of 5.63 and 6.26 ?M, respectively. The functional importance of the recorded genetic variants remains to be explored. Equine CYP2B6 was determined to be a CYP enzyme involved in ketamine and norketamine metabolism, thus confirming results from inhibition studies with horse liver microsomes. Clopidogrel seems to be a feasible inhibitor for equine CYP2B6. The specificity still needs to be established with other single equine CYPs. Heterologous expression of single equine CYP enzymes opens new possibilities to substantially improve the understanding of drug metabolism and drug interactions in horses. -- Highlights: ? We annotate, express and functionally characterize equine CYP2B6. ? 3 genetic variants within this gene are described. ? Equine CYP2B6 N-demethylates ketamine and metabolizes norketamine. ? Equine CYP2B6 can be inhibited by clopidogrel.

  11. Microsoft Word - FC-Final-2 _5-2-12__Approved at 6-12 Meeting_

    Energy Savers [EERE]

    Report of the Fuel Cycle Research and Development Subcommittee of the Nuclear Energy Advisory Committee Burton Richter (Chairman) Margaret Chu Darleane Hoffman Ray Juzaitis Sekazi Mtingwa Ronald P. Omberg Joy L. Rempe Dominique Warin June 12, 2012 2 I. Introduction and Summary The Fuel Cycle (FC) Subcommittee of NEAC met February 7-8, 2012 in Washington (Drs. Hoffmann and Juzaitis were unable to attend). While the meeting was originally scheduled to occur after the submission of the President's

  12. Subtask 2.6 - Assessment of Alternative Fuels on CO2 Production

    SciTech Connect (OSTI)

    Debra Pflughoeft-Hassett; Darren Naasz

    2009-06-16

    Many coal-based electric generating units use alternative fuels, and this effort assessed the impact of alternative fuels on CO{sub 2} production and other emissions and also assessed the potential impact of changes in emission regulations under the Clean Air Act (CAA) for facilities utilizing alternative fuels that may be categorized as wastes. Information was assembled from publicly available U.S. Department of Energy Energy Information Administration databases that included alternative fuel use for 2004 and 2005. Alternative fuel types were categorized along with information on usage by coal-based electric, number of facilities utilizing each fuel type, and the heating value of solid, liquid, and gaseous alternative fuels. The sulfur dioxide, nitrogen oxide, and carbon dioxide emissions associated with alternative fuels and primary fuels were also evaluated. Carbon dioxide emissions are also associated with the transport of all fuels. A calculation of carbon dioxide emissions associated with the transport of biomass-based fuels that are typically accessed on a regional basis was made. A review of CAA emission regulations for coal-based electric generating facilities from Section 112 (1) and Section 129 (2) for solid waste incinerators was performed with consideration for a potential regulatory change from Section 112 (1) regulation to Section 129 (2). Increased emission controls would be expected to be required if coal-based electric generating facilities using alternative fuels would be recategorized under CAA Section 129 (2) for solid waste incinerators, and if this change were made, it is anticipated that coal-fired electric generating facilities might reduce the use of alternative fuels. Conclusions included information on the use profile for alternative fuels and the impacts to emissions as well as the impact of potential application of emission regulations for solid waste incinerators to electric generating facilities using alternative fuels.

  13. The equation of state of 5-nitro-2,4-dihydro-1,2,4,-triazol-3-one determined via in-situ optical microscopy and interferometry measurements

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

    Stavrou, Elissaios; Zaug, Joseph M.; Bastea, Sorin; Crowhurst, Jonathan C.

    2016-04-07

    Quasi-hydrostatic high-pressure equations of state (EOS) are typically determined, for crystalline solids, by measuring unit-cell volumes using x-ray diffraction (XRD) techniques. However, when characterizing low-symmetry materials with large unit cells, conventional XRD approaches may become problematic. To overcome this issue, we examined the utility of a "direct" approach toward determining high pressure material volume by measuring surface area and sample thickness using optical microscopy and interferometry (OMI) respectively. We have validated this experimental approach by comparing results obtained for TATB (2,4,6-triamino-1,3,5-trinitrobenzene) with an EOS determined from synchrotron XRD measurements; and, a good match is observed. We have measured the highmore » pressure EOS of 5-nitro-2,4-dihydro-1,2,4-triazol-3-one (α-NTO) up to 33 GPa. No high-pressure XRD EOS data have been published on α-NTO, probably due to its complex crystal structure. Furthermore, the results of this study suggest that OMI is a reliable and versatile alternative for determining EOSs, especially when conventional methodologies are impractical.« less

  14. Dielectric breakdown properties of SF{sub 6}-N{sub 2} mixtures at 0.01-1.6 MPa and 300-3000 K

    SciTech Connect (OSTI)

    Zhao Hu; Li Xingwen; Jia Shenli; Murphy, Anthony B.

    2013-04-14

    The dielectric breakdown properties of SF{sub 6}-N{sub 2} mixtures were investigated at different concentrations of N{sub 2}, 0.01-1.6 MPa, and 300-3000 K. The equilibrium compositions of different SF{sub 6}-N{sub 2} mixtures at several gas pressures and temperatures up to 3000 K were first calculated by minimizing the Gibbs free energy under the assumptions of local thermodynamic and chemical equilibrium. The electron energy distribution function was then obtained using the composition data by Boltzmann equation analysis. It was found that adding N{sub 2} to SF{sub 6} gas can markedly reduce the kinetic energy of electrons at relatively high gas temperatures, which enhances the dielectric field strength. Finally, the critical reduced electric field (E/N){sub cr}, defined as the value for which ionization is equal to attachment, of hot SF{sub 6}-N{sub 2} mixtures was determined. The results indicate that in the gas temperature range around 2000-3000 K, increasing the concentration of N{sub 2} effectively enhances the (E/N){sub cr} of SF{sub 6}-N{sub 2} mixtures, and the (E/N){sub cr} of SF{sub 6}-N{sub 2} mixtures at a wide range of concentrations of N{sub 2} (5%, 50%, and 95%) are all higher than that of pure SF{sub 6} gas. Further, this trend exists at all the gas pressures considered (0.01-1.6 MPa).

  15. Ferromagnetic interactions and slow magnetic relaxation behaviors of two lanthanide coordination polymers bridged by 2,6-naphthalenedicarboxylate ligand

    SciTech Connect (OSTI)

    Fang, Ming; Li, Xiuhua; Cui, Ping; Zhao, Bin

    2015-03-15

    Two lanthanide-based frameworks: (Ln(phen)(NDA){sub 1.5}(H{sub 2}O)){sub n} (Ln=Gd(1), NDA=2,6-naphthalenedicarboxylate anion, phen=1,10-phenanthroline), and ([Dy(phen)(NDA){sub 1.5}]·0.5H{sub 2}NDA){sub n} (2) were structurally and magnetically characterized. Compound 1 exhibits 2D layer structure, belonging to the triclinic system with space group P−1, while compound 2 features a 3D framework with space group P−1. The magnetic studies revealed that ferromagnetic coupling existed between adjacent lanthanide ions in 1 and 2, and frequency-dependence out-of-phase signals in the measurement of alternate-current susceptibilities were observed for 2, albeit without reaching the characteristic maxima above 2 K, implying slow magnetic relaxation behavior in 2. After the application of a dc field, good peak shapes of ac signal were obtained and got the energy barrier ΔE/k{sub B}=29 K and the pre-exponential factor τ{sub 0}=4.47×10{sup −7} s at 2000 Oe field; and when the dc field was in 5000 Oe, giving ΔE/k{sub B}=40 K and τ{sub 0}=2.82×10{sup −6}. - Graphical abstract: Two novel lanthanide-based frameworks 1 and 2 were structurally and magnetically characterized. The results revealed that ferromagnetic coupling exists between adjacent lanthanide ions in 1 and 2, and 2 displayed slow magnetic relaxation behavior with the energy barrier of 29 K. - Highlights: • Two lanthanide frameworks were synthesized and magnetically characterized. • The magnetism studies indicate slow magnetic relaxation behavior in 2. • Weak ferromagnetic coupling existing between adjacent lanthanide centers.

  16. The Crystal Structure of Human, Nicotine Metabolizing Cytochrome P450 2A6

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

    The Crystal Structure of Human, Nicotine Metabolizing Cytochrome P450 2A6 J.K. Yano1, M.-H. Hsu1, K.J. Griffin1, C.D. Stout2, and E.F. Johnson1 1Department of Molecular and Experimental Medicine, The Scripps Research Institute, La Jolla, CA 92037 2Department of Molecular Biology, The Scripps Research Institute, La Jolla, CA 92037 Figure 1. Stereo views of sA-weighted 2|Fo|-|Fc| composite omit electron density maps contoured at 1 s and rendered within 1 Å of the heme and substrate for the P450

  17. Crystal structure, electronic structure and physical properties of the new low-valent thallium silicon telluride Tl{sub 6}Si{sub 2}Te{sub 6} in comparison to Tl{sub 6}Ge{sub 2}Te{sub 6}

    SciTech Connect (OSTI)

    Assoud, Abdeljalil [Department of Chemistry, University of Waterloo, Waterloo, Ont., N2L 3G1 (Canada); Soheilnia, Navid [Department of Chemistry, University of Waterloo, Waterloo, Ont., N2L 3G1 (Canada); Kleinke, Holger [Department of Chemistry, University of Waterloo, Waterloo, Ont., N2L 3G1 (Canada)]. E-mail: kleinke@uwaterloo.ca

    2006-08-15

    The title compounds were prepared from the elements in the stoichiometric ratio at 800deg. C under exclusion of air. Tl{sub 6}Si{sub 2}Te{sub 6} crystallizes in the space group P1-bar , isostructural with Tl{sub 6}Ge{sub 2}Te{sub 6}, with a=9.4235(6)A, b=9.6606(7)A, c=10.3889(7)A, {alpha}=89.158(2){sup o}, {beta}=96.544(2){sup o}, {gamma}=100.685(2){sup o}, V=923.3(1)A{sup 3} (Z=2). Its structure is composed of dimeric [Si{sub 2}Te{sub 6}]{sup 6-} units with a Si-Si single bond, while the Tl atoms are irregularly coordinated by five to six Te atoms. Numerous weakly bonding Tl-Tl contacts exist. Both title compounds are black semiconductors with small band gaps, calculated to be 0.9eV for Tl{sub 6}Si{sub 2}Te{sub 6} and 0.5eV for Tl{sub 6}Ge{sub 2}Te{sub 6}. The Seebeck coefficients are +65{mu}VK{sup -1} in case of Tl{sub 6}Si{sub 2}Te{sub 6} and +150{mu}VK{sup -1} in case of Tl{sub 6}Ge{sub 2}Te{sub 6} at 300K, and the electrical conductivities are 5.5 and 3{omega}{sup -1}cm{sup -1}, respectively.

  18. Phase transitions in double perovskite Sr{sub 2}ScSbO{sub 6}: An Ab-initio study

    SciTech Connect (OSTI)

    Ray, Rajyavardhan; Kumar, Uday; Sinha, T. P.

    2014-04-24

    First Principles study of the electronic properties of recently synthesized double perovskite Sr{sub 2}ScSbO{sub 6} have been performed using density functional theory. With increasing temperature, the Sr compound undergoes three structural phase transitions at 400K, 550K and 650K approximately, leading to the following sequence of phases: P21/n ? I2/m ? I4/m ? Fm-3m. Starting from the monoclinic phase P21/n at room temperature, resulting from the Sc/Sb ordering, the electronic structure for the tetragonal I4/m at 613K and cubic Fm-3m for T?660K has been studied in terms of the density of states and band-structure. Presence of large band gap, both direct and indirect, has been reported and analyzed.

  19. Balancing act: Evidence for a strong subdominant d-wave pairing channel in Ba0.6K0.4Fe2As2

    SciTech Connect (OSTI)

    Böhm, T.; Kemper, A. F.; Moritz, B.; Kretzschmar, F.; Muschler, B.; Eiter, H. -M.; Hackl, R.; Devereaux, T. P.; Scalapino, D. J.; Wen, Hai -Hu

    2014-12-18

    We present detailed measurements of the temperature-dependent Raman spectra of optimally doped Ba0.6K0.4Fe2As2 and analyze the low-temperature spectra based on local-density-approximation band-structure calculations and the subsequent estimation of effective Raman vertices. Experimentally, a narrow, emergent mode appears in the B1g (dx2-y2) Raman spectra only below Tc, well into the superconducting state and at an energy below twice the energy gap on the electron Fermi-surface sheets. The Raman spectra can be reproduced quantitatively with estimates for the magnitude and momentum-space structure of an A1g (s-wave) pairing gap on different Fermi-surface sheets, as well as the identification of the emergent sharp feature as a Bardasis-Schrieffer exciton. Formed as a Cooper-pair bound state in a subdominant dx2-y2 channel, the binding energy of the exciton relative to the gap edge shows that the coupling strength in the subdominant channel is as strong as 60% of that in the dominant s-wave channel. This result suggests that dx2-y2 may be the dominant pairing symmetry in Fe-based superconductors that lack central hole bands.

  20. (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl)Strontium(II)

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl)Strontium(II) Citation Details In-Document Search Title: (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl)Strontium(II) × You are accessing a document from the Department of Energy's (DOE) SciTech Connect. This site is a product of DOE's Office of Scientific and Technical Information (OSTI) and is provided as a public service. Visit OSTI to utilize additional information resources

  1. A comparison of the structure and localized magnetism in Ce{sub 2}PdGa{sub 12} with the heavy fermion CePdGa{sub 6}

    SciTech Connect (OSTI)

    Macaluso, Robin T. [Department of Chemistry, Louisiana State University, Baton Rouge, LA 70803 (United States); Millican, Jasmine N. [Department of Chemistry, Louisiana State University, Baton Rouge, LA 70803 (United States); Nakatsuji, Satoru [Department of Physics, Kyoto University, Kyoto, Japan 606-8502 (Japan); Lee, Han-Oh [Department of Physics, University of California, Davis, CA 95616 (United States); Carter, B. [Los Alamos National Laboratory, Los Alamos, NM 87545 (United States); Moreno, Nelson O. [Los Alamos National Laboratory, Los Alamos, NM 87545 (United States); Fisk, Zachary [Department of Physics, University of California, Davis, CA 95616 (United States); Chan, Julia Y. [Department of Chemistry, Louisiana State University, Baton Rouge, LA 70803 (United States)]. E-mail: jchan@lsu.edu

    2005-11-15

    Single crystals of Ce{sub 2}PdGa{sub 12} have been synthesized in Ga flux and characterized by X-ray diffraction. This compound crystallizes in the tetragonal P4/nbm space group, Z=2 with lattice parameters of a=6.1040(2)A and c=15.5490(6)A. It shows strongly anisotropic magnetism and orders antiferromagnetically at T{sub N}{approx}11K. A field-induced metamagnetic transition to the ferromagnetic state is observed below T{sub N}. Structure-property relationships with the related heavy-fermion antiferromagnet CePdGa{sub 6} are discussed.

  2. (2,2-Bipyridyl)bis(eta5-1,2,3,4,5-pentamethylcyclopentadienyl...

    Office of Scientific and Technical Information (OSTI)

    The Sr-centroid distances are 2.571 and 2.561 Angstroms. The N-C-C-N torsion angle in the ... of Publication: United States Language: English Subject: 38; ATOMS; BIPYRIDINES; TORSION

  3. Criticality Safety Study of UF6and UO2F2in 8-in. Inner Diameter Piping

    SciTech Connect (OSTI)

    Elam, K.R.

    2003-10-07

    The purpose of this report is to provide an evaluation of the criticality safety aspects of using up to 8-in.-inner-diameter (ID) piping as part of a system to monitor the {sup 235}U enrichment in uranium hexafluoride (UF{sub 6}) gas both before and after an enrichment down-blending operation. The evaluated operation does not include the blending stage but includes only the monitors and the piping directly associated with the monitors, which are in a separate room from the blending operation. There are active controls in place to limit the enrichment of the blended UF{sub 6} to a maximum of 5 weight percent (wt%) {sup 235}U. Under normal operating conditions of temperature and pressure, the UF{sub 6} will stay in the gas phase and criticality will not be credible. The two accidents of concern are solidification of the UF{sub 6} along with some hydrofluoric acid (HF) and water or moisture ingress, which would cause the UF{sub 6} gas to react and form a hydrated uranyl fluoride (UO{sub 2}F{sub 2}) solid or solution. Of these two types of accidents, the addition of water and formation of UO{sub 2}F{sub 2} is the most reactive scenario and thus limits related to UO{sub 2}F{sub 2} will bound the limits related to UF{sub 6}. Two types of systems are included in the monitoring process. The first measures the enrichment of the approximately 90 wt% enriched UF{sub 6} before it is blended. This system uses a maximum 4-in.-(10.16-cm-) ID pipe, which is smaller than the 13.7-cm-cylinder-diameter subcritical limit for UO{sub 2}F{sub 2} solution of any enrichment as given in Table 1 of American National Standard ANSI/ANS-8.1.1 Therefore, this system poses no criticality concerns for either accident scenario. The second type of system includes two enrichment monitors for lower-enriched UF{sub 6}. One monitors the approximately 1.5 wt% enriched UF{sub 6} entering the blending process, and the second monitors the approximately 5 wt% enriched UF{sub 6} coming out of the blending process. Both use a maximum 8-in.-(20.32-cm-) ID piping, where the length of the larger ID piping is approximately 9.5 m. This diameter of piping is below the 26.6-cm-cylinder-diameter subcritical limit for 5 wt% enriched UO{sub 2}F{sub 2} solutions as given in Table 6 of ANSI/ANS-8.1. Therefore, for up to 5 wt% enriched UF{sub 6}, this piping does not present a criticality concern for either accident scenario. Calculations were performed to determine the enrichment level at which criticality could become a concern in these 8-in.-ID piping sections. Both unreflected and fully water-reflected conditions were considered.

  4. Calorimetric, spectroscopic and structural investigations of phase polymorphism in [Ru(NH{sub 3}){sub 6}](BF{sub 4}){sub 3}. Part I

    SciTech Connect (OSTI)

    Dolega, Diana; Mikuli, Edward; Inaba, Akira; Gorska, Natalia; Holderna-Natkaniec, Krystyna; Nitek, Wojciech

    2013-01-15

    Four crystalline phases of the coordination compound [Ru(NH{sub 3}){sub 6}](BF{sub 4}){sub 3} are identified by adiabatic calorimetry. Three phase transitions, one at T{sub C3}(IV{yields}III)=30.7 K, the second at T{sub C2}(III{yields}II)=91.7 K (both accompanied by comparable entropy changes 3.0 and 3.1 J K{sup -1} mol{sup -1}, respectively) and the third at T{sub C1}(II{yields}I)=241.6 K (accompanied by an entropy change of 8.1 J K{sup -1} mol{sup -1}) were discovered. X-ray single crystal diffraction (at 293 K) demonstrates that phase I is a highly dynamic disordered cubic phase (Fm3{sup Macron }m, No. 225) with two types of BF{sub 4}{sup -} anions differing in a degree of disorder. In phase II (at 170 K) the structure remains cubic (Ia3{sup Macron }, No. 206), with two different types of cations and four different types of anions. Splitting of certain IR bands connected with NH{sub 3} ligands at the observed phase transitions suggests a lowering of the symmetry of the [Ru(NH{sub 3}){sub 6}]{sup 3+} complex cation. Both NH{sub 3} ligands and BF{sub 4}{sup -} anions perform fast reorientations ({tau}{sub R} Almost-Equal-To 10{sup -12} s), which are significantly slowed down below the phase transition at T{sub C3}. {sup 1}H NMR studies led to estimate the values of the activation energy of NH{sub 3} ligands reorientation in the phases II and I as equal to {approx}8 kJ mol{sup -1}. In phase I the whole hexammineruthenium(III) cations reorientation as a tumbling process can be noticed. The activation energy value of this motion is {approx}24 kJ mol{sup -1}. {sup 19}F NMR studies give the values of the activation energy of BF{sub 4}{sup -} anions reorientation as {approx}6 kJ mol{sup -1}. Above the phase transition temperature half of BF{sub 4}{sup -} anions perform a tumbling motion with E{sub a} Almost-Equal-To 8 kJ mol{sup -1}. - Graphical abstract: A series of complementary methods, such as Adiabatic Calorimetry, Differential Scanning Calorimetry, Fourier Transform-Far and Middle Spectroscopy, proton and fluorine Nuclear Magnetic Resonance and structural methods reveal information about phase transitions in [Ru(NH{sub 3}){sub 6}](BF{sub 4}){sub 3}. Highlights: Black-Right-Pointing-Pointer Three novel phase transitions are found in [Ru(NH{sub 3}){sub 6}](BF{sub 4}){sub 3}. Black-Right-Pointing-Pointer The thermodynamic parameters of the phase transitions are derived. Black-Right-Pointing-Pointer The transitions are of order-disorder type. Black-Right-Pointing-Pointer The complex belongs to Fm3{sup Macron }m at 293 K and its symmetry changes to Ia3{sup Macron} at 170 K. Black-Right-Pointing-Pointer [Ru(NH{sub 3}){sub 6}](BF{sub 4}){sub 3} is a highly dynamically disordered crystal.

  5. The Pd/Fe Interface in the Epitaxial System Pd/Fe/GaAs(001)- 4 x 6

    SciTech Connect (OSTI)

    Budnik, P.S.; Gordon, R.A.; Crozier, E.D.

    2007-01-18

    Magnetic properties of thin magnetic films are strongly affected by the nature of the interface between magnetic and non-magnetic layers. In spintronic devices the extent to which spins are scattered at an interface depends upon interfacial roughness, alloying, and impurities. We present a polarization-dependent XAFS study of a 1Pd/9Fe/GaAs(001)-(4 x 6) structure grown in situ in the MBE facility at the PNC/XOR, APS. To increase the interfacial roughness, the 1ML Pd was grown on the 9 ML Fe without first sputtering and annealing the Fe. An estimate of interfacial roughness, evidence for formation of Pd islands, their height, and the amount of As floating to the Pd surface from the GaAs are given.

  6. Data:C6bdf72a-ed0a-4b57-b925-933e6f205d63 | Open Energy Information

    Open Energy Info (EERE)

    under review by our subject matter experts. Jump to: navigation, search Loading... 1. Basic Information 2. Demand 3. Energy << Previous 1 2 3 Next >> Basic Information...

  7. Multispectrum analysis of the v9 band of 12C2H6: Positions, intensities, self- and N2-broadened half-width coefficients

    SciTech Connect (OSTI)

    Devi, V. Malathy; Rinsland, Curtis P.; Benner, D. C.; Sams, Robert L.; Blake, Thomas A.

    2010-06-01

    Line positions, intensities, Lorentz self- and N2-broadened half-width coefficients have been measured for PQ3, PQ2, PQ1, RQ0,RQ1, RQ2, and RQ3 sub-band transitions in the 9 fundamental band of 12C2H6. A multispectrum nonlinear least-squares fitting technique was used to fit up to 17 high-resolution (~0.00156 cm-1), room temperature absorption spectra of pure (99.99% chemical purity) natural sample of ethane and lean mixtures of the high-purity ethane diluted with N2. A Bruker IFS 120HR Fourier transform spectrometer located at the Pacific Northwest National Laboratory (PNNL), in Richland, Washington was used to record the data. A standard Voigt line shape was assumed to fit all the data since no line mixing or other non Voigt line shapes were required to fit any of the spectra used in the analysis. Short spectral intervals (~2 to 2.5 cm-1) of all 17 spectra covering a specific PQ or RQ sub band were fit simultaneously. For the first time in an ethane band, pressure-broadened half-width coefficients were determined for each of the torsional-split components. Constraints were used such that the half-width coefficients of both torsional-split components were identical for a specific broadening gas. No pressure-induced shift coefficients were necessary to fit the spectra to their noise level. The present study revealed for the first time the dependence of self- and N2-broadened half-width coefficients upon the J, K quantum numbers of the transitions in ethane. A number of transitions belonging to the 9+ 4- 4 and the 9+2 4-2 4 hot bands were also observed in the fitted regions and measurements were made when possible.

  8. Stark and Zeeman effect in the [18.6]3.5 – X(1)4.5 transition of uranium monofluoride, UF

    SciTech Connect (OSTI)

    Linton, C.; Adam, A. G.; Steimle, T. C.

    2014-06-07

    High resolution spectra of the 0-0 band of the [18.6]3.5 – X(1)4.5 transition of uranium monofluoride, UF, obtained using a laser ablation spectrometer, showed a perturbation in the upper state. Examination of the Stark and Zeeman effects yielded permanent electric dipole moments of 2.01 and 1.88 D and magnetic g-factors of 3.28 and 3.26 for the ground and excited states, respectively. Both the dipole moment and g-factor of the ground state are in good agreement with ab initio calculations [I. O. Antonov and M. C. Heaven, J. Phys. Chem. A 117, 9684 (2013)]. The Zeeman effect results confirm that the ground state arises primarily from the U{sup +}(5f {sup 3}7s{sup 24}I{sub 4.5})F{sup −} configuration and suggest several possible configurations for the upper state.

  9. Hydrothermal synthesis and crystal structure of a new inorganic/organic hybrid of scandium sulfate: (H{sub 2}en)Sc{sub 2}(SO{sub 4}){sub 4}.(H{sub 2}O){sub 0.72}

    SciTech Connect (OSTI)

    Lu Jianjiang [Materials Science Division, Argonne National Laboratory, 9700 S Cass Avenue, Argonne, IL 60439 (United States)]. E-mail: j.lu@anl.gov; Schlueter, John A. [Materials Science Division, Argonne National Laboratory, 9700 S Cass Avenue, Argonne, IL 60439 (United States); Geiser, Urs [Materials Science Division, Argonne National Laboratory, 9700 S Cass Avenue, Argonne, IL 60439 (United States)

    2006-05-15

    The first organically templated layered structure of scandium sulfate, (H{sub 2}en)Sc{sub 2}(SO{sub 4}){sub 4}.(H{sub 2}O){sub 0.72}, (en=ethylenediamine) was synthesized by a hydrothermal method and characterized by single crystal X-ray diffraction. In the title compound, scandium ions are bridged by sulfate groups with a ratio of 1:2 into a 4{sub 3}{sup 6} layer structure. These layers are parallel packed and separated from each other by ethylenediammonium dications and water molecules. The title compound crystallizes in the monoclinic space group P2/c, with cell parameters a=8.5966(13)A, b=5.1068(8)A, c=18.847(3)A, {beta}=91.210(3){sup o}, V=827.2(2)A{sup 3} and Z=2. Refinement gave R{sub 1}[I>2{sigma}(I)]=0.0354 and wR{sub 2}[I>2{sigma}(I)]=0.0878. Thermogravimetric analysis indicates that this material is thermally stable to above 400 deg. C.

  10. Table HC1.2.4 Living Space Characteristics by Average Floorspace--Apartments, 2

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

    2.4 Living Space Characteristics by Average Floorspace--Apartments, 2005" ,,,"Average Square Feet per Apartment in a --" ," Housing Units (millions)" ,,,"2 to 4 Unit Building",,,"5 or More Unit Building" ,,"Apartments (millions)" "Living Space Characteristics",,,"Total","Heated","Cooled","Total","Heated","Cooled" "Total",111.1,24.5,1090,902,341,872,780,441

  11. Buildings Energy Data Book: 6.2 Electricity Generation, Transmission, and Distribution

    Buildings Energy Data Book [EERE]

    0 Top 10 U.S. States by Existing Wind Power Capacities Capacity Under Construction State (MW) (%) (MW) Texas 9,727 27% 350 Iowa 3,670 10% 0 California 2,739 7% 443 Oregon 2,095 6% 201 Washington 1,964 5% 735 Illinois 1,848 5% 587 Minnesota 1,818 5% 677 New York 1,274 3% 95 Colorado 1,248 3% 552 Indiana 1,238 3% 99 U.S. Total Note(s): Source(s): Existing Capacity 36,698 6,925 Estimates of existing capacity and capacity under construction are current as of September 2010. Does not include small

  12. Spectral studies of copper(II) complexes of 6-(3-thienyl) pyridine-2-thiosemicarbazone

    SciTech Connect (OSTI)

    Mahjoub, Omima Abdalla; Farina, Yang

    2014-09-03

    Two novel copper(II) complexes [Cu(HL)Cl]Cl.H{sub 2}O (1) and [Cu(L)NO{sub 3}]МH{sub 2}O (2) of the three NNS donor thiosemicarbazone ligand 6-(3-thienyl) pyridine-2-thiosemicarbazone have been synthesized. The ligand and its copper(II) complexes were characterized by elemental analysis (C, H, N, and S), FT-IR, UV-visible, magnetic susceptibility and molar conductance. The thiosemicarbazone is present either as the thione form in complex 1 or as thiol form in complex 2 and is coordinated to copper(II) atom via the pyridine nitrogen atom, the azomethine nitrogen atom and the sulfur atom. The physicochemical and spectral data suggest square planar geometry for copper(II) atoms.

  13. User's guide for ENVSTD24 program, Version 2. 4

    SciTech Connect (OSTI)

    Hanlon, R.L.; Connell, L.M.

    1993-05-01

    On January 30, 1989, the US Department of Energy (DOE) promulgated an interim rule entitled [open quotes]Energy Conservation Voluntary Performance Standards for New Commercial and Multi-Family High Rise Residential Buildings; Mandatory for New Federal Buildings[close quotes] (10 CFR Part 435, Subpart A). These standards require federal agencies to design all future federal commercial and multifamily high-rise residential buildings in accordance with the standards, or demonstrate that their current requirements already meet or exceed the energy-efficiency requirements of the standards. Although these newly enacted standards do not regulate the design of nonfederal buildings, the DOE recommends that all design professionals use the standards as guidelines for designing energy-conserving buildings. To encourage private sector use, the DOE published the standards in the January 30, 1989, Federal Register in the format typical of commercial standards. The Pacific Northwest Laboratory developed several computer programs for the DOE to make it easier for designers to comply with the standards. One of the programs, ENVSTD24 (Version 2.4), is detailed in this user's guide and is provided on the accompanying diskettes. The program will facilitate the designer's use of the standards dealing specifically with building envelope design. Using this program will greatly simplify the designer's task of performing the calculations needed to determine if a design complies with the standards.

  14. Materials Data on CuH6(CO2)4 (SG:61) by Materials Project

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

    Kristin Persson

    2015-01-27

    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 Li6Cr9(PO4)8 (SG:2) 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. State","Week 1","Week 2","Week 3","Week 4","Week 5","Week 6"...

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

    667,20965,21498,19323,24245,24370,25018,25288,24949,24722,24974,23215,25866,26268,25591,17147,17077,1344305 "Arizona",85010,250233,257994,266772,232538,238842,254492,256778,227326,...

  17. Materials Data on Li2CuPO4 (SG:6) 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 Li6Cu9(PO4)8 (SG:2) 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 Li6Fe9(PO4)8 (SG:2) by Materials Project

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

    Kristin Persson

    2015-03-23

    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. Microsoft Word - m460.2-1aFinal6-4-08.doc

    National Nuclear Security Administration (NNSA)

    ... Office of Inspector General, Bonneville Power Administration, Southeastern Power ... to ensure that shipments use high quality carriers and drivers; * Shipment ...

  1. Synthesis and purification of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB)

    DOE Patents [OSTI]

    Mitchell, Alexander R.; Coburn, Michael D.; Lee, Gregory S.; Schmidt, Robert D.; Pagoria, Philip F.; Hsu, Peter C.

    2006-06-06

    A method to convert surplus nitroarene explosives (picric acid, ammonium picrate,) into TATB is described. The process comprises three major steps: conversion of picric acid/ammonium picrate into picramide; conversion of picramide to TATB through vicarious nucleophilic substitution (VNS) of hydrogen chemistry; and purification of TATB.

  2. Microsoft PowerPoint - Herb_Presentation 6-10-09 (2).ppt

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

    Southeastern Power Administration Southwestern Federal Hydropower Conference Hydropower Pump-back Projects/Perspectives 2 System Overview Pump Storage Facilities Marketing Issues Operational Considerations Pump Storage as a Generation Resource Presentation Points Southeastern Power Administration 3 Southeastern Power Administration 4 5 System Overview Pump Storage Facilities Marketing Issues Operational Considerations Pump Storage as a Generation Resource Presentation Points Southeastern Power

  3. Buildings Energy Data Book: 6.2 Electricity Generation, Transmission, and Distribution

    Buildings Energy Data Book [EERE]

    2 Net Internal Demand, Capacity Resources, and Capacity Margins in the Contiguous United States (GW) Net Internal Capacity Capacity Demand (1) Resources (2) Margin (3) 1995 1996 1997 1998 1999 2000 2001 2002 2003 2004 2005 2006 2007 2008 2009 2010 2011 2012 2013 2014 2015 Note(s): Source(s): 778.5 980.3 20.6% 1) Net internal demand represents the system demand that is planned for by the electric power industry`s reliability authority and is equal to internal demand less direct control load

  4. 6tab.xlsx

    Gasoline and Diesel Fuel Update (EIA)

    million short tons) Production ........................................... 240.2 211.1 237.3 206.8 165.1 171.0 208.3 201.2 192.6 177.6 209.7 198.0 895.4 745.7 777.9 Appalachia ....................................... 62.3 54.6 56.5 50.6 40.3 45.6 53.2 51.1 50.4 49.3 52.0 49.1 224.0 190.2 200.8 Interior .............................................. 45.2 38.9 45.2 39.7 31.0 34.7 45.1 43.3 40.8 38.5 45.5 42.8 169.1 154.1 167.7 Western ........................................... 132.7 117.6 135.5

  5. Crystallization of lysozyme with (R)-, (S)- and (RS)-2-methyl-2, 4-pentanediol

    SciTech Connect (OSTI)

    Stauber, Mark; Jakoncic, Jean; Berger, Jacob; Karp, Jerome M.; Axelbaum, Ariel; Sastow, Dahniel; Buldyrev, Sergey V.; Hrnjez, Bruce J.; Asherie, Neer

    2015-03-01

    Crystallization of lysozyme with (R)-2-methyl-2, 4-pentanediol produces more ordered crystals and a higher resolution protein structure than crystallization with (S)-2-methyl-2, 4-pentanediol. The results suggest that chiral interactions with chiral additives are important in protein crystal formation. Chiral control of crystallization has ample precedent in the small-molecule world, but relatively little is known about the role of chirality in protein crystallization. In this study, lysozyme was crystallized in the presence of the chiral additive 2-methyl-2, 4-pentanediol (MPD) separately using the R and S enantiomers as well as with a racemic RS mixture. Crystals grown with (R)-MPD had the most order and produced the highest resolution protein structures. This result is consistent with the observation that in the crystals grown with (R)-MPD and (RS)-MPD the crystal contacts are made by (R)-MPD, demonstrating that there is preferential interaction between lysozyme and this enantiomer. These findings suggest that chiral interactions are important in protein crystallization.

  6. Buildings Energy Data Book: 4.2 Federal Buildings and Facilities Characteristics

    Buildings Energy Data Book [EERE]

    2 Federal Buildings and Facilities Characteristics March 2012 4.2.1 Federal Building Gross Floorspace, by Year and Agency Fiscal Year Agency FY 1985 3.37 DOD 63% FY 1986 3.38 USPS 10% FY 1987 3.40 GSA 6% FY 1988 3.23 VA 5% FY 1989 3.30 DOE 3% FY 1990 3.40 Other 13% FY 1991 3.21 Total 100% FY 1992 3.20 FY 1993 3.20 FY 1994 3.11 FY 1995 3.04 FY 1996 3.03 FY 1997 3.02 FY 1998 3.07 FY 1999 3.07 FY 2000 3.06 FY 2001 3.07 FY 2002 3.03 FY 2003 3.04 FY 2004 2.97 FY 2005 2.96 FY 2006 3.10 FY 2007 3.01

  7. update4_supplemental_lists_1c_2c_2c3b_041411updated_051711.xls | Department

    Energy Savers [EERE]

    of Energy update4_supplemental_lists_1c_2c_2c3b_041411updated_051711.xls update4_supplemental_lists_1c_2c_2c3b_041411updated_051711.xls Office spreadsheet icon update4_supplemental_lists_1c_2c_2c3b_041411updated_051711.xls More Documents & Publications List 2: Eligible Multifamily Buildings 10-CFR-440.22(b)(4)(ii) updated_supplemental_lists_1h-2h-3g- 11-4-2011.xlsx updated_supplemental_lists_1j-2j-3i_12-22-2011.xlsx

  8. Microsoft Word - T4_VEIC_TO2_ Sub3_Residential Retrofit Program...

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

    Microsoft Word - T4VEICTO2 Sub3Residential Retrofit Program Design Guide Play BookTEAM 4 FINAL.docx Microsoft Word - T4VEICTO2 Sub3Residential Retrofit Program Design ...

  9. Exotic magnetism on the quasi-FCC lattices of the d3 double perovskites La2NaB'O6 (B' = Ru, Os)

    SciTech Connect (OSTI)

    Aczel, Adam A; Baker, Peter J.; Bugaris, Dan; Yeon, Jeongho; Zur Loye, Hans-Conrad; Guidi, T.; Adroja, D. T.

    2014-01-01

    We find evidence for long-range and short-range ($\\zeta$~$=$~70~\\AA~at 4~K) incommensurate magnetic order on the quasi-face-centered-cubic (FCC) lattices of the monoclinic double perovskites La$_2$NaRuO$_6$ and La$_2$NaOsO$_6$ respectively. Incommensurate magnetic order on the FCC lattice has not been predicted by mean field theory, but may arise via a delicate balance of inequivalent nearest neighbour and next nearest neighbour exchange interactions. In the Ru system with long-range order, inelastic neutron scattering also reveals a spin gap $\\Delta$~$\\sim$~2.75~meV. Magnetic anisotropy is generally minimized in the more familiar octahedrally-coordinated $3d^3$ systems, so the large gap observed for La$_2$NaRuO$_6$ may result from the significantly enhanced value of spin-orbit coupling in this $4d^3$ material.

  10. Final Project Report Project 10749-4.2.2.1 2007-2009

    SciTech Connect (OSTI)

    Zacher, Alan H.; Holladay, Johnathan E.; Frye, J. G.; Brown, Heather M.; Santosa, Daniel M.; Oberg, Aaron A.

    2009-05-11

    This is the final report for the DOE Project 10749-4.2.2.1 for the FY2007 - FY2009 period. This report is non-proprietary, and will be submitted to DOE as a final project report. The report covers activities under the DOE Project inside CRADA 269 (Project 53231) as well as project activites outside of that CRADA (Project 56662). This is the final report that is summarized from the non-proprietary quarterlies submitted to DOE over the past 2.5 years, which in turn are summaries from the proprietary technical reporting to UOP.

  11. The first mixed-halide zirconium cluster compounds: Zr{sub 6}Cl{sub 1.6}I{sub 10.4}Be, Zr{sub 6}Cl{sub 1.3}I{sub 10.7}B, and Zr{sub 6}Cl{sub 11.5}I{sub 1.5}B. Matrix effects and halogen substitution in compact network structures

    SciTech Connect (OSTI)

    Koeckerling, M.; Qi, R.Y.; Corbett, J.D.

    1996-03-13

    Investigations of the effect of halogen size on structure stability have been conducted in well-reduced and heavily interbridged zirconium chloride-iodide cluster systems. The title compounds are obtained in good yields from reactions of Zr, ZrCl{sub 4}, ZrI{sub 4}, and B or Be in sealed Ta tubes for {approximately} 4 weeks at 850 {degrees}C. Single-crystal diffraction at room temperature established these as Zr{sub 6}Cl{sub 1.65(4)}I{sub 10.35(4)}Be and Zr{sub 6}Cl{sub 1.27/(3)}. These are derivatives of the Zr{sub 6}I{sub 12}C and orthorhombic Zr{sub 6}Cl{sub 13}B structures, respectively, the latter containing unusual linear chains of clusters interbridged by Cl{sup i-i} that are in turn interconnected by three-bonded Cl{sup a-a-a} atoms. The random substitution of fractional Cl at specific I sites in the first two, and I for certain Cl in the third, was positionally resolved in all cases. The replacement always occurs at two-bonded X{sup i}, so that single types of halogen are left in sites that interconnected clusters and generate the three-dimensional array. Structural changes seen in both structures are specifically related to relief of X{hor_ellipsis}X crowding in the parent structure (matrix effects). Substitution of Cl for I{sup i} in the Zr{sub 6}I{sub 12}C type greatly reduces intercluster I{hor_ellipsis}I repulsions and allows, among other things, a 0.20 {Angstrom} (5.8*5) reduction in Zr-I{sup 1-i} intercluster bond lengths. Increased Cl{hor_ellipsis}I repulsions caused by I substitution in orthorhombic Zr{sub 6}Cl{sub 11.5}I{sub 1.5}B. Phase widths found are 0{le} x {le} 1.4 for Zr{sub 6}Cl{sub x}I{sub 12-x}Z (Z=B, Be) and 0 {le} x {le} 1.5 for Zr{sub 6}Cl{sub 13-x}I{sub x}B. The limit for iodine substitution in the chlorine-rich rhombohedral Zr{sub 6}Cl{sub 12-x}I{sub x}Be is about x=2.5.

  12. Exemption 6

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

    Exemption 6 Exemption 6

  13. X-ray crystal structure of (6-n-propyl-2-thiouracilato)(triethylphosphine) gold (I)

    SciTech Connect (OSTI)

    Cookson, P.D.; Tiekink, E.R.T. )

    1993-03-01

    The crystal structure of the title compound [Et[sub 3]PAu(PRU)] is reported. There are two molecules in the asymmetric unit and each of the independent Au atoms exists in a linear geometry defined by a P atom of the phosphine ligand and a thiolate S atom derived from the thionucleobase; molecule 1: Au-P 2.255(5), Au-S 2.314(5)[Angstrom], P-Au-S 176.0(2)[degrees] and molecule 2: Au-P 2.249(5), Au-S 2.328(4)[Angstrom] and hydrogen bonding interactions involving the oxo and N-H groups. Crystals are monoclinic, space group P2[sub 1]/c with unit cell dimensions: a = 21.445(2), b = 8.931(2), c = 17.956(3)[Angstrom]; [Beta] = 96.091(1)[degrees] and Z = 89. The structure was refined by a full-matrix least-squares procedure to final R = 0.053 using 2875 reflections with I [ge] 3.0[sigma](I).

  14. ch_4

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

    20 Affected Environment 4.6 Geology and Soils This section describes the geological, mineral resources, seismic, and volcanic characteristics of INEEL, INTEC, and surrounding areas. A more detailed description of geology at INEEL can be reviewed in the SNF & INEL EIS, Volume 2, Part A, Section 4.6 (DOE 1995). 4.6.1 GENERAL GEOLOGY INEEL occupies a relatively flat area on the northwestern edge of the Eastern Snake River Plain. Figure 4-4 shows important geological features of the INEEL area.

  15. Crystal structure and magnetic properties and Zn substitution effects on the spin-chain compound Sr{sub 3}Co{sub 2}O{sub 6}

    SciTech Connect (OSTI)

    Wang, Xia [Superconducting Properties Unit, National Institute for Materials Science, 1-1 Namiki, Tsukuba Ibaraki 305-0044 (Japan); Department of Chemistry, Graduate School of Science, Hokkaido University, Sapporo, Hokkaido 060-0810 (Japan); Guo, Yanfeng, E-mail: Yangfeng.Guo@physics.ox.ac.uk [Superconducting Properties Unit, National Institute for Materials Science, 1-1 Namiki, Tsukuba Ibaraki 305-0044 (Japan); Sun, Ying [International Center for Materials Nanoarchitectonics (WPI-MANA), National Institute for Materials Science, 1-1 Namiki, Tsukuba Ibaraki 305-0044 (Japan); Tsujimoto, Yoshihiro [Materials Processing Unit, National Institute for Materials Science, 1-2-1 Sengen, Tsukuba Ibaraki 305-0047 (Japan); Matsushita, Yoshitaka [Materials Analysis Station, National Institute for Materials Science, 1-2-1 Sengen, Tsukuba Ibaraki 305-0047 (Japan); Yamaura, Kazunari, E-mail: yamaura.kazunari@nims.go.jp [Superconducting Properties Unit, National Institute for Materials Science, 1-1 Namiki, Tsukuba Ibaraki 305-0044 (Japan); Department of Chemistry, Graduate School of Science, Hokkaido University, Sapporo, Hokkaido 060-0810 (Japan)

    2013-08-15

    The effects of substituting Co on the spin-chain compound Sr{sub 3}Co{sub 2}O{sub 6} with Zn were investigated by synchrotron X-ray diffraction, magnetic susceptibility, isothermal magnetization, and specific heat measurements. To the best of our knowledge, this is the first report to describe the successful substitution of Co in Sr{sub 3}Co{sub 2}O{sub 6} with Zn. The substitution was carried out by a method involving high pressures and temperatures to obtain Sr{sub 3}CoZnO{sub 6}, which crystalized into a K{sub 4}CdCl{sub 6}-derived rhombohedral structure with a space group of R-3c, similar to the host compound. With the Zn substitution, the Ising-type magnetic anisotropy of the host compound remarkably reduced; the newly formed Sr{sub 3}CoZnO{sub 6} became magnetically isotropic with Heisenberg-type characteristics. This could probably be ascribed to the establishment of a different interaction pathway, Co{sup 4+}(S=1/2)OZn{sup 2+}(S=0)OCo{sup 4+}(S=1/2). Details of the magnetic properties of Zn substituted Sr{sub 3}Co{sub 2}O{sub 6} were reported. - Graphical abstract: Crystal structure of the spin-chain compound Sr{sub 3}CoZnO{sub 6} synthesized at 6 GPa. Zn atoms preferably occupy the trigonal prism sites rather than the octahedral sites. As a result, the compound is much magnetically isotropic. Highlights: Effects of substituting Co with Zn on spin-chain magnetism of Sr{sub 3}Co{sub 2}O{sub 6} were studied. High-pressure synthesis resulted in a solid solution of Sr{sub 3}CoZnO{sub 6}. Sr{sub 3}CoZnO{sub 6} showed more isotropic magnetism than the host Sr{sub 3}Co{sub 2}O{sub 6}.

  16. Partial substitution of Mo{sup 6+} by S{sup 6+} in the fast oxide ion conductor La{sub 2}Mo{sub 2}O{sub 9}: Synthesis, structure and sulfur depletion

    SciTech Connect (OSTI)

    Mhadhbi, Noureddine; Corbel, Gwenaeel; Lacorre, Philippe; Bulou, Alain

    2012-06-15

    Powder-solid state reaction route using La{sub 2}(SO{sub 4}){sub 3} as sulfur source was used to prepare compositions of the solid solution La{sub 2}Mo{sub 2-y}S{sub y}O{sub 9}. Single phases were only obtained in the substitution range extending up to y=0.8 (40 mol% S) at the annealing temperature of 850 Degree-Sign C with regard to the limit of stability of the lanthanum sulphate reactant. Within the synthesis conditions, a stabilization of the high temperature {beta}-form is observed from and above y=0.1 (5 mol% S). Temperature-controlled X-ray diffraction and thermogravimetric analyses have shown that La{sub 2}Mo{sub 2-y}S{sub y}O{sub 9} raw powders undergo thermal decompositions in two steps. Heating above 900 Degree-Sign C, a sulfur depletion to the benefit of molybdenum in La{sub 2}Mo{sub 2-y}S{sub y}O{sub 9} raw powders leads to the formation of La{sub 2}SO{sub 6}. At higher temperature, the exsolved La{sub 2}SO{sub 6} phase then decomposes into La{sub 2}O{sub 3}, which in turn reacts with the sulfur-depleted La{sub 2}Mo{sub 2}O{sub 9} phase to form La{sub 2}MoO{sub 6}. The present study also reveals that depending on the substitution rate y, the sulfur depletion can be induced by ball-milling of raw powders. Along the La{sub 2}Mo{sub 2-y}S{sub y}O{sub 9} series, the isovalent substitution of molybdenum by sulfur tends to restrict in magnitude, or even to suppress above 400 Degree-Sign C, the distortive thermal expansion of the cubic {beta}-type structure, thus strongly decreasing the conductance at high temperature. - Graphical abstract: La{sub 2}O{sub 3}-MoO{sub 3}-'SO{sub 3}' ternary phase diagram showing the exsolution path at low temperature (white arrows) and the total decomposition path at high temperature (black arrows) of {beta}-La{sub 2}Mo{sub 2-y}S{sub y}O{sub 9} raw powders. Highlights: Black-Right-Pointing-Pointer Isovalent substitution of molybdenum by sulfur in La{sub 2}Mo{sub 2}O{sub 9} up to 40 mol%. Black-Right-Pointing-Pointer Stabilization of the {beta}-form for a sulfur content greater than or equal to 5 mol%. Black-Right-Pointing-Pointer Decomposition by sulfur exsolution induced by thermal treatment or ball-milling. Black-Right-Pointing-Pointer Reduction or even cancellation of the distortive thermal expansion above 400 Degree-Sign C. Black-Right-Pointing-Pointer Decrease of conductance at high T involved by the low thermal expansion above 400 Degree-Sign C.

  17. Synthesis of 6-Methyl-9-n-propyldibenzothiophene-4-ol. Quarterly technical progress report No. 5, July 28--October 28, 1991

    SciTech Connect (OSTI)

    Not Available

    1991-10-28

    The material presented here has been described to some extent in Status Reports 12, 13, and 14 and covers the progress toward the synthesis of the modified target molecules 9-isopropyl-4-methoxy-6-methyldibenzothiophene (13) and 9-isopropyl-6-methyldibenzothiophene-4-ol (14). It is divided into three parts: (a) Dehydrogenation experiments On tetrahydrodibenzothiophene 12. (b) methoxyl methyl cleavage of 13 to 14 using boron tribromide. (c) isolation and purification of methoxydibenzothiophene 13.

  18. CuYb{sub 2}Ge{sub 4}O{sub 12}, a new bidimensionally tunneled structure

    SciTech Connect (OSTI)

    Campa, J.A.; Cascales, C.; Gueierrez-Puebla, E.; Monge, M.A.; Rasines, I.; Ruiz Valero, C.

    1996-06-01

    Employing CuO as self flux crystals of CuYb{sub 2}Ge{sub 4}O{sub 12} have been grown for the first time. The crystal structure of CuYb{sub 2}Ge{sub 4}O{sub 12} has been determined by single-crystal X-ray diffraction in the triclinic P1 (No. 2) space group to an R value of 6.1%, with (a) = 7.156(2) {Angstrom}, (b) = 7.937(3) {Angstrom}, (c) = 4.905(3) {Angstrom}, {alpha} = 86.63(3){degrees}, {Beta} = 102.41(4){degrees}, {gamma}=1114.12(3){degrees}, V = 248.2(2) {Angstrom}{sup 3}, Z = 1, and D{sub c} = 5.97 gcm{sup {minus}3}. The novel tridimensional CuYb{sub 2}Ge{sub 4}O{sub 12} structure type can be conceived as formed by layers of (GeO{sub 4}){sub 4} units of vertex-sharing GeO{sub 4} squares connecting (GeO{sub 4}){sub 4} units, with channels or tunnels of size up to 4.08 {Angstrom} in the a and c directions. A comparison is made between the structure types of the title germanate and recently reported CuNd{sub 2}Ge{sub 2}O{sub 8}. The temperature dependence from 350 to 1.8 K of the reciprocal dc magnetic susceptibility for CuYb{sub 2}Ge{sub 4}O{sub 12} is shown and presents a deviation from linearity over the whole temperature range. The infrared spectrum between 1000 and 100 cm{sup {minus}1} is given and related with those of comparable species.

  19. Enforcement Letter, CH2M Hill- October 4, 2004

    Broader source: Energy.gov [DOE]

    Issued to CH2M Hill related to at a Lapse in Dosimetry Accreditation at the Separations Process Research Unit

  20. Synthesis of bimetallic barium titanium alkoxides as precursors for electrical ceramics. Molecular structure of the new barium titanium oxide alkoxide Ba[sub 4]Ti[sub 13]([mu][sub 3]-O)[sub 12]([mu][sub 5]-O)[sub 6]([mu][sub 1]-[eta][sup 1]-OCH[sub 2]CH[sub 2]OCH[sub 3])[sub 12]([mu][sub 1],[mu][sub 3]-[eta][sup 2]-OCH[sub 2]CH[sub 2]OCH[sub 3])[sub 12

    SciTech Connect (OSTI)

    Campion, J.F.; Payne, D.A.; Chae, H.K.; Maurin, J.K.; Wilson, S.R. )

    1991-08-21

    Complex alkoxides are promising precursors for the preparation of fine ceramic powders, thin-layer devices, and fibers. Hydrolysis and condensation of alkoxides result in the formation of oligomeric structures in solution and in the eventual formation of a gel. The formation of heterometallic species can lead to chemical homogeneity at the molecular level. Although there are numerous examples of bimetallic alkoxides in the literature, less is known regarding the structure of partial hydrolysis products. A better understanding of the sol-gel processing of ceramics could result from a study of hydrolysis and polycondensation reactions in complex alkoxides. The investigation described herein has as its objective the study of the synthesis and hydrolysis of heterometallic alkoxide precursors for barium titanate ceramics. For example, BaTiO[sub 3] is used in high dielectric constant capacitor materials, and Ba[sub 4]Ti[sub 13]O[sub 30], in high-frequency resonators.