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Sample records for 5posub 4sub 3f

  1. Diode-pumped Yb:Sr{sub 5}(PO{sub 4}){sub 3}F laser performance

    SciTech Connect

    Marshall, C.D.; Payne, S.A.; Smith, L.K.

    1995-03-17

    The performance of the first diode-pumped Yb{sup 3+}-doped Sr{sub 5}(PO{sub 4}){sub 3}F (Yb:S-FAP) laser is discussed. We found the pumping dynamics and extraction cross-sections of Yb:S-FAP crystals to be similar to those previously inferred by purely spectroscopic techniques. The saturation fluence for pumping was measured to be 2.2 J/cm{sup 2} using three different methods based on either the spatial, temporal, or energy transmission properties of a Yb:S-FAP rod. The small signal gain implies an emission cross section of 6.0 x 10{sup -20} cm{sup 2} that falls within error bars of the previously reported value of 7.3 x 10{sup -20} cm{sup 2}, obtained from spectroscopic techniques. Up to 1.7 J/cm{sup 3} of stored energy density was achieved in a 6 x 6 x 44 mm Yb:S-FAP amplifier rod. An InGaAs diode array has been fabricated that has suitable specifications for pumping a 3 x 3 x 30 mm Yb:S-FAP rod. In a free running configuration diode-pumped slope efficiencies up to 43% were observed with output energies up to {approximately}0.5 J per 1 ms pulse. When the rod was mounted in a copper block for cooling, 13 W of average power was produced with power supply limited operation at 70 Hz and 500 {mu}s pulses.

  2. Solvothermal indium fluoride chemistry: Syntheses and crystal structures of K{sub 5}In{sub 3}F{sub 14}, beta-(NH{sub 4}){sub 3}InF{sub 6} and [NH{sub 4}]{sub 3}[C{sub 6}H{sub 21}N{sub 4}]{sub 2}[In{sub 4}F{sub 21}

    SciTech Connect

    Jayasundera, Anil C.A.; Goff, Richard J.; Li Yang; Finch, Adrian A.; Lightfoot, Philip

    2010-02-15

    The solvothermal syntheses and crystal structures of three indium fluorides are presented. K{sub 5}In{sub 3}F{sub 14} (1) and beta-(NH{sub 4}){sub 3}InF{sub 6} (2) are variants on known inorganic structure types chiolite and cryolite, respectively, with the latter exhibiting a complex and apparently novel structural distortion. [NH{sub 4}]{sub 3}[C{sub 6}H{sub 21}N{sub 4}]{sub 2}[In{sub 4}F{sub 21}] (3) represents a new hybrid composition displaying a unique trimeric metal fluoride building unit. - Graphical abstract: Solvothermal synthesis has been used to prepare three indium fluorides, including a novel hybrid material containing a unique [In{sub 3}F{sub 15}] trimer templated by tren.

  3. Diode-laser-pumped 1.065-{mu}m Nd:Sr{sub 5}(VO{sub 4}){sub 3}F laser and its intracavity frequency doubling

    SciTech Connect

    Zhao, S.; Wang, Q.; Zhang, X.; Wang, S.; Zhao, L.; Sun, L.; Zhang, S.

    1996-12-01

    Nd:Sr{sub 5}(VO{sub 4}){sub 3}F, known as Nd:S-VAP, is a new material for efficient and miniature diode-pumped solid state lasers. By using a laser-diode pump operating at 809 nm, Nd:S-VAP is successfully lased at 1.065 {mu}m. A slope efficiency of 43.5{percent} and a laser threshold of only 11 mW are measured. The theoretical formulas for threshold power and slope efficiency are written and the theoretical calculations are in agreement with the experimental results. In addition, by using KTP as an intracavity-doubling crystal, the intracavity frequency of the Nd:S-VAP laser at 0.5325 {mu}m is also realized. The threshold power is 13.2 mW and the TEM{sub 00} mode green laser output power is 25.6 mW at 200 mW incident pump power, corresponding to an optical efficiency of 12.8{percent}. In addition a way to improve efficiency is discussed. {copyright} {ital 1996 Society of Photo{minus}Optical Instrumentation Engineers.}

  4. Mild hydrothermal synthesis, crystal structure, thermal behavior, spectroscopic and magnetic properties of the (NH{sub 4})[Fe(AsO{sub 4}){sub 1-x}(PO{sub 4}){sub x}F] (x=0.3, 0.6, 0.8) series. Thermal transformation of (NH{sub 4})[Fe(AsO{sub 4}){sub 0.7}(PO{sub 4}){sub 0.3}F] into the textural porous orthorhombic Fe(AsO{sub 4}){sub 0.7}(PO{sub 4}){sub 0.3}

    SciTech Connect

    Berrocal, Teresa

    2009-04-15

    The (NH{sub 4})[Fe(AsO{sub 4}){sub 1-x}(PO{sub 4}){sub x}F] (x=0.3, 0.6, 0.8) series of compounds has been synthesized under mild hydrothermal conditions. The compounds crystallize in the orthorhombic Pna2{sub 1} space group, with the unit-cell parameters a=13.1718(1), b=6.5966(6), c=10.797(1) A for x=0.3; a=13.081(1), b=6.5341(6), c=10.713(1) A for x=0.6 and a=13.0329(9), b=6.4994(4), c=10.6702(6) A for x=0.8, with the volumes 938.6(1), 915.7(1) and 903.8(1) A{sup 3}, respectively, with Z=8. Single crystals of (NH{sub 4})[Fe(AsO{sub 4}){sub 0.7}(PO{sub 4}){sub 0.3}F] heated under air atmosphere at 465 deg. C remain as single crystals, changing the composition to Fe(AsO{sub 4}){sub 0.7}(PO{sub 4}){sub 0.3}. This later phase belongs to the orthorhombic Imam space group, with the unit cell parameters a=13.328(2), b=6.5114(5), c=10.703(1) A, V=928.9(2) A{sup 3} and Z=12. The crystal structure of the ammonium phases consists of a KTP three-dimensional framework constructed by chains formed by alternating Fe(2)O{sub 4}F{sub 2} or Fe(1)O{sub 4}F{sub 2} octahedra and As/P(2)O{sub 4} or As/P(1)O{sub 4} tetrahedra, respectively. These octahedra and tetrahedra are linked by a common oxygen vertex. The chains run along the 'a' and 'b' crystallographic axes. The crystal structure of Fe(AsO{sub 4}){sub 0.7}(PO{sub 4}){sub 0.3} is a three-dimensional skeleton derived from that of the precursor, formed from (100) sheets stacked along the [001] direction, and interconnected by chains of alternating Fe(2)O{sub 6} octahedra and As/P(2)O{sub 4} tetrahedra sharing a vertex in the 'a' direction. Transmission electronic microscopy of this compound indicates the existence of unconnected external cavities with a BET surface area of 3.91(3) m{sup 2} g{sup -1}. The diffuse reflectance spectra in the visible region show the forbidden electronic transitions characteristic of the Fe(III) d{sup 5}-high spin cation in slightly distorted octahedral geometry, for all the compounds. The ESR spectra

  5. Investigation of structural and luminescent properties of Ce{sup 3+}/Mn{sup 2+} ions-doped Ca{sub 5}(PO{sub 4}){sub 3}F

    SciTech Connect

    Zhang, Lei; Fu, Zuoling; Wu, Zhijian; Wang, Yuan; Fu, Xihong; Cui, Tian

    2014-08-15

    Graphical abstract: The structural and luminescent properties FAP: Ce{sup 3+} and FAP: Ce{sup 3+}, Mn{sup 2+} were investigated in detail by the spectral measurement and theoretical calculation. The emission of Ce{sup 3+} is fitted by two Gaussian functions dashed lines in wavenumber to further confirm the Ce{sup 3+} ion simultaneously occupy the 4f and 6h sites Ca{sub 5}(PO{sub 4})F host. - Highlights: • A simple hydrothermal method has been used to prepare Ca{sub 5}(PO{sub 4}){sub 3}F: Ce{sup 3+}, Mn{sup 2+} powders with structural and luminescent analysis. • The emission of Ce{sup 3+} is fitted by two Gaussian functions to confirm the Ce{sup 3+} ion simultaneously to occupy the 4f and 6h sites in Ca{sub 5}(PO{sub 4}){sub 3}F host. • Due to an efficient energy transfer, the existence of Ce{sup 3+} (sensitizer) can dramatically enhance the green emission of Mn{sup 2+} (activator) in co-doped samples. - Abstract: Ce{sup 3+}/Mn{sup 2+} ions-doped oxyapatite calcium fluorapatite [Ca{sub 5}(PO{sub 4}){sub 3}F, FAP] has been successfully synthesized by a facile one-step hydrothermal method. The luminescent properties of Ce{sup 3+}- and Ce{sup 3+}/Mn{sup 2+}- activated FAP phosphors were investigated using the photoluminescence (PL) and photoluminescence excitation (PLE) spectra. The emission of Ce{sup 3+} was fitted by two Gaussian functions with dashed lines in wavenumber to confirm the Ce{sup 3+} ion simultaneously to occupy the 4f and 6h sites in Ca{sub 5}(PO{sub 4}){sub 3}F host, which was consistent with the calculated results of crystal field based on chemical bond theory. In addition, the existence of Ce{sup 3+} (sensitizer) can dramatically enhance the green emission of Mn{sup 2+} (activator) in Ce{sup 3+}/Mn{sup 2+} ions co-doped samples due to an efficient energy transfer from Ce{sup 3+} to Mn{sup 2+}. All of these results could help us understand the site assignments and optical properties of the rare earth ions doped in hexagonal Ca{sub 5}(PO{sub 4

  6. Influence of 6s{sup 2} lone pair electrons of Bi{sup 3+} on its preferential site occupancy in fluorapatite, NaCa{sub 3}Bi(PO{sub 4}){sub 3}F – An insight from Eu{sup 3+} luminescent probe

    SciTech Connect

    Lakshminarasimhan, N. Varadaraju, U.V.

    2014-12-15

    Graphical abstract: Eu{sup 3+} structural probe – difference in Eu{sup 3+} PL emission in (a) NaCa{sub 3}Bi{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F and (b) NaCa{sub 3}La{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F suggests Bi{sup 3+} with preferential site occupancy at M(II) site directing Eu{sup 3+} to M(I) site. - Highlights: • Eu{sup 3+} luminescent probe used for establishing the role of 6s{sup 2} lone pair electrons of Bi{sup 3+} in fluorapatite. • Difference in Eu{sup 3+} PL emission spectral features in NaCa{sub 3}Bi{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F and NaCa{sub 3}La{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F. • Preferential site occupancy of Bi{sup 3+} in M(II) site directs Eu{sup 3+} to M(I) site in NaCa{sub 3}Bi{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F. - Abstract: Eu{sup 3+} luminescence was used as a structural probe in understanding the preferential site occupancy of lone pair cation, Bi{sup 3+}, in fluorapatite by comparing the photoluminescence (PL) emission spectral features with that of in analogous La{sup 3+} based fluorapatite. The fluorapatites, NaCa{sub 3}Bi{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F and NaCa{sub 3}La{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F, were synthesized by conventional high temperature solid state reaction method and characterized by powder X-ray diffraction (XRD) and FT-IR spectroscopy. The Eu{sup 3+} PL results revealed a difference in the emission spectral features in NaCa{sub 3}Bi{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F and NaCa{sub 3}La{sub 0.95}Eu{sub 0.05}(PO{sub 4}){sub 3}F. This difference in Eu{sup 3+} PL emission can be attributed to the difference in its site occupancy in the studied fluorapatites.

  7. Hydrothermal synthesis, crystal structure, and characterization of a new pseudo-two-dimensional uranyl oxyfluoride, [N(C{sub 2}H{sub 5}){sub 4}]{sub 2}[(UO{sub 2}){sub 4}(OH{sub 2}){sub 3}F{sub 10}

    SciTech Connect

    Ok, Kang Min; O'Hare, Dermot

    2007-02-15

    A new uranyl oxyfluoride, [N(C{sub 2}H{sub 5}){sub 4}]{sub 2}[(UO{sub 2}){sub 4}(OH{sub 2}){sub 3}F{sub 10}] has been synthesized by a hydrothermal reaction technique using (C{sub 2}H{sub 5}){sub 4}NBr, UO{sub 2}(OCOCH{sub 3}){sub 2}.2H{sub 2}O, and HF as reagents. The structure of [N(C{sub 2}H{sub 5}){sub 4}]{sub 2}[(UO{sub 2}){sub 4}(OH{sub 2}){sub 3}F{sub 10}] has been determined by a single-crystal X-ray diffraction technique. [N(C{sub 2}H{sub 5}){sub 4}]{sub 2}[(UO{sub 2}){sub 4}(OH{sub 2}){sub 3}F{sub 10}] crystallizes in the monoclinic space group P2{sub 1}/n (No. 14), with a=13.852(3)A, b=15.532(3)A, c=16.481(3)A, {beta}=98.88(3){sup o}, V=3503.4(12)A{sup 3}, and Z=4. [N(C{sub 2}H{sub 5}){sub 4}]{sub 2}[(UO{sub 2}){sub 4}(OH{sub 2}){sub 3}F{sub 10}] reveals a novel pseudo-two-dimensional crystal structure that is composed of UO{sub 2}F{sub 5}, UO{sub 3}F{sub 4}, and UO{sub 4}F{sub 3} pentagonal bipyramids. Each uranyl pentagonal bipyramid shares edges and corners through F atoms to form a six-membered ring. The rings are further interconnected to generate infinite strips running along the b-axis. [N(C{sub 2}H{sub 5}){sub 4}]{sub 2}[(UO{sub 2}){sub 4}(OH{sub 2}){sub 3}F{sub 10}] has been further characterized by elemental analysis, bond valence calculations, Infrared and Raman spectroscopy, and thermogravimetric analysis.

  8. Syntheses, crystal structures and Raman spectra of Ba(BF{sub 4})(PF{sub 6}), Ba(BF{sub 4})(AsF{sub 6}) and Ba{sub 2}(BF{sub 4}){sub 2}(AsF{sub 6})(H{sub 3}F{sub 4}); the first examples of metal salts containing simultaneously tetrahedral BF{sub 4}{sup -} and octahedral AF{sub 6}{sup -} anions

    SciTech Connect

    Lozinsek, Matic; Bunic, Tina; Goreshnik, Evgeny; Meden, Anton; Tramsek, Melita; Tavcar, Gasper; Zemva, Boris

    2009-10-15

    In the system BaF{sub 2}/BF{sub 3}/PF{sub 5}/anhydrous hydrogen fluoride (aHF) a compound Ba(BF{sub 4})(PF{sub 6}) was isolated and characterized by Raman spectroscopy and X-ray diffraction on the single crystal. Ba(BF{sub 4})(PF{sub 6}) crystallizes in a hexagonal P6-bar2m space group with a=10.2251(4) A, c=6.1535(4) A, V=557.17(5) A{sup 3} at 200 K, and Z=3. Both crystallographically independent Ba atoms possess coordination polyhedra in the shape of tri-capped trigonal prisms, which include F atoms from BF{sub 4}{sup -} and PF{sub 6}{sup -} anions. In the analogous system with AsF{sub 5} instead of PF{sub 5} the compound Ba(BF{sub 4})(AsF{sub 6}) was isolated and characterized. It crystallizes in an orthorhombic Pnma space group with a=10.415(2) A, b=6.325(3) A, c=11.8297(17) A, V=779.3(4) A{sup 3} at 200 K, and Z=4. The coordination around Ba atom is in the shape of slightly distorted tri-capped trigonal prism which includes five F atoms from AsF{sub 6}{sup -} and four F atoms from BF{sub 4}{sup -} anions. When the system BaF{sub 2}/BF{sub 3}/AsF{sub 5}/aHF is made basic with an extra addition of BaF{sub 2}, the compound Ba{sub 2}(BF{sub 4}){sub 2}(AsF{sub 6})(H{sub 3}F{sub 4}) was obtained. It crystallizes in a hexagonal P6{sub 3}/mmc space group with a=6.8709(9) A, c=17.327(8) A, V=708.4(4) A{sup 3} at 200 K, and Z=2. The barium environment in the shape of tetra-capped distorted trigonal prism involves 10 F atoms from four BF{sub 4}{sup -}, three AsF{sub 6}{sup -} and three H{sub 3}F{sub 4}{sup -} anions. All F atoms, except the central atom in H{sub 3}F{sub 4} moiety, act as mu{sub 2}-bridges yielding a complex 3-D structural network. - Graphical abstract: The first three compounds, containing simultaneously tetrahedral BF{sub 4}{sup -} and octahedral AF{sub 6}{sup -} (A=P, As) anions have been synthesized and characterized by Raman spectroscopy and X-ray single crystal diffraction. In the system BaF{sub 2}/BF{sub 3}/PF{sub 5}/anhydrous hydrogen fluoride (a

  9. Thermodynamic Model for the Solubility of Ba(SeO4sub>, SO4sub>) Precipitates

    SciTech Connect

    Rai, D.; Felmy, Andrew R.; Moore, Dean A.; Kitamura, Akira; Yoshikawa, Hideki; Doi, Reisuke; Yoshida, Yasushi

    2014-08-15

    The solubility of Ba(SeO4sub>, SO4sub>) precipitates was determined as a function of the BaSeO4sub> mole fractions, ranging from 0.0015 to 0.3830, and time with an equilibration period extending to as long as 302 days. Equilibrium/steady state conditions in this system are reached in ≤ 65 days. Pitzer’s ion interaction model was used to calculate solid and aqueous phase activity coefficients. Thermodynamic analyses showed that the data do not satisfy Gibbs-Duhem equation, thereby demonstrating that a single-solid solution phase does not control both the selenate and sulfate concentrations. Our extensive data with log 10 [Ba] ranging from -3.6 to -5.9 mol kg-1, log 10 [SeO4sub>] rangingfrom-3.6 to -5.2 mol kg-1, and log 10 [SO4sub>] ranging from-4.0 to -5.3 mol kg-1 can be explained with the formation of an ideal BaSeO4sub> solid solution phase that controls the selenium concentrations and a slightly disordered/less-crystalline BaSO4sub>(s) (log 10Κ°sp = -9.5 instead of -10.05 for barite) that controls the sulfate concentrations. In these experiments the BaSO4sub> component of the solid solution phase never reaches thermodynamic equilibrium with the aqueous phase. Thermodynamic interpretations of the data show that both the ideal BaSeO4sub> solid solution phase and less-crystalline BaSO4sub> (s) phase are in equilibrium with each other in the entire range of BaSeO4sub> mole fractions investigated in this study.

  10. Near Infrared Luminescence Properties of Mn(5+): Ca5(PO4)3F

    NASA Technical Reports Server (NTRS)

    Davis, Valetta R.; Hoemmerich, Uwe; Loutts, George B.

    1997-01-01

    We report a spectroscopic investigation of Mn(5+) doped Ca5(PO4)(sub 3)F or FAP. Mn(5+) doped crystals have recently attracted world wide attention for potential solid-state laser applications. Following optical excitation of Mn: FAP with the 600 nm output of a Nd: YAG OPO laser system, we observed a strong near infrared luminescence centered at around 1150 nm. The room temperature luminescence decay time was measured to be approximately 635 microseconds. We attribute the infrared luminescence to the(1)E yields (3)A2 transition of tetrahedrally coordinated Mn5+ ions located in a strong crystal field environment. Absorption, luminescence and lifetime data of Mn: FAP will be presented and discussed.

  11. Solvate Structures and Computational/Spectroscopic Characterization of LiBF4sub> Electrolytes

    SciTech Connect

    Seo, D. M.; Boyle, Paul D.; Allen, Joshua L.; Han, Sang D.; Jonsson, Erlendur; Johansson, Patrik; Henderson, Wesley A.

    2014-07-21

    Crystal structures have been determined for both LiBF4sub> and HBF4sub> solvates—(acetonitrile)2:LiBF4sub>, (ethylene glycol diethyl ether)1:LiBF4sub>, (diethylene glycol diethyl ether)1:LiBF4sub>, (tetrahydrofuran)1:LiBF4, (methyl methoxyacetate)1:LiBF4sub>, (suc-cinonitrile)1:LiBF4sub>, (N,N,N',N",N"-pentamethyldiethylenetriamine)1:HBF4sub>, (N,N,N',N'-tetramethylethylenediamine)3/2:HBF4sub> and (phenanthroline)2:HBF4sub>. These, as well as other known LiBF4sub> solvate structures, have been characterized by Raman vibrational spectroscopy to unambiguously assign the anion Raman band positions to specific forms of BF4sub>-...Li+ cation coordination. In addition, complementary DFT calculations of BF4sub>-...Li+ cation complexes have provided additional insight into the challenges associated with accurately interpreting the anion interactions from experimental Raman spectra. This information provides a crucial tool for the characterization of the ionic association interactions within electrolytes.

  12. Temperature dependent luminescence characteristics of KBe2BO3F2 and RbBe2BO3F2

    NASA Astrophysics Data System (ADS)

    Martincik, J.; Babin, V.; Liu, L.; Wang, X.; Chen, C. T.; Beitlerova, A.; Mihokova, E.; Nikl, M.

    2015-04-01

    This paper reports on a study of the luminescence characteristics of KBe2BO3F2 (KBBF) and RbBe2BO3F2(RBBF) crystals in UV/visible spectral range. The KBBF crystals are very popular for their nonlinear optical properties, however they have a potential to be used as scintillators for neutron detection. To determine the effectiveness of KBBF scintillation we combine the results from measurements of optical absorption; radioluminescence; light yield; photoluminescence and decay kinetics in the temperature range 8-330 K. Temperature dependence of luminescence in KBBF crystals is discussed.

  13. Solution-processable glass LiI-Li4sub>SnS4sub> superionic conductors for all-solid-state Li-ion batteries

    SciTech Connect

    Kern Ho Park; Oh, Dae Yang; Choi, Young Eun; Nam, Young Jin; Han, Lili; Kim, Ju -Young; Xin, Huolin; Lin, Feng; Oh, Seung M.; Jung, Yoon Seok

    2015-12-22

    The new, highly conductive (4.1 × 10–4 S cm–1 at 30 °C), highly deformable, and dry-air-stable glass 0.4LiI-0.6Li4sub>SnS4sub> is prepared using a homogeneous methanol solution. Furthermore, the solution process enables the wetting of any exposed surface of the active materials with highly conductive solidified electrolytes (0.4LiI-0.6Li4sub>SnS4sub>), resulting in considerable improvements in electrochemical performances of these electrodes over conventional mixture electrodes.

  14. Near-infrared quantum-cutting luminescence and energy transfer properties of Ca{sub 3}(PO{sub 4}){sub 2}:Tm{sup 3+},Ce{sup 3+} phosphors

    SciTech Connect

    Dong, S. L.; Lin, H. H. E-mail: qyzhang@scut.edu.cn; Yu, T.; Zhang, Q. Y. E-mail: qyzhang@scut.edu.cn

    2014-07-14

    The phosphors Ca{sub 3}(PO{sub 4}){sub 2}:Tm{sup 3+} by co-doping Ce{sup 3+} have been synthesized by conventional high-temperature solid-state reaction method. Their spectroscopic properties in the UV-VIS-NIR range have been investigated. The first 5d crystal field level location and stokes shift have been determined from the UV excitation and emission spectra of Ca{sub 3}(PO{sub 4}){sub 2}:Ce{sup 3+}. The three-photon NIR quantum-cutting luminescence of Tm{sup 3+} assigned to the electronic transitions of {sup 1}G{sub 4}→{sup 3}H{sub 4}, {sup 3}H{sub 4}→{sup 3}F{sub 4} and {sup 3}F{sub 4}→{sup 3}H{sub 6} is observed, whether in Ca{sub 3}(PO{sub 4}){sub 2}:Tm{sup 3+} or Ca{sub 3}(PO{sub 4}){sub 2}:Tm{sup 3+},Ce{sup 3+}. The energy transfer from Ce{sup 3+} to Tm{sup 3+} takes place with energy-transfer efficiency up to 34.5% for the Ca{sub 3}(PO{sub 4}){sub 2}:Tm{sup 3+},Ce{sup 3+}. A cross relaxation scheme using the 5d states of Ce{sup 3+} and f-f transition of Tm{sup 3+} is proposed. The mechanism is revealed from energy level and decay measurements. The results show that the broadband absorption of Ce{sup 3+} sensitizer not only extends the spectrum conversion in UV region but also greatly enhances the photoluminescence intensities of the three-photon quantum cutting luminescence of Tm{sup 3+} doped Ca{sub 3}(PO{sub 4}){sub 2}.

  15. U(v) in metal uranates: A combined experimental and theoretical study of MgUO4sub>, CrUO4sub>, and FeUO4sub>

    SciTech Connect

    Guo, Xiaofeng; Tiferet, Eitan; Qi, Liang; Solomon, Jonathan M.; Lanzirotti, Antonio; Newville, Matthew; Engelhard, Mark H.; Kukkadapu, Ravi K.; Wu, Di; Ilton, Eugene S.; Asta, Mark; Sutton, Stephen R.; Xu, Hongwu; Navrotsky, Alexandra

    2016-01-01

    Although pentavalent uranium can exist in aqueous solution, its presence in the solid state is uncommon. Metal monouranates, MgUO4sub>, CrUO4sub> and FeUO4sub> were synthesized for detailed structural and energetic investigations. Structural characteristics of these uranates used powder X-ray diffraction, synchrotron X-ray absorption spectroscopy, X-ray photoelectron spectroscopy, and 57Fe-Mossbauer spectroscopy. Enthalpies of formation were measured by high temperature oxide melt solution calorimetry. Density functional theory (DFT) calculations provided both structural and energetic information. The measured structural and thermodynamic properties show good consistency with those predicted from DFT. The presence of U5+ has been solidly confirmed in CrUO4sub> and FeUO4sub>, which are thermodynamically stable compounds, and the origin and stability of U5+ in the system was elaborated by DFT. Lastly, the structural and thermodynamic behaviour of U5+ elucidated in this work is relevant to fundamental actinide redox chemistry and to applications in the nuclear industry and radioactive waste disposal.

  16. ABET Criterion 3.f: how much curriculum content is enough?

    PubMed

    Barry, B E; Ohland, M W

    2012-06-01

    Even after multiple cycles of ABET accreditation, many engineering programs are unsure of how much curriculum content is needed to meet the requirements of ABET's Criterion 3.f (an understanding of professional and ethical responsibility). This study represents the first scholarly attempt to assess the impact of curriculum reform following the introduction of ABET Criterion 3.f. This study sought to determine how much professional and ethical responsibility curriculum content was used between 1995 and 2005, as well as how, when, why, and to what effect changes in the amount of content occurred. Subsequently, the study sought to evaluate if different amounts of curriculum content generated differing student outcomes. The amount of curriculum content used by each of the participating programs was identified during semi-structured interviews with program administrators and a review of ABET Self-Study documents. Quantitative methods were applied to determine if a relationship existed between the curriculum content and performance on a nationally administered, engineering-specific standardized examination. The findings indicate a statistical relationship, but a lack of structure between the amount of required content in the curriculum and performance on the examination. Additional findings were also generated regarding the way that programs interpret the Criterion 3.f feedback generated during accreditation visits. The primary impact of this study is that it dispels the myth that more courses or course time on professionalism and ethics will necessarily lead to positive engineering education outcomes. Much of the impetus to add more curriculum content results from a lack of conclusive feedback during ABET accreditation visits.

  17. Vibrational relaxation of CH3F in inert gas matrices

    NASA Astrophysics Data System (ADS)

    Young, Linda; Moore, C. Bradley

    1982-06-01

    The deactivation mechanism of the CH stretching fundamentals and bending overtones in matrix isolated CH3F has been determined for dilute samples as a function of host and temperature using infrared laser excited vibrational fluorescence. The decay mechanism is the same for all hosts; depopulation of any of the levels near 3000 cm-1 occurs via rapid (<5 ns) V→V transfer to the CF stretching overtone level 2 ν3. Subsequent stepwise relaxation occurs from 2ν3 to ν3 and from ν3 to ground. Decay rates of 2ν3 and ν3 have been determined through temporal resolution of 1050 and 2100 cm-1 fluorescence, respectively. These rates show a dramatic dependence on host lattice, an increase of two orders of magnitude in going from Xe to Ar matrices. Lifetimes depend only weakly on temperature.

  18. Electroporation of DC-3F cells is a dual process.

    PubMed

    Wegner, Lars H; Frey, Wolfgang; Silve, Aude

    2015-04-01

    Treatment of biological material by pulsed electric fields is a versatile technique in biotechnology and biomedicine used, for example, in delivering DNA into cells (transfection), ablation of tumors, and food processing. Field exposure is associated with a membrane permeability increase usually ascribed to electroporation, i.e., formation of aqueous membrane pores. Knowledge of the underlying processes at the membrane level is predominantly built on theoretical considerations and molecular dynamics (MD) simulations. However, experimental data needed to monitor these processes with sufficient temporal resolution are scarce. The whole-cell patch-clamp technique was employed to investigate the effect of millisecond pulsed electric fields on DC-3F cells. Cellular membrane permeabilization was monitored by a conductance increase. For the first time, to our knowledge, it could be established experimentally that electroporation consists of two clearly separate processes: a rapid membrane poration (transient electroporation) that occurs while the membrane is depolarized or hyperpolarized to voltages beyond so-called threshold potentials (here, +201 mV and -231 mV, respectively) and is reversible within ∼100 ms after the pulse, and a long-term, or persistent, permeabilization covering the whole voltage range. The latter prevailed after the pulse for at least 40 min, the postpulse time span tested experimentally. With mildly depolarizing or hyperpolarizing pulses just above threshold potentials, the two processes could be separated, since persistent (but not transient) permeabilization required repetitive pulse exposure. Conductance increased stepwise and gradually with depolarizing and hyperpolarizing pulses, respectively. Persistent permeabilization could also be elicited by single depolarizing/hyperpolarizing pulses of very high field strength. Experimental measurements of propidium iodide uptake provided evidence of a real membrane phenomenon, rather than a mere

  19. Aqueous Sulfate Separation by Sequestration of [(SO4sub>)2(H2O)4sub>]4sub> Clusters within Highly Insoluble Imine-Linked Bis-Guanidinium Crystals

    SciTech Connect

    Custelcean, Radu; Williams, Neil J.; Seipp, Charles A.; Ivanov, Aleksandr; Bryantsev, Vyacheslav

    2015-12-18

    Quantitative removal of sulfate from seawater was achieved by selective crystallization of the anion with a bis(guanidinium) ligand self-assembled in situ through imine condensation of simple components. The resulting crystalline salt has an exceptionally low aqueous solubility, on a par with BaSO4sub>. Single-crystal X-ray diffraction analysis revealed pairs of sulfate anions clustered together with four water molecules within the crystals.

  20. Origin of modulated phases and magnetic hysteresis in TmB4sub>

    SciTech Connect

    Wierschem, Keola; Sunku, Sai Swaroop; Kong, Tai; Ito, Toshimitsu; Canfield, Paul C.; Panagopoulos, Christos; Sengupta, Pinaki

    2015-12-23

    In this study, we investigate the low-temperature magnetic phases in TmB4sub>, a metallic quantum magnet on the geometrically frustrated Shastry-Sutherland lattice, using coordinated experimental and theoretical studies. Our results provide an explanation for the appearance of the intriguing fractional plateau in TmB4sub> and accompanying magnetic hysteresis. Together with observation of the bump in the half plateau, our results support the picture that the magnetization plateau structure in TmB4sub> is strongly influenced by the zero-field modulated phases. We present a phenomenological model to explain the appearance of the modulated phases and a microscopic Hamiltonian that captures the complete magnetic behavior of TmB4sub>.

  1. Native defects in Tl6SI4sub>: Density functional calculations

    SciTech Connect

    Shi, Hongliang; Du, Mao -Hua

    2015-05-05

    In this study, Tl6SI4sub> is a promising room-temperature semiconductor radiation detection material. Here, we report density functional calculations of native defects and dielectric properties of Tl6SI4sub>. Formation energies and defect levels of native point defects and defect complexes are calculated. Donor-acceptor defect complexes are shown to be abundant in Tl6SI4sub>. 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 Tl6SI4sub> gives rise to enhanced Born effective charges and large static dielectric constant, which provides effective screening of charged defects and impurities.

  2. Mutation Analysis of H3F3A and H3F3B as a Diagnostic Tool for Giant Cell Tumor of Bone and Chondroblastoma.

    PubMed

    Cleven, Arjen H G; Höcker, Saskia; Briaire-de Bruijn, Inge; Szuhai, Karoly; Cleton-Jansen, Anne-Marie; Bovée, Judith V M G

    2015-11-01

    Specific H3F3A driver mutations and IDH2 mutations were recently described in giant cell tumor of bone (GCTB) and H3F3B driver mutations in chondroblastoma; these may be helpful as a diagnostic tool for giant cell-containing tumors of the bone. Using Sanger sequencing, we determined the frequency of H3F3A, H3F3B, IDH1, and IDH2 mutations in GCTBs (n=60), chondroblastomas (n=12), and other giant cell-containing tumors (n=24), including aneurysmal bone cyst, chondromyxoid fibroma, and telangiectatic osteosarcoma. To find an easy applicable marker for H3F3A mutation status, H3K36 trimethylation and ATRX expression were correlated with H3F3A mutations. In total, 69% of all GCTBs harbored an H3F3A (G34W/V) mutation compared with 0% of all other giant cell-containing tumors (P<0.001), whereas 70% of chondroblastomas showed an H3F3B (K36M) mutation compared with 0% of other giant cell-containing tumors (P<0.001). Diffuse H3K36 trimethylation positivity was more often seen in mutated H3F3A GCTBs compared with other giant cell-containing tumors (P=0.005). ATRX protein expression was not correlated with H3F3A mutation status. Hotspot mutations in IDH1 or IDH2 were absent. Our results show that H3F3A and H3F3B mutation analysis appears to be a highly specific, although less sensitive, diagnostic tool for the distinction of GCTB and chondroblastoma from other giant cell-containing tumors. Although H3K36 trimethylation and ATRX immunohistochemistry cannot be used as surrogate markers for H3F3A mutation status, mutations in H3F3A are associated with increased H3K36 trimethylation, suggesting that methylation at this residue may play a role in the etiology of the disease.

  3. Mutation Analysis of H3F3A and H3F3B as a Diagnostic Tool for Giant Cell Tumor of Bone and Chondroblastoma.

    PubMed

    Cleven, Arjen H G; Höcker, Saskia; Briaire-de Bruijn, Inge; Szuhai, Karoly; Cleton-Jansen, Anne-Marie; Bovée, Judith V M G

    2015-11-01

    Specific H3F3A driver mutations and IDH2 mutations were recently described in giant cell tumor of bone (GCTB) and H3F3B driver mutations in chondroblastoma; these may be helpful as a diagnostic tool for giant cell-containing tumors of the bone. Using Sanger sequencing, we determined the frequency of H3F3A, H3F3B, IDH1, and IDH2 mutations in GCTBs (n=60), chondroblastomas (n=12), and other giant cell-containing tumors (n=24), including aneurysmal bone cyst, chondromyxoid fibroma, and telangiectatic osteosarcoma. To find an easy applicable marker for H3F3A mutation status, H3K36 trimethylation and ATRX expression were correlated with H3F3A mutations. In total, 69% of all GCTBs harbored an H3F3A (G34W/V) mutation compared with 0% of all other giant cell-containing tumors (P<0.001), whereas 70% of chondroblastomas showed an H3F3B (K36M) mutation compared with 0% of other giant cell-containing tumors (P<0.001). Diffuse H3K36 trimethylation positivity was more often seen in mutated H3F3A GCTBs compared with other giant cell-containing tumors (P=0.005). ATRX protein expression was not correlated with H3F3A mutation status. Hotspot mutations in IDH1 or IDH2 were absent. Our results show that H3F3A and H3F3B mutation analysis appears to be a highly specific, although less sensitive, diagnostic tool for the distinction of GCTB and chondroblastoma from other giant cell-containing tumors. Although H3K36 trimethylation and ATRX immunohistochemistry cannot be used as surrogate markers for H3F3A mutation status, mutations in H3F3A are associated with increased H3K36 trimethylation, suggesting that methylation at this residue may play a role in the etiology of the disease. PMID:26457357

  4. The hydrogen permeability of Pd4sub>S

    SciTech Connect

    O’Brien, Casey P.; Gellman, Andrew J.; Morreale, Bryan D.; Miller, James B.

    2011-04-01

    Hydrogen permeates rapidly through pure Pd membranes, but H2S, a common minor component in hydrogencontaining streams, produces a Pd4sub>S film on the Pd surface that severely retards hydrogen permeation. Hydrogen still permeates through the bi-layered Pd4sub>S/Pd structure, indicating that the Pd4sub>S surface is active for H2 dissociation; the low hydrogen permeability of the Pd4sub>S film is responsible for the decreased rate of hydrogen transport. In this work, the hydrogen permeability of Pd4sub>S was determined experimentally in the 623-773 K temperature range. Bi-layered Pd4sub>S/Pd foils were produced by exposing pure Pd foils to H2S. H2 fluxes through the bi-layered Pd4sub>S/Pd foils were measured during exposure to both pure H2 and a 1000 ppm H2S in H2 gas mixture. Our results show that H2S slows hydrogen permeation through Pd mainly by producing a Pd4S film on the Pd surface that is roughly an order-of-magnitude less permeable to hydrogen (kPd4S = 10-7.5 exp(-0.22 eV/kBT)molH2/m/s/Pa-1/2) than pure Pd. The presence of H2S in the gas stream results in greater inhibition of hydrogen transport than can be explained by the very low permeability of Pd4sub>S. H2S may block H2 dissociation sites at the Pd4sub>S surface.

  5. The role of carbonic anhydrase in C4sub> photosynthesis

    SciTech Connect

    Studer, Anthony

    2015-10-01

    Current pressures on the global food supply have accelerated the urgency for a second green revolution using novel and sustainable approaches to increase crop yield and efficiency. This proposal outlines experiments to address fundamental questions regarding the biology of C4sub> photosynthesis, the method of carbon fixation utilized by the most productive food, feed and bioenergy crops. Carbonic anhydrase (CA) has been implicated in multiple cellular functions including nitrogen metabolism, water use efficiency, and photosynthesis. CA catalyzes the first dedicated step in C4sub> photosynthesis, the hydration of CO2 into bicarbonate, and is potentially rate limiting in C4sub> grasses. Using insertional mutagenesis, we have generated CA mutants in maize, and propose the characterization of these mutants using phenotypic, physiological, and transcriptomic profiling to assay the plant’s response to altered CA activity. In addition, florescent protein tagging experiments will be employed to study the subcellular localization of CA paralogs, providing critical data for modeling carbon fixation in C4sub> plants. Finally, I propose parallel experiments in Setaria viridis to explore its relevance as model C4sub> grass. Using a multifaceted approach, this proposal addresses important questions in basic biology, as well as the need for translation research in response to looming global food challenges.

  6. Two-micron lasing in NaLa{sub 1/2}Gd{sub 1/2}(WO{sub 4}){sub 2} crystals doped with Tm{sup 3+} ions

    SciTech Connect

    Bolshchikov, F A; Ryabochkina, P A; Zharikov, Evgeny V; Lis, Denis A; Subbotin, Kirill A; Zakharov, N G; Antipov, Oleg L

    2010-02-28

    Lasing on the {sup 3}F{sub 4{yields}}{sup 3}H{sub 6} transition of Tm{sup 3+} ions in Tm{sup 3+}:NaLa{sub 1/2}Gd{sub 1/2}(WO{sub 4}){sub 2} crystals pumped by a diode laser is obtained for the first time. The {pi}- and {sigma}-polarised laser radiation at wavelengths of 1908 and 1918 nm was generated with a slope efficiency of 28% and 25%, respectively. (lasers)

  7. Integrated Data Collection Analysis (IDCA) Program - KClO4sub>/Aluminum Mixture

    SciTech Connect

    Sandstrom, Mary M.; Brown, Geoffrey W.; Preston, Daniel N.; Pollard, Colin J.; Warner, Kirstin F.; Sorensen, Daniel N.; Remmers, Daniel L.; Whinnery, LeRoy L.; Shelley, Timothy J.; Reyes, Jose A.; Hsu, Peter C.; Reynolds, John G.

    2012-01-17

    The Integrated Data Collection Analysis (IDCA) program is conducting a Proficiency Test for Small-Scale Safety and Thermal (SSST) testing of homemade explosives (HMEs). Described here are the results for impact, friction, electrostatic discharge, and differential scanning calorimetry analysis of a mixture of KClO4sub> and aluminum—KClO4sub>/Al mixture. This material was selected because of the challenge of performing SSST testing of a mixture of two solids. The mixture was found to be: 1) much less sensitive to impact than RDX, (LLNL being the exception) and PETN, 2) more sensitive to friction than RDX and PETN, and 3) extremely sensitive to spark. The thermal analysis showed little or no exothermic character. One prominent endothermic feature was observed in the temperature range studied and identified as a phase transition of KClO4sub>.

  8. Investigations On Stoichiometry And Melting Behavior Of NaY(WO{sub 4}){sub 2}

    SciTech Connect

    Salunke, R. G.; Gosavi, S. W.; Singh, S. G.; Singh, A. K.; Desai, D. G.; Chauhan, A. K.; Gadkari, S. C.

    2010-12-01

    Differential thermal analysis (DTA) and X-ray diffraction (XRD) studies were carried out to understand the melting behavior of the NaY(WO{sub 4}){sub 2}, an important functional material used for the laser production. It has been observed that the stoichiometric NaY(WO{sub 4}){sub 2} composition forms a solution with another phase of the Na{sub 2}WO{sub 4}-Y{sub 2}(WO{sub 4}){sub 3} pseudo-binary system. This is found to be detrimental for the growth of single crystals of the material. Therefore, molar fraction in the starting charge was suitably altered to successfully restrict the formation of the undesired phase in the melt. A composition is suggested for the favorable crystal growth of this material.

  9. Novel Solution Process for Fabricating Ultra-Thin-Film Absorber Layers in Fe2SiS4sub> and Fe2GeS4sub> Photovoltaics

    SciTech Connect

    Orefuwa, Samuel A.; Lai, Cheng-Yu; Dobson, Kevin D.; Ni, Chaoying; Radu, Daniela R.

    2014-05-12

    Fe2SiS4sub> and Fe2GeS4sub> crystalline materials posses direct bandgaps of ~1.55 and ~1.4 eV respectively and an absorption coefficient larger than 10^5 cm–1; their theoretical potential as solar photovoltaic absorbers has been demonstrated. However, no solar devices that employ either Fe2SiS4sub> or Fe2GeS4sub> have been reported to date. In the presented work, nanoprecursors to Fe2SiS4sub> and Fe2GeS4sub> have been fabricated and employed to build ultra-thin-film layers via spray coating and rod coating methods. Temperature-dependent X-Ray diffraction analyses of nanoprecursors coatings show an unprecedented low temperature for forming crystalline Fe2SiS4sub> and Fe2GeS4sub>. Fabricating of ultra-thin-film photovoltaic devices utilizing Fe2SiS4sub> and Fe2GeS4sub> as solar absorber material is presented.

  10. Structural Insights into HIV-1 Vif-APOBEC3F Interaction

    PubMed Central

    Nakashima, Masaaki; Ode, Hirotaka; Kawamura, Takashi; Kitamura, Shingo; Naganawa, Yuriko; Awazu, Hiroaki; Tsuzuki, Shinya; Matsuoka, Kazuhiro; Nemoto, Michiko; Hachiya, Atsuko; Sugiura, Wataru; Yokomaku, Yoshiyuki; Watanabe, Nobuhisa

    2015-01-01

    ABSTRACT The HIV-1 Vif protein inactivates the cellular antiviral cytidine deaminase APOBEC3F (A3F) in virus-infected cells by specifically targeting it for proteasomal degradation. Several studies identified Vif sequence motifs involved in A3F interaction, whereas a Vif-binding A3F interface was proposed based on our analysis of highly similar APOBEC3C (A3C). However, the structural mechanism of specific Vif-A3F recognition is still poorly understood. Here we report structural features of interaction interfaces for both HIV-1 Vif and A3F molecules. Alanine-scanning analysis of Vif revealed that six residues located within the conserved Vif F1-, F2-, and F3-box motifs are essential for both A3C and A3F degradation, and an additional four residues are uniquely required for A3F degradation. Modeling of the Vif structure on an HIV-1 Vif crystal structure revealed that three discontinuous flexible loops of Vif F1-, F2-, and F3-box motifs sterically cluster to form a flexible A3F interaction interface, which represents hydrophobic and positively charged surfaces. We found that the basic Vif interface patch (R17, E171, and R173) involved in the interactions with A3C and A3F differs. Furthermore, our crystal structure determination and extensive mutational analysis of the A3F C-terminal domain demonstrated that the A3F interface includes a unique acidic stretch (L291, A292, R293, and E324) crucial for Vif interaction, suggesting additional electrostatic complementarity to the Vif interface compared with the A3C interface. Taken together, these findings provide structural insights into the A3F-Vif interaction mechanism, which will provide an important basis for development of novel anti-HIV-1 drugs using cellular cytidine deaminases. IMPORTANCE HIV-1 Vif targets cellular antiviral APOBEC3F (A3F) enzyme for degradation. However, the details on the structural mechanism for specific A3F recognition remain unclear. This study reports structural features of interaction

  11. The superionic phase transitions in (NH{sub 4}){sub 3}H(SeO{sub 4}){sub 2} under hydrostatic pressure up to 400 MPa

    SciTech Connect

    Lindner, Ł.; Zdanowska-Frączek, M. Pawłowski, A.; Frączek, Z. J.

    2014-10-28

    The effect of hydrostatic pressure on proton conductivity of (NH{sub 4}){sub 3}H(SeO{sub 4}){sub 2} superionic crystal was studied in a wide temperature range and different isobaric conditions by means of impedance spectroscopy method. The measurements were performed along the trigonal c axis of the crystal, i.e., along the direction perpendicular to the plane in which, in the superionic phases, a dynamically disordered H-bond network is formed. The obtained pressure-temperature phase diagram is linear with increasing pressure. The triple point, which is the point of coexistence of the three phases: ferroelastic phase IV, ferroelastic phase III, and superionic phase II was found at p = 116.3 MPa and T = 287.3 K. High pressure leads to increase in the temperature range of stability of both superionic phases and to a drastic decrease in the temperature width of the ferroelastic phase III. With increasing pressure, the range of the superionic phase II expands at the expense of the range of the ferroelastic phase III, which is unstable and vanishes at the triple point.

  12. Role of APOBEC3F Gene Variation in HIV-1 Disease Progression and Pneumocystis Pneumonia.

    PubMed

    An, Ping; Penugonda, Sudhir; Thorball, Christian W; Bartha, Istvan; Goedert, James J; Donfield, Sharyne; Buchbinder, Susan; Binns-Roemer, Elizabeth; Kirk, Gregory D; Zhang, Wenyan; Fellay, Jacques; Yu, Xiao-Fang; Winkler, Cheryl A

    2016-03-01

    Human APOBEC3 cytidine deaminases are intrinsic resistance factors to HIV-1. However, HIV-1 encodes a viral infectivity factor (Vif) that degrades APOBEC3 proteins. In vitro APOBEC3F (A3F) anti-HIV-1 activity is weaker than A3G but is partially resistant to Vif degradation unlike A3G. It is unknown whether A3F protein affects HIV-1 disease in vivo. To assess the effect of A3F gene on host susceptibility to HIV- acquisition and disease progression, we performed a genetic association study in six well-characterized HIV-1 natural cohorts. A common six-Single Nucleotide Polymorphism (SNP) haplotype of A3F tagged by a codon-changing variant (p. I231V, with allele (V) frequency of 48% in European Americans) was associated with significantly lower set-point viral load and slower rate of progression to AIDS (Relative Hazards (RH) = 0.71, 95% CI: 0.56, 0.91) and delayed development of pneumocystis pneumonia (PCP) (RH = 0.53, 95% CI: 0.37-0.76). A validation study in the International Collaboration for the Genomics of HIV (ICGH) showed a consistent association with lower set-point viral load. An in vitro assay revealed that the A3F I231V variant may influence Vif mediated A3F degradation. Our results provide genetic epidemiological evidence that A3F modulates HIV-1/AIDS disease progression.

  13. Role of APOBEC3F Gene Variation in HIV-1 Disease Progression and Pneumocystis Pneumonia.

    PubMed

    An, Ping; Penugonda, Sudhir; Thorball, Christian W; Bartha, Istvan; Goedert, James J; Donfield, Sharyne; Buchbinder, Susan; Binns-Roemer, Elizabeth; Kirk, Gregory D; Zhang, Wenyan; Fellay, Jacques; Yu, Xiao-Fang; Winkler, Cheryl A

    2016-03-01

    Human APOBEC3 cytidine deaminases are intrinsic resistance factors to HIV-1. However, HIV-1 encodes a viral infectivity factor (Vif) that degrades APOBEC3 proteins. In vitro APOBEC3F (A3F) anti-HIV-1 activity is weaker than A3G but is partially resistant to Vif degradation unlike A3G. It is unknown whether A3F protein affects HIV-1 disease in vivo. To assess the effect of A3F gene on host susceptibility to HIV- acquisition and disease progression, we performed a genetic association study in six well-characterized HIV-1 natural cohorts. A common six-Single Nucleotide Polymorphism (SNP) haplotype of A3F tagged by a codon-changing variant (p. I231V, with allele (V) frequency of 48% in European Americans) was associated with significantly lower set-point viral load and slower rate of progression to AIDS (Relative Hazards (RH) = 0.71, 95% CI: 0.56, 0.91) and delayed development of pneumocystis pneumonia (PCP) (RH = 0.53, 95% CI: 0.37-0.76). A validation study in the International Collaboration for the Genomics of HIV (ICGH) showed a consistent association with lower set-point viral load. An in vitro assay revealed that the A3F I231V variant may influence Vif mediated A3F degradation. Our results provide genetic epidemiological evidence that A3F modulates HIV-1/AIDS disease progression. PMID:26942578

  14. Role of APOBEC3F Gene Variation in HIV-1 Disease Progression and Pneumocystis Pneumonia

    PubMed Central

    An, Ping; Penugonda, Sudhir; Thorball, Christian W.; Bartha, Istvan; Goedert, James J.; Donfield, Sharyne; Buchbinder, Susan; Binns-Roemer, Elizabeth; Kirk, Gregory D.; Zhang, Wenyan; Fellay, Jacques; Yu, Xiao-Fang; Winkler, Cheryl A.

    2016-01-01

    Human APOBEC3 cytidine deaminases are intrinsic resistance factors to HIV-1. However, HIV-1 encodes a viral infectivity factor (Vif) that degrades APOBEC3 proteins. In vitro APOBEC3F (A3F) anti-HIV-1 activity is weaker than A3G but is partially resistant to Vif degradation unlike A3G. It is unknown whether A3F protein affects HIV-1 disease in vivo. To assess the effect of A3F gene on host susceptibility to HIV- acquisition and disease progression, we performed a genetic association study in six well-characterized HIV-1 natural cohorts. A common six-Single Nucleotide Polymorphism (SNP) haplotype of A3F tagged by a codon-changing variant (p. I231V, with allele (V) frequency of 48% in European Americans) was associated with significantly lower set-point viral load and slower rate of progression to AIDS (Relative Hazards (RH) = 0.71, 95% CI: 0.56, 0.91) and delayed development of pneumocystis pneumonia (PCP) (RH = 0.53, 95% CI: 0.37–0.76). A validation study in the International Collaboration for the Genomics of HIV (ICGH) showed a consistent association with lower set-point viral load. An in vitro assay revealed that the A3F I231V variant may influence Vif mediated A3F degradation. Our results provide genetic epidemiological evidence that A3F modulates HIV-1/AIDS disease progression. PMID:26942578

  15. Hydrothermal synthesis and characterization of the first 1-D indiumphosphate chain In{sub 2}(HPO{sub 4}){sub 2}(H{sub 2}PO{sub 4}){sub 2}F{sub 2}.C{sub 4}N{sub 2}H{sub 12}, a precursor for high dimensional structures

    SciTech Connect

    Chen Chao; Yi Zhuo; Bi Minghui; Liu Yunling; Wang Chunyu; Liu Li; Zhao Zan; Pang Wenqin . E-mail: wqpang@mail.jlu.edu.cn

    2006-05-15

    The first one-dimensional (1-D) indiumphosphate chain, In{sub 2}(HPO{sub 4}){sub 2}(H{sub 2}PO{sub 4}){sub 2}F{sub 2}.C{sub 4}N{sub 2}H{sub 12} (1), has been hydrothermally prepared using piperazine (PIP) as a template. The structure consists of infinite chains of trans,trans-corners-sharing InO{sub 4}F{sub 2} octahedra with the adjacent octahedra being bridged by tetrahedral PO{sub 3}(OH) and PO{sub 2}(OH){sub 2} units, which are H-bonded with amine groups of the organic cations. Interestingly, this macroanionic chain InP{sub 2}O{sub 8}H{sub 3}F{sup -} is similar to that found in the mineral tancoite-like chains and has potential to further set up higher-dimensional networks. On heating 1 in the presence of additional phosphoric acid at 180 deg. C under hydrothermal condition, compound 2, In{sub 2}(OH)(H{sub 2}O)(PO{sub 4}){sub 2}.H{sub 3}O.H{sub 2}O, possessed a 3-D structure building from the repetition of a secondary building unit is obtained. When 1 is heated with additional PIP, an unknown phase, compound 3 is formed. Finally, on treatment with another amine, such as diethylenetriamine or 1,4-diaminobutane, at 180 deg. C, 1, as a precursor, can convert into a previously known 3-D framework structure with 16-membered ring compound 4. Compounds 1 and 2 are determined by single-crystal X-ray diffraction. Furthermore, 1 is characterized by X-ray powder diffraction, IR spectroscopy, inductively coupled plasma analysis, thermogravimetric analysis and differential thermal analysis.

  16. Characterization of bubble core and cloudiness in Yb3+:Sr5(PO4)3F crystals using Micro-Raman spectroscopy

    SciTech Connect

    Cui, Y; Roy, U N; Bai, L; Burger, A; Qiu, S R; Schaffers, K

    2006-11-15

    Ytterbium doped strontium fluoroapatite Yb{sup 3+}:Sr{sub 5}(PO{sub 4}){sub 3}F (Yb: S-FAP) crystals have been used in High Average Power Laser systems as gain medium. Growth induced defects associated with the crystal often affect their performance. In order to improve the crystal quality and its optical applications, it is imperative to understand the nature of these defects. In this study, we utilize Micro-Raman spectroscopy to characterize two common growth-induced defects: bubble core and cloudiness. We find the bubble core consist of voids and microcrystals of Yb: S-FAP. These microcrystals have very different orientation from that of the pure crystal outside the bubble core. In contrast to a previous report, neither Sr{sub 3}(PO{sub 4}){sub 2} nor Yb{sub 2}O{sub 3} are observed in the bubble core regions. On the other hand, the cloudy regions are made up of the host materials blended with a structural deformation along with impurities which include CaCO{sub 3}, YbPO{sub 4}, SrHPO{sub 4} and Sr{sub 2}P{sub 2}O{sub 7}. The impurities are randomly distributed in the cloudy regions. This analysis is necessary for understanding and eliminating these growth defects in Yb:S-FAP crystals.

  17. Sub-nanosecond Yb:KLu(WO4sub>)2 microchip laser.

    PubMed

    Loiko, P; Serres, J M; Mateos, X; Yumashev, K; Yasukevich, A; Petrov, V; Griebner, U; Aguiló, M; Díaz, F

    2016-06-01

    A diode-pumped Yb:KLu(WO4sub>)2 microchip laser passively Q-switched by a Cr4+:YAG saturable absorber generated a maximum average output power of 590 mW at 1031 nm with a slope efficiency of 55%. The pulse characteristics were 690 ps/47.6 μJ at a pulse repetition frequency of 12.4 kHz. The output beam had an excellent circular profile with M2<1.05. Yb:KLu(WO4sub>)2 is very promising for ultrathin sub-ns microchip lasers. PMID:27244429

  18. Shape resonances in the photoionization of CF4sub>

    SciTech Connect

    Stephens, J. A.; Dill, Dan; Dehmer, Joseph L.

    1986-01-01

    Calculations of photoionization cross sections and photoelectron angular distributions have been performed for all occupied orbitals of CF4sub> using the multiple-scattering model. Results are compared with very recent experiments which employ synchrotron radiation to measure these quantities, namely the measurements of Truesdale e t a l. for the carbonK shell, and measurements of Carlson e t a l. and Novak e t a l. for the five outermost valence levels. The calculations predict intense shape resonances below 3 eV in continua of a1 and t2 final state symmetry. Qualitative agreement is attained on comparing much of the theory with experiment, notably the five outer valence levels, which serves to establish a one-electron picture of the photoionization dynamics of CF4sub>.

  19. Sequential Reaction Channels of Metastable C{sup 4+}{sub 60}

    SciTech Connect

    Duenser, B.; Echt, O.; Scheier, P.; Maerk, T.D.

    1997-11-01

    We employ a two-sector-field mass spectrometer to identify sequential, unimolecular dissociation channels of C{sup 4+}{sub 60} . In addition to sequential {open_quotes}monomer evaporations{close_quotes} (loss of two C{sub 2} units), we observe two novel sequential channels which involve fissionlike events: loss of C{sup +}{sub 2} followed by evaporation, and sequential loss of two C{sup +}{sub 2} units. {copyright} {ital 1997} {ital The American Physical Society}

  20. Crystal Chemistry of Electrochemically and Chemically Lithiated Layered αI-LiVOPO4sub>

    SciTech Connect

    He, Guang; Bridges, Craig A.; Manthiram, Arumugam

    2015-09-14

    LiVOPO4sub> is an attractive cathode for lithium-ion batteries with a high operating voltage and the potential to achieve the reversible insertion of two lithium ions between VOPO4sub> and Li2VOPO4sub>. Among the three known forms of LiVOPO4sub> (α, β, and αI), the αI-LiVOPO4sub> has a layered structure that could promote better ionic mobility and reversibility than others. However, a comprehensive study of its lithiated product is not available as αI-LiVOPO4sub> is metastable and difficult to prepare by conventional approaches. We present here a facile synthesis of highly crystalline αI-LiVOPO4sub> and αI-LiVOPO4sub>/rGO nanocomposite by a microwave-assisted solvothermal method and its electrochemical/chemical lithiation. The LiVOPO4sub>/rGO cathodes exhibit a high reversible capacity of 225 mAh g–1, indicating the insertion of more than one lithium into VOPO4sub>. Both electrochemical and chemical lithiation imply a solid-solution reaction mechanism on inserting the second lithium into αI-LiVOPO4sub>, but a two-phase reaction feature could also occur under certain conditions such as insufficient time for equilibration of Li+ diffusion in the structure. The fully lithiated new αI-Li2VOPO4sub> phase was characterized by combined Rietveld refinement of neutron diffraction and X-ray diffraction data and by bond-valence sum maps. The results suggest that αI-Li2VOPO4sub> retains the tetragonal P4/nmm symmetry of the parent αI-LiVOPO4sub> structure, where the second lithium ions are located in the lithium layers rather than in the VOPO4sub> layers

  1. Collisional narrowing by polyatomic buffer gases in an optically pumped CH3F laser

    NASA Technical Reports Server (NTRS)

    Lawandy, N. M.; Koepf, G. A.

    1980-01-01

    The gain linewidth of an optically pumped CH3F molecular laser is observed with the addition of various polyatomic buffer gases. This is interpreted as collisional (Dicke) narrowing. The measurement is the first observation of collisional narrowing by polyatomic buffer gases. It is also the first observation of the effect in a laser oscillator. The effect was observed using a heterodyne mixing technique at the laser emission frequency of 604 GHz. Collision cross sections for SF6-CH3F and CS2-CH3F are obtained.

  2. Be2BO3F: A Phase of Beryllium Fluoride Borate Derived from KBe2BO3F2 with Short UV Absorption Edge.

    PubMed

    Guo, Shu; Liu, Lijuan; Xia, Mingjun; Kang, Lei; Huang, Qian; Li, Chao; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian

    2016-07-01

    A phase of beryllium fluoride borate Be2BO3F (BBF) was successfully developed and grown by spontaneous nucleation from high temperature solution. The crystal belongs to the trigonal space group of R3̅c (No. 167), with lattice parameters a = 4.442(1) Å, c = 24.956(5) Å, and Z = 2. It is constructed by the infinite planar [Be2BO3F2]∞ layers, in which the planar triangle [BO3](3-) and the tetrahedral [BeO3F](5-) anionic groups are arranged in parallel via corner-sharing O atoms in each ab plane. BBF is an incongruent compound and decomposes at about 650 °C. The deep-ultraviolet (DUV) transmittance spectrum reveals that its UV cutoff wavelength is down to ∼150 nm. Theoretical calculations show that BBF has a large birefringence (Δn = 0.13 at 200 nm), which mainly originates from the infinite planar [Be2BO3F2]∞ layers. In conclusion, BBF may be served as a potential DUV birefringent material. PMID:27332696

  3. Quaternary (FeIn{sub 2}S{sub 4}){sub x}(MnIn{sub 2}S{sub 4}){sub 1-x} alloys and photosensitive structures on their basis

    SciTech Connect

    Bodnar, I. V.; Rud, V. Yu.; Rud, Yu. V.; Lozhkin, D. V.

    2011-07-15

    Using directional crystallization of the melt of the (FeIn{sub 2}S{sub 4}){sub x}(MnIn{sub 2}S{sub 4}){sub 1-x} alloy, homogeneous crystals of a similar atomic composition are grown over the entire range of compositions 1 {>=} x {>=} 0. It is established that the crystals of the continuous series of quaternary alloys in the range x = 0-1 crystallize in the spinel structure and lattice parameter a linearly depends on x. It is established that it is possible to obtain In(Al)/(FeIn{sub 2}S{sub 4}){sub x}(MnIn{sub 2}S{sub 4}){sub 1-x} photosensitive structures. Room-temperature spectra of relative quantum efficiency of photoconversion of the In(Al)/(FeIn{sub 2}S{sub 4}){sub x}(MnIn{sub 2}S{sub 4}){sub 1-x} structures fabricated for the first time are obtained. From the analysis of these spectra, activation energies of direct and indirect band-to-band transitions for the crystals of the (FeIn{sub 2}S{sub 4}){sub x}(MnIn{sub 2}S{sub 4}){sub 1-x} alloys are determined and the dependence of these parameters on the composition of the position-disordered phases of mentioned alloys is discussed. It is concluded that the crystals of the (FeIn{sub 2}S{sub 4}){sub x}(MnIn{sub 2}S{sub 4}){sub 1-x} alloys can be used in broadband photoconverters of optical radiation.

  4. 3F8 monoclonal antibody treatment of patients with stage 4 neuroblastoma: a phase II study.

    PubMed

    Cheung, N K; Kushner, B H; Yeh, S D; Larson, S M

    1998-06-01

    3F8 is an IgG3 murine monoclonal antibody directed against the ganglioside GD2. In a phase II study, 3F8 was administered i.v. to 16 patients (pts) who had stage 4 neuroblastoma. Response was seen in bony lesions (2 of 7 pts) and marrow (3 of 8 pts). Acute toxicities of pain, fever, urticaria, hypertension, hypotension and anaphylactoid reactions were self-limited and manageable. Three pts are long-term survivors between 79-130+ months after 3F8 treatment without additional systemic therapy and no delayed neurological complications. The potential benefits of 3F8 when added to chemoradio-therapy warrant further investigation.

  5. Generation and Standardized, Systemic Phenotypic Analysis of Pou3f3L423P Mutant Mice.

    PubMed

    Kumar, Sudhir; Rathkolb, Birgit; Kemter, Elisabeth; Sabrautzki, Sibylle; Michel, Dian; Adler, Thure; Becker, Lore; Beckers, Johannes; Busch, Dirk H; Garrett, Lillian; Hans, Wolfgang; Hölter, Sabine M; Horsch, Marion; Klingenspor, Martin; Klopstock, Thomas; Rácz, Ildikó; Rozman, Jan; Vargas Panesso, Ingrid Liliana; Vernaleken, Alexandra; Zimmer, Andreas; Fuchs, Helmut; Gailus-Durner, Valérie; Hrabě de Angelis, Martin; Wolf, Eckhard; Aigner, Bernhard

    2016-01-01

    Increased levels of blood plasma urea were used as phenotypic parameter for establishing novel mouse models for kidney diseases on the genetic background of C3H inbred mice in the phenotype-driven Munich ENU mouse mutagenesis project. The phenotypically recessive mutant line HST011 was established and further analyzed. The causative mutation was detected in the POU domain, class 3 transcription factor 3 (Pou3f3) gene, which leads to the amino acid exchange Pou3f3L423P thereby affecting the conserved homeobox domain of the protein. Pou3f3 homozygous knockout mice are published and show perinatal death. Line Pou3f3L423P is a viable mouse model harboring a homozygous Pou3f3 mutation. Standardized, systemic phenotypic analysis of homozygous mutants was carried out in the German Mouse Clinic. Main phenotypic changes were low body weight and a state of low energy stores, kidney dysfunction and secondary effects thereof including low bone mineralization, multiple behavioral and neurological defects including locomotor, vestibular, auditory and nociceptive impairments, as well as multiple subtle changes in immunological parameters. Genome-wide transcriptome profiling analysis of kidney and brain of Pou3f3L423P homozygous mutants identified significantly regulated genes as compared to wild-type controls. PMID:27003440

  6. Generation and Standardized, Systemic Phenotypic Analysis of Pou3f3L423P Mutant Mice

    PubMed Central

    Kumar, Sudhir; Rathkolb, Birgit; Kemter, Elisabeth; Sabrautzki, Sibylle; Michel, Dian; Adler, Thure; Becker, Lore; Beckers, Johannes; Busch, Dirk H.; Garrett, Lillian; Hans, Wolfgang; Hölter, Sabine M.; Horsch, Marion; Klingenspor, Martin; Klopstock, Thomas; Rácz, Ildikó; Rozman, Jan; Vargas Panesso, Ingrid Liliana; Vernaleken, Alexandra; Zimmer, Andreas; Fuchs, Helmut; Gailus-Durner, Valérie; Hrabě de Angelis, Martin; Wolf, Eckhard; Aigner, Bernhard

    2016-01-01

    Increased levels of blood plasma urea were used as phenotypic parameter for establishing novel mouse models for kidney diseases on the genetic background of C3H inbred mice in the phenotype-driven Munich ENU mouse mutagenesis project. The phenotypically recessive mutant line HST011 was established and further analyzed. The causative mutation was detected in the POU domain, class 3 transcription factor 3 (Pou3f3) gene, which leads to the amino acid exchange Pou3f3L423P thereby affecting the conserved homeobox domain of the protein. Pou3f3 homozygous knockout mice are published and show perinatal death. Line Pou3f3L423P is a viable mouse model harboring a homozygous Pou3f3 mutation. Standardized, systemic phenotypic analysis of homozygous mutants was carried out in the German Mouse Clinic. Main phenotypic changes were low body weight and a state of low energy stores, kidney dysfunction and secondary effects thereof including low bone mineralization, multiple behavioral and neurological defects including locomotor, vestibular, auditory and nociceptive impairments, as well as multiple subtle changes in immunological parameters. Genome-wide transcriptome profiling analysis of kidney and brain of Pou3f3L423P homozygous mutants identified significantly regulated genes as compared to wild-type controls. PMID:27003440

  7. Generation and Standardized, Systemic Phenotypic Analysis of Pou3f3L423P Mutant Mice.

    PubMed

    Kumar, Sudhir; Rathkolb, Birgit; Kemter, Elisabeth; Sabrautzki, Sibylle; Michel, Dian; Adler, Thure; Becker, Lore; Beckers, Johannes; Busch, Dirk H; Garrett, Lillian; Hans, Wolfgang; Hölter, Sabine M; Horsch, Marion; Klingenspor, Martin; Klopstock, Thomas; Rácz, Ildikó; Rozman, Jan; Vargas Panesso, Ingrid Liliana; Vernaleken, Alexandra; Zimmer, Andreas; Fuchs, Helmut; Gailus-Durner, Valérie; Hrabě de Angelis, Martin; Wolf, Eckhard; Aigner, Bernhard

    2016-01-01

    Increased levels of blood plasma urea were used as phenotypic parameter for establishing novel mouse models for kidney diseases on the genetic background of C3H inbred mice in the phenotype-driven Munich ENU mouse mutagenesis project. The phenotypically recessive mutant line HST011 was established and further analyzed. The causative mutation was detected in the POU domain, class 3 transcription factor 3 (Pou3f3) gene, which leads to the amino acid exchange Pou3f3L423P thereby affecting the conserved homeobox domain of the protein. Pou3f3 homozygous knockout mice are published and show perinatal death. Line Pou3f3L423P is a viable mouse model harboring a homozygous Pou3f3 mutation. Standardized, systemic phenotypic analysis of homozygous mutants was carried out in the German Mouse Clinic. Main phenotypic changes were low body weight and a state of low energy stores, kidney dysfunction and secondary effects thereof including low bone mineralization, multiple behavioral and neurological defects including locomotor, vestibular, auditory and nociceptive impairments, as well as multiple subtle changes in immunological parameters. Genome-wide transcriptome profiling analysis of kidney and brain of Pou3f3L423P homozygous mutants identified significantly regulated genes as compared to wild-type controls.

  8. Integrated Data Collection Analysis (IDCA) Program - KClO4sub>/Carbon Mixture

    SciTech Connect

    Sandstrom, Mary M.; Brown, Geoffrey W.; Preston, Daniel N.; Pollard, Colin J.; Warner, Kirstin F.; Sorensen, Daniel N.; Remmers, Daniel L.; Shelley, Timothy J.; Reyes, Jose A.; Hsu, Peter C.; Reynolds, John G.

    2013-01-31

    The Integrated Data Collection Analysis (IDCA) program is conducting a proficiency study for Small- Scale Safety and Thermal (SSST) testing of homemade explosives (HMEs). Described here are the results for impact, friction, electrostatic discharge, and differential scanning calorimetry analysis of a mixture of KClO4sub> and activated carbon—KClO4sub>/C mixture. This material was selected because of the challenge of performing SSST testing of a mixture of two solids. The mixture was found to be insensitive to impact, friction, and thermal stimulus, and somewhat sensitive to spark discharge. This effort, funded by the Department of Homeland Security (DHS), ultimately will put the issues of safe handling of these materials in perspective with standard military explosives. The study is adding SSST testing results for a broad suite of different HMEs to the literature. Ultimately the study has the potential to suggest new guidelines and methods and possibly establish the SSST testing accuracies needed to develop safe handling practices for HMEs. Each participating testing laboratory uses identical test materials and preparation methods wherever possible. Note, however, the test procedures differ among the laboratories. The results are compared among the laboratories and then compared to historical data from various sources. The testing performers involved for the KClO4sub>/carbon mixture are Lawrence Livermore National Laboratory (LLNL), Los Alamos National Laboratory (LANL), Indian Head Division, Naval Surface Warfare Center, (NSWC IHD), and Air Force Research Laboratory (AFRL/RXQL). These tests are conducted as a proficiency study in order to establish some consistency in test protocols, procedures, and experiments and to understand how to compare results when these testing variables cannot be made consistent.

  9. Integrated Data Collection Analysis (IDCA) program--KClO4sub>/Dodecane Mixture

    SciTech Connect

    Sandstrom, Mary M.; Brown, Geoffrey W.; Preston, Daniel N.; Pollard, Colin J.; Warner, Kirstin F.; Sorensen, Daniel N.; Remmers, Daniel L.; Shelley, Timothy J.; Reyes, Jose A.; Hsu, Peter C.; Reynolds, John G.

    2012-05-11

    The Integrated Data Collection Analysis (IDCA) program is conducting a proficiency study for Small- Scale Safety and Thermal (SSST) testing of homemade explosives (HMEs). Described here are the results for impact, friction, electrostatic discharge, and differential scanning calorimetry analysis of a mixture of KClO4sub> and dodecane—KClO4sub>/dodecane mixture. This material was selected because of the challenge of performing SSST testing of a mixture of solid and liquid materials. The mixture was found to: 1) be less sensitive to impact than RDX, and PETN, 2) less sensitive to friction than RDX and PETN, and 3) less sensitive to spark than RDX and PETN. The thermal analysis showed little or no exothermic features suggesting that the dodecane volatilized at low temperatures. A prominent endothermic feature was observed and assigned to a phase transition of KClO4sub>. This effort, funded by the Department of Homeland Security (DHS), ultimately will put the issues of safe handling of these materials in perspective with standard military explosives. The study is adding SSST testing results for a broad suite of different HMEs to the literature. Ultimately the study has the potential to suggest new guidelines and methods and possibly establish the SSST testing accuracies needed to develop safe handling practices for HMEs. Each participating testing laboratory uses identical test materials and preparation methods wherever possible. Note, however, the test procedures differ among the laboratories. The results are compared among the laboratories and then compared to historical data from various sources. The testing performers involved for the KClO4sub>/dodecane mixture are Lawrence Livermore National Laboratory (LLNL), Los Alamos National Laboratory (LANL), Indian Head Division, Naval Surface Warfare Center, (NSWC IHD), and Air Force Research Laboratory (AFRL/RXQL). These tests are conducted as a proficiency study in order to establish some

  10. Discovery of a metastable Al20Sm4sub> phase

    SciTech Connect

    Ye, Z.; Zhang, F.; Sun, Y.; Mendelev, M. I.; Ott, R. T.; Park, E.; Besser, M. F.; Kramer, M. J.; Ding, Z.; Wang, C. -Z.; Ho, K. -M.

    2015-03-09

    In this study, we present an efficient genetic algorithm, integrated with experimental diffraction data, to solve a nanoscale metastable Al20Sm4sub> phase that evolves during crystallization of an amorphous magnetron sputtered Al90Sm10 alloy. The excellent match between calculated and experimental X-ray diffraction patterns confirms an accurate description of this metastable phase. Molecular dynamic simulations of crystal growth from the liquid phase predict the formation of disordered defects in the devitrified crystal.

  11. Distinct H3F3A and H3F3B driver mutations define chondroblastoma and giant cell tumor of bone.

    PubMed

    Behjati, Sam; Tarpey, Patrick S; Presneau, Nadège; Scheipl, Susanne; Pillay, Nischalan; Van Loo, Peter; Wedge, David C; Cooke, Susanna L; Gundem, Gunes; Davies, Helen; Nik-Zainal, Serena; Martin, Sancha; McLaren, Stuart; Goody, Victoria; Goodie, Victoria; Robinson, Ben; Butler, Adam; Teague, Jon W; Halai, Dina; Khatri, Bhavisha; Myklebost, Ola; Baumhoer, Daniel; Jundt, Gernot; Hamoudi, Rifat; Tirabosco, Roberto; Amary, M Fernanda; Futreal, P Andrew; Stratton, Michael R; Campbell, Peter J; Flanagan, Adrienne M

    2013-12-01

    It is recognized that some mutated cancer genes contribute to the development of many cancer types, whereas others are cancer type specific. For genes that are mutated in multiple cancer classes, mutations are usually similar in the different affected cancer types. Here, however, we report exquisite tumor type specificity for different histone H3.3 driver alterations. In 73 of 77 cases of chondroblastoma (95%), we found p.Lys36Met alterations predominantly encoded in H3F3B, which is one of two genes for histone H3.3. In contrast, in 92% (49/53) of giant cell tumors of bone, we found histone H3.3 alterations exclusively in H3F3A, leading to p.Gly34Trp or, in one case, p.Gly34Leu alterations. The mutations were restricted to the stromal cell population and were not detected in osteoclasts or their precursors. In the context of previously reported H3F3A mutations encoding p.Lys27Met and p.Gly34Arg or p.Gly34Val alterations in childhood brain tumors, a remarkable picture of tumor type specificity for histone H3.3 driver alterations emerges, indicating that histone H3.3 residues, mutations and genes have distinct functions.

  12. Neural Cell Adhesion Molecule NrCAM Regulates Semaphorin 3F-Induced Dendritic Spine Remodeling

    PubMed Central

    Demyanenko, Galina P.; Mohan, Vishwa; Zhang, Xuying; Brennaman, Leann H.; Dharbal, Katherine E.S.; Tran, Tracy S.; Manis, Paul B.

    2014-01-01

    Neuron-glial related cell adhesion molecule (NrCAM) is a regulator of axon growth and repellent guidance, and has been implicated in autism spectrum disorders. Here a novel postsynaptic role for NrCAM in Semaphorin3F (Sema3F)-induced dendritic spine remodeling was identified in pyramidal neurons of the primary visual cortex (V1). NrCAM localized to dendritic spines of star pyramidal cells in postnatal V1, where it was coexpressed with Sema3F. NrCAM deletion in mice resulted in elevated spine densities on apical dendrites of star pyramidal cells at both postnatal and adult stages, and electron microscopy revealed increased numbers of asymmetric synapses in layer 4 of V1. Whole-cell recordings in cortical slices from NrCAM-null mice revealed increased frequency of mEPSCs in star pyramidal neurons. Recombinant Sema3F-Fc protein induced spine retraction on apical dendrites of wild-type, but not NrCAM-null cortical neurons in culture, while re-expression of NrCAM rescued the spine retraction response. NrCAM formed a complex in brain with Sema3F receptor subunits Neuropilin-2 (Npn-2) and PlexinA3 (PlexA3) through an Npn-2-binding sequence (TARNER) in the extracellular Ig1 domain. A trans heterozygous genetic interaction test demonstrated that Sema3F and NrCAM pathways interacted in vivo to regulate spine density in star pyramidal neurons. These findings reveal NrCAM as a novel postnatal regulator of dendritic spine density in cortical pyramidal neurons, and an integral component of the Sema3F receptor complex. The results implicate NrCAM as a contributor to excitatory/inhibitory balance in neocortical circuits. PMID:25143608

  13. A dispersive treatment of Kl4sub> decays

    SciTech Connect

    Colangelo, Gilberto; Passemar, Emilie; Stoffer, Peter

    2015-04-28

    Kl4sub> decays offer several reasons of interest: they allow an accurate measurement of ππ-scattering lengths; they provide the best source for the determination of some low-energy constants of xPT; one form factor is directly related to the chiral anomaly, which can be measured here. We present a dispersive treatment of Kl4sub> decays that provides a resummation of ππ- and Kπ-rescattering effects. In addition, the free parameters of the dispersion relation are fitted to the data of the high-statistics experiments E865 and NA48/2. The matching toxPT at NLO and NNLO enables us to determine the LECs Lr1, Lr2 and Lr3. With recently published data from NA48/2, the LEC Lr9 can be determined as well. In contrast to a pure chiral treatment, the dispersion relation describes the observed curvature of one of the form factors, which we understand as a rescattering effect beyond NNLO.

  14. APOBEC3DE Antagonizes Hepatitis B Virus Restriction Factors APOBEC3F and APOBEC3G.

    PubMed

    Bouzidi, Mohamed S; Caval, Vincent; Suspène, Rodolphe; Hallez, Camille; Pineau, Pascal; Wain-Hobson, Simon; Vartanian, Jean-Pierre

    2016-08-28

    The APOBEC3 locus consists of seven genes (A3A-A3C, A3DE, A3F-A3H) that encode DNA cytidine deaminases. These enzymes deaminate single-stranded DNA, the result being DNA peppered with CG →TA mutations preferentially in the context of 5'TpC with the exception of APOBEC3G (A3G), which prefers 5'CpC dinucleotides. Hepatitis B virus (HBV) DNA is vulnerable to genetic editing by APOBEC3 cytidine deaminases, A3G being a major restriction factor. APOBEC3DE (A3DE) stands out in that it is catalytically inactive due to a fixed Tyr320Cys substitution in the C-terminal domain. As A3DE is closely related to A3F and A3G, which can form homo- and heterodimers and multimers, the impact of A3DE on HBV replication via modulation of other APOBEC3 restriction factors was investigated. A3DE binds to itself, A3F, and A3G and antagonizes A3F and, to a lesser extent, A3G restriction of HBV replication. A3DE suppresses A3F and A3G from HBV particles, leading to enhanced HBV replication. Ironically, while being part of a cluster of innate restriction factors, the A3DE phenotype is proviral. As the gorilla genome encodes the same Tyr320Cys substitution, this proviral phenotype seems to have been selected for. PMID:27289067

  15. APOBEC3G and APOBEC3F Act in Concert To Extinguish HIV-1 Replication

    PubMed Central

    Krisko, John F.; Begum, Nurjahan; Baker, Caroline E.

    2016-01-01

    ABSTRACT The multifunctional HIV-1 accessory protein Vif counters the antiviral activities of APOBEC3G (A3G) and APOBEC3F (A3F), and some Vifs counter stable alleles of APOBEC3H (A3H). Studies in humanized mice have shown that HIV-1 lacking Vif expression is not viable. Here, we look at the relative contributions of the three APOBEC3s to viral extinction. Inoculation of bone marrow/liver/thymus (BLT) mice with CCR5-tropic HIV-1JRCSF (JRCSF) expressing a vif gene inactive for A3G but not A3F degradation activity (JRCSFvifH42/43D) displayed either no or delayed replication. JRCSF expressing a vif gene mutated to inactivate A3F degradation but not A3G degradation (JRCSFvifW79S) always replicated to high viral loads with variable delays. JRCSF with vif mutated to lack both A3G and A3F degradation activities (JRCSFvifH42/43DW79S) failed to replicate, mimicking JRCSF without Vif expression (JRCSFΔvif). JRCSF and JRCSFvifH42/43D, but not JRCSFvifW79S or JRCSFvifH42/43DW79S, degraded APOBEC3D. With one exception, JRCSFs expressing mutant Vifs that replicated acquired enforced vif mutations. These mutations partially restored A3G or A3F degradation activity and fully replaced JRCSFvifH42/43D or JRCSFvifW79S by 10 weeks. Surprisingly, induced mutations temporally lagged behind high levels of virus in blood. In the exceptional case, JRCSFvifH42/43D replicated after a prolonged delay with no mutations in vif but instead a V27I mutation in the RNase H coding sequence. JRCSFvifH42/43D infections exhibited massive GG/AG mutations in pol viral DNA, but in viral RNA, there were no fixed mutations in the Gag or reverse transcriptase coding sequence. A3H did not contribute to viral extinction but, in combination with A3F, could delay JRCSF replication. A3H was also found to hypermutate viral DNA. IMPORTANCE Vif degradation of A3G and A3F enhances viral fitness, as virus with even a partially restored capacity for degradation outgrows JRCSFvifH42/43D and JRCSFvifW79S. Unexpectedly

  16. Time-resolved luminescence spectroscopy of structurally disordered K3WO3F3 crystals

    NASA Astrophysics Data System (ADS)

    Omelkov, S. I.; Spassky, D. A.; Pustovarov, V. A.; Kozlov, A. V.; Isaenko, L. I.

    2016-08-01

    Three emission centers of exciton-like origin, with distinct relaxation time, emission and excitation spectra were revealed in K3WO3F3 and described taking into account its structural disordering. Low-temperature monoclinic phase of K3WO3F3 features few anion sites with mixed oxygen/fluorine occupancy per [WO3F3] octahedron. Therefore, different kinds of distorted octahedra form, providing different luminescence centers. The time-resolved luminescence spectroscopy technique was applied to distinguish these centers. The simultaneous thermal quenching of them above ∼200 K was qualitatively explained involving dynamic structural disorder of the compound. The energy transfer mechanism between centers was found and tentatively described by the diffusion of excitons. Apart from intrinsic luminescence, the PL of defect-related centers was discovered and the role of shallow charge carrier traps in the low-temperature persistent luminescence was revealed.

  17. Synthesis, structure, and optical properties of CsU{sub 2}(PO{sub 4}){sub 3}

    SciTech Connect

    Oh, George N.; Ringe, Emilie; Van Duyne, Richard P.; Ibers, James A.

    2012-01-15

    CsU{sub 2}(PO{sub 4}){sub 3} was synthesized in highest yield by the reaction in a fused-silica tube of U, P, and Se in a CsCl flux at 1273 K. It crystallizes with four formula units in space group P2{sub 1}/n of the monoclinic system in a new structure type. The structure of CsU{sub 2}(PO{sub 4}){sub 3} is composed of U and Cs atoms coordinated by PO{sub 4}{sup 3-} units in distorted octahedral arrangements. Each U atom corner shares with six PO{sub 4}{sup 3-} units. Each Cs atom face shares with one, edge shares with two, and corner shares with three PO{sub 4}{sup 3-} units. The structure shares some features with the sodium zirconium phosphate structure type. X-ray powder diffraction results demonstrate that the present CsU{sub 2}(PO{sub 4}){sub 3} compound crystallizes in a structure different from the previously reported {beta} Prime - and {gamma}-CsU{sub 2}(PO{sub 4}){sub 3} compounds. CsU{sub 2}(PO{sub 4}){sub 3} is highly pleochroic, as demonstrated by single-crystal optical absorption measurements. - Graphical abstract: Stacking of the layers in CsU{sub 2}(PO{sub 4}){sub 3}, viewed along [100]. Highlights: Black-Right-Pointing-Pointer Compound CsU{sub 2}(PO{sub 4}){sub 3} crystallizes in a new structure type. Black-Right-Pointing-Pointer Structure shares some features with the sodium zirconium phosphate structure type. Black-Right-Pointing-Pointer CsU{sub 2}(PO{sub 4}){sub 3} is highly pleochroic, as demonstrated by single-crystal optical absorption measurements.

  18. Heat capacity and neutron diffraction studies on the frustrated magnetic Co{sub 2}(OH)(PO{sub 4}){sub 1-x}(AsO{sub 4}){sub x} [0{<=}x{<=}1] solid solution

    SciTech Connect

    Pedro, I. de; Rojo, J.M.; Rodriguez Fernandez, J.; Sanchez Marcos, J.; Fernandez-Diaz, M.T.; Rojo, T.

    2012-04-15

    The Co{sub 2}(OH)(PO{sub 4}){sub 1-x}(AsO{sub 4}){sub x} [0{<=}x{<=}1] solid solution exhibits a complex magnetic behaviour due to the bond-frustration in its magnetic structure. Heat capacity measurements of the (x=0.1-0.5) phases show a three-dimensional magnetic ordering ({lambda} anomaly) that shifts to lower temperatures and becomes broader as the AsO{sub 4}{sup 3-} content increases. For x=0.75, no significant feature was observed whereas for higher arsenate ion content, x=0.9 and 1, a small maximum was detected. The magnetic structures of solid solution are consistent with the existence of predominant antiferromagnetic superexchange interactions through the |OH| and |XO{sub 4}| (X=P and As) groups between the Co{sup +2} ions. The substitution of PO{sub 4}{sup 3-} by AsO{sub 4}{sup 3-} anions by more than 90% substantially modifies the magnetic exchange pathways in the solid solution, leading to an incommensurate antiferromagnetic structure in Co{sub 2}(OH)(PO{sub 4}){sub 1-x}(AsO{sub 4}){sub x} [x=0.9 and 1] phases. - Graphical abstract: Magnetic structures of Co{sub 2}(OH)(PO{sub 4}){sub 1-x}(AsO{sub 4}){sub x} [0{<=}x{<=}1]. The ordering of the magnetic moments of Co{sup 2+} is in c direction for the two crystallographic positions (dimers and chains) in all compounds. The unit cell is surrounded by a red line. Highlights: Black-Right-Pointing-Pointer Synthesis of a new adamite-type compounds, Co{sub 2}(OH)(PO{sub 4}){sub 1-x}(AsO{sub 4}){sub x} (0.1, 0.25, 0.5, 0.75, 0.9) phases. Black-Right-Pointing-Pointer Co{sub 2}(OH)(PO{sub 4}){sub 1-x}(AsO{sub 4}){sub x} (0-1) solid solution; magnetic frustrated system. Black-Right-Pointing-Pointer High resolution neutron powder diffraction to determine the crystal structures. Black-Right-Pointing-Pointer Incommensurate magnetic structures at low temperature. Black-Right-Pointing-Pointer Magnetostructural correlations in cobalt-based Co{sub 2}(OH)XO{sub 4} (X=P and As) insulation compounds.

  19. Preparation and crystal structure of Na sub 3 SbO(PO sub 4 ) sub 2

    SciTech Connect

    Guyomard, D.; Pagnoux, C.; Verbaere, A.; Piffard, Y. ); Zah Letho, J.J. )

    1991-02-01

    The single phase compound Na{sub 3}SbO(PO{sub 4}){sub 2} was prepared by a solid state reaction. It crystallizes in the orthorhombic system, space group P2{sub 1}2{sub 1}2{sub 1} with a = 6.964(1) {angstrom}, b = 9.284(2) {angstrom}, c = 12.425(2) {angstrom}, Z = 4. The structure was determined from 968 reflections collected on a Nonius CAD4 automatic diffractometer with MoK{alpha} radiation. The final R index and weighted R{sub w} index are 0.031 and 0.039, respectively. The structure is built up from strings of corner-sharing SbO{sub 6} octahedra to which phosphate groups are linked by two of their vertices. These chains, running parallel to the a-axis, are separated from each other by sodium atoms.

  20. Anomalous magnetic structure and spin dynamics in magnetoelectric LiFePO4sub>

    SciTech Connect

    Toft-Petersen, Rasmus; Reehuis, Manfred; Jensen, Thomas B. S.; Andersen, Niels H.; Li, Jiying; Le, Manh Duc; Laver, Mark; Niedermayer, Christof; Klemke, Bastian; Lefmann, Kim; Vaknin, David

    2015-07-06

    We report significant details of the magnetic structure and spin dynamics of LiFePO4sub> obtained by single-crystal neutron scattering. Our results confirm a previously reported collinear rotation of the spins away from the principal b axis, and they determine that the rotation is toward the a axis. In addition, we find a significant spin-canting component along c. Furthermore, the possible causes of these components are discussed, and their significance for the magnetoelectric effect is analyzed. Inelastic neutron scattering along the three principal directions reveals a highly anisotropic hard plane consistent with earlier susceptibility measurements. While using a spin Hamiltonian, we show that the spin dimensionality is intermediate between XY- and Ising-like, with an easy b axis and a hard c axis. As a result, it is shown that both next-nearest neighbor exchange couplings in the bc plane are in competition with the strongest nearest neighbor coupling.

  1. Two-Dimensional Nb-Based M 4sub> C 3 Solid Solutions (MXenes)

    SciTech Connect

    Yang, Jian; Naguib, Michael; Ghidiu, Michael; Pan, Li-Mei; Gu, Jian; Nanda, Jagjit; Halim, Joseph; Gogotsi, Yury; Barsoum, Michel W.; Zhou, Y.

    2015-10-15

    Two new two-dimensional Nb4sub>C3-based solid solutions (MXenes), (Nb0.8,Ti0.2)4sub>C3Tx and (Nb0.8,Zr0.2)4sub>C3Tx (where T is a surface termination) were synthesizedas confirmed by X-ray diffractionfrom their corresponding MAX phase precursors (Nb0.8,Ti0.2)4sub>AlC3 and (Nb0.8,Zr0.2)4sub>AlC3. In our report we discuss Zr-containing MXene. We also studied intercalation of Li ions into these two compositions, and Nb4sub>C3Tx in order to determine the potential of those materials for energy storage applications. Lithiation and delithiation peaks at 2.26 and 2.35 V, respectively, appeared in the case of Nb4sub>C3Tx, but were not present in Nb2CTx. After 20 cycles at a rate of C/4, the specific capacities of (Nb0.8,Ti0.2)4sub>C3Txand (Nb0.8,Ti0.2)4sub>C3Tx were 158 and 132 mAh/g, respectively, both slightly lower than the capacity of Nb4sub>C3Tx.

  2. Relations structurales entre U 3O 8 et quelques fluorures mixtes de formules M2M' 3F 11, MM' 2F 7 et MM' 3F 10

    NASA Astrophysics Data System (ADS)

    Aléonard, S.; Le Fur, Y.; Champarnaud-Mesjard, J. C.; Frit, B.; Roux, M. Th.

    1983-01-01

    U 3O 8 oxide, as well as M2M' 3F 11, MM' 2F 7 and MM' 3F 10 fluorides, with M = Rb, Tl, Cs, NH 4 and M' = In, Lu, Yb, Tm, is described as the regular repetition according to the … A-A-A … sequence of identical and parallel sheets of edge-and corner-sharing M'F 7 or UO 7 pentagonal bipyramids and M'F 6 octahedra. M' and U atoms are systematically located at the lattice points of a pseudohexagonal network, but in the fluorides some of these lattice points are vacant, producing hexagonal tunnels in which M atoms are located. It is shown that in the two kinds of compounds the same linear chains and M' 3X17 groups of pentagonal bipyramids are present, and that the transformation of the U 3O 8 structure into the fluorides can be achieved by an ordered substitution of some linear … UOUO … chains by … M- M- M … chains. All these structures can be described with the same structural model based on the chemical twinning principle.

  3. COMPARATIVE EVALUATION OF R3f GARNET BEAD FILTRATION AND MULTIMEDIA FILTRATION SYSTEMS; FINAL REPORT

    EPA Science Inventory

    This report summarizes the results of tests conducted to date at the EPA T&E Facility on the R3f filtration system utilizing fine beads (such as garnet beads or glass beads) and a conventional multimedia filtration system. Both systems have been designed and built by Enprotec, a...

  4. Census of Population and Housing, 1980: Summary Tape File 3F. Technical Documentation.

    ERIC Educational Resources Information Center

    Bureau of the Census (DOC), Washington, DC. Data User Services Div.

    This report provides technical documentation associated with a 1980 Census of Population and Housing Summary Tape File (STF) 3F--which contains responses to the extended questionnaire summarized in STF 3, aggregated by school district. The file contains sample data inflated to represent the total population, 100% counts, and unweighted sample…

  5. 48 CFR 47.305-3 - F.o.b. origin solicitations.

    Code of Federal Regulations, 2010 CFR

    2010-10-01

    ... 48 Federal Acquisition Regulations System 1 2010-10-01 2010-10-01 false F.o.b. origin... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.305-3 F.o.b. origin solicitations. When preparing f.o.b. origin solicitations, the contracting officer shall refer to 47.303, where...

  6. 48 CFR 47.303-3 - F.o.b. origin, freight allowed.

    Code of Federal Regulations, 2010 CFR

    2010-10-01

    ... Administration prescribes commercial zones at Subpart B of 49 CFR part 372); and (2) An allowance for freight... 48 Federal Acquisition Regulations System 1 2010-10-01 2010-10-01 false F.o.b. origin, freight... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.303-3 F.o.b. origin,...

  7. 48 CFR 47.305-3 - F.o.b. origin solicitations.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 48 Federal Acquisition Regulations System 1 2013-10-01 2013-10-01 false F.o.b. origin... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.305-3 F.o.b. origin solicitations. When preparing f.o.b. origin solicitations, the contracting officer shall refer to 47.303, where...

  8. 48 CFR 47.303-3 - F.o.b. origin, freight allowed.

    Code of Federal Regulations, 2011 CFR

    2011-10-01

    ... Administration prescribes commercial zones at Subpart B of 49 CFR part 372); and (2) An allowance for freight... 48 Federal Acquisition Regulations System 1 2011-10-01 2011-10-01 false F.o.b. origin, freight... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.303-3 F.o.b. origin,...

  9. 48 CFR 47.305-3 - F.o.b. origin solicitations.

    Code of Federal Regulations, 2011 CFR

    2011-10-01

    ... 48 Federal Acquisition Regulations System 1 2011-10-01 2011-10-01 false F.o.b. origin... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.305-3 F.o.b. origin solicitations. When preparing f.o.b. origin solicitations, the contracting officer shall refer to 47.303, where...

  10. 48 CFR 47.303-3 - F.o.b. origin, freight allowed.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... Administration prescribes commercial zones at Subpart B of 49 CFR part 372); and (2) An allowance for freight... 48 Federal Acquisition Regulations System 1 2013-10-01 2013-10-01 false F.o.b. origin, freight... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.303-3 F.o.b. origin,...

  11. 48 CFR 47.305-3 - F.o.b. origin solicitations.

    Code of Federal Regulations, 2012 CFR

    2012-10-01

    ... 48 Federal Acquisition Regulations System 1 2012-10-01 2012-10-01 false F.o.b. origin... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.305-3 F.o.b. origin solicitations. When preparing f.o.b. origin solicitations, the contracting officer shall refer to 47.303, where...

  12. 48 CFR 47.303-3 - F.o.b. origin, freight allowed.

    Code of Federal Regulations, 2012 CFR

    2012-10-01

    ... Administration prescribes commercial zones at Subpart B of 49 CFR part 372); and (2) An allowance for freight... 48 Federal Acquisition Regulations System 1 2012-10-01 2012-10-01 false F.o.b. origin, freight... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.303-3 F.o.b. origin,...

  13. 48 CFR 47.303-3 - F.o.b. origin, freight allowed.

    Code of Federal Regulations, 2014 CFR

    2014-10-01

    ... Administration prescribes commercial zones at Subpart B of 49 CFR part 372); and (2) An allowance for freight... 48 Federal Acquisition Regulations System 1 2014-10-01 2014-10-01 false F.o.b. origin, freight... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.303-3 F.o.b. origin,...

  14. 48 CFR 47.305-3 - F.o.b. origin solicitations.

    Code of Federal Regulations, 2014 CFR

    2014-10-01

    ... 48 Federal Acquisition Regulations System 1 2014-10-01 2014-10-01 false F.o.b. origin... CONTRACT MANAGEMENT TRANSPORTATION Transportation in Supply Contracts 47.305-3 F.o.b. origin solicitations. When preparing f.o.b. origin solicitations, the contracting officer shall refer to 47.303, where...

  15. Treatment of neoplastic meningeal xenografts by intraventricular administration of an antiganglioside monoclonal antibody, 3F8.

    PubMed

    Bergman, I; Barmada, M A; Heller, G; Griffin, J A; Cheung, N K

    1999-08-12

    Leptomeningeal (LM) neoplastic metastases are painful, debilitating and inevitably lethal. Intrathecal (IT) anti-tumor antibodies may have therapeutic potential. We evaluated 3F8, an anti-G(D2) murine IgG(3) monoclonal antibody (MAb) in the treatment of human melanoma (SKMEL-1) and neuroblastoma (NMB7) xenografts in athymic rats. Both tumors were lysed efficiently in vitro by 3F8 in the presence of rat neutrophils or rat complement. Antibody-dependent cellular cytotoxicity (ADCC) was not augmented by recombinant human GM-CSF (rhGM-CSF), rhG-CSF, recombinant rat MIP-2 (rrMIP-2) or lipopolysaccharide (LPS). In vivo, continuous intraventricular administration of 3F8 and LPS prevented tumor engraftment, retarded tumor growth and eradicated 3-day-old established xenografts whereas 3F8 alone, LPS alone or F(ab)'(2) plus LPS had no or only marginal effects. Tumor establishment in brain was completely prevented in 36% of animals implanted with SKMEL-1 and 65% of animals implanted with NMB7. Twenty percent of established xenografts around the brain were eradicated but all animals had persistent tumor in the lumbosacral meninges despite treatment. Continuous intraventricular infusion of LPS produced a variable polymorphonuclear (PMN) pleocytosis that was dose-dependent. Continuous intraventricular infusion of 3F8 produced immunohistochemically detectable attachment to 86% of persistent brain deposits of tumor but <1% of spinal lumbosacral deposits. We conclude that regional therapy with anti-G(D2) MAb could target neutrophils to inhibit LM tumor growth. However, optimal activation and mobilization of neutrophils into the cerebrospinal fluid (CSF) and improved penetration of MAb to tumor sites remain critical variables.

  16. New double molybdate Na{sub 9}Fe(MoO{sub 4}){sub 6}: Synthesis, structure, properties

    SciTech Connect

    Savina, Aleksandra A.; Solodovnikov, Sergey F.; Basovich, Olga M.; Solodovnikova, Zoya A.; Belov, Dmitry A.; Pokholok, Konstantin V.; Gudkova, Irina A.; Stefanovich, Sergey Yu.; Lazoryak, Bogdan I.; Khaikina, Elena G.

    2013-09-15

    A new double molybdate Na{sub 9}Fe(MoO{sub 4}){sub 6} was synthesized using solid state reactions and studied with X-ray powder diffraction, second harmonic generation (SHG) technique, differential scanning calorimetry, X-ray fluorescence analysis, Mössbauer and dielectric impedance spectroscopy. Single crystals of Na{sub 9}Fe(MoO{sub 4}){sub 6} were obtained and its structure was solved (the space group R3{sup ¯}, a=14.8264(2), c=19.2402(3) Å, V=3662.79(9) Å{sup 3}, Z=6, R=0.0132). The structure is related to that of sodium ion conductor II-Na{sub 3}Fe{sub 2}(AsO{sub 4}){sub 3}. The basic structure units are polyhedral clusters composed of central FeO{sub 6} octahedron sharing edges with three Na(1)O{sub 6} octahedra. The clusters share common vertices with bridging MoO{sub 4} tetrahedra to form an open 3D framework where the cavities are occupied by Na(2) and Na(3) atoms. The compound melts incongruently at 904.7±0.2 K. Arrhenius type temperature dependence of electric conductivity σ has been registered in solid state (σ=6.8×10{sup −2} S cm{sup −1} at 800 K), thus allowing considering Na{sub 9}Fe(MoO{sub 4}){sub 6} as a new sodium ion conductor. - Graphical abstract: A new double molybdate Na{sub 9}Fe(MoO{sub 4}){sub 6} was synthesized and structurally characterized, its physicochemical properties were studied. Display Omitted - Highlights: • A new compound Na{sub 9}Fe(MoO{sub 4}){sub 6} was synthesized as ceramics and single crystals. • Na{sub 9}Fe(MoO{sub 4}){sub 6} structure is related to that of sodium-ion conductor II-Na{sub 3}Fe{sub 2}(AsO{sub 4}){sub 3}. • Physicochemical properties of the compound were studied. • Arrhenius plot for conductivity showed 6.8×10{sup −2} S cm{sup −1} at 800 K, E{sub a}∼0.8 eV. • Thus, Na{sub 9}Fe(MoO{sub 4}){sub 6} may be considered as a new sodium ion conductor.

  17. Luminescence properties of phosphate phosphor Ba{sub 3}Y(PO{sub 4}){sub 3}:Sm{sup 3+}

    SciTech Connect

    Yang, Fu; Liu, Yufeng; Tian, Xiaodong; Dong, Guoyi; Yu, Quanmao

    2015-05-15

    A series of reddish orange-emitting phosphate phosphors Ba{sub 3}Y{sub 1−x}(PO{sub 4}){sub 3}:xSm{sup 3+}(0.01≤x≤0.20) were synthesized by solid-state reaction. X-ray diffraction and photoluminescence spectra were utilized to characterize the structure and luminescence properties of as-synthesized phosphors. The optimized phosphors Ba{sub 3}Y{sub 0.95}(PO{sub 4}){sub 3}:0.05Sm{sup 3+} present several excitation bands from 300 to 500 nm, and exhibit intense reddish orange-emitting properties. The energy transfer type between Sm{sup 3+} ions was confirmed as d–d interaction by using Van Uitert model. The chromatic properties of the typical sample Ba{sub 3}Y(PO{sub 4}){sub 3}:0.05Sm{sup 3+} phosphor have been found to have chromaticity coordinates of (0.583, 0.405), which are located in reddish orange region under the excitation of 401 nm. These results indicated that Ba{sub 3}Y(PO{sub 4}){sub 3}:Sm{sup 3+} phosphors have potential applications in the field of lighting and display due to their effective excitation in the near-ultraviolet range. - Graphical abstract: The color coordinates for 5 mol% Sm{sup 3+} doped Ba{sub 3}Y(PO{sub 4}){sub 3} phosphor were calculated to be (0.583, 0.405), which are located in reddish orange region under the excitation of 401 nm. The peaks of Ba{sub 3}Y{sub 0.95}(PO{sub 4}){sub 3}:0.05Sm{sup 3+} phosphor with the highest emission intensity at 600 nm are broader than those of Y{sub 2}O{sub 3}:Eu{sup 3+} and Y{sub 2}O{sub 2}S:Eu{sup 3+} phosphors. All these characteristics suggest that Ba{sub 3}Y(PO{sub 4}){sub 3}:Sm{sup 3+} phosphors are suitable for near-UV (370–410 nm) excitation and can be applicable to near UV-based WLEDs. ▪ - Highlights: • Different concentration Sm{sup 3+}-doped Ba{sub 3}Y(PO{sub 4}){sub 3} phosphors were fabricated by solid state method. • The optimized phosphors present the several excitation bands from 300 to 500 nm. • The Ba{sub 3}Y(PO{sub 4}){sub 3}:Sm{sup 3+} shows bright reddish orange

  18. New insight in the structure-luminescence relationships of Ca{sub 9}Eu(PO{sub 4}){sub 7}

    SciTech Connect

    Benhamou, Rajia Ait; Bessiere, Aurelie; Wallez, Gilles; Viana, Bruno; Elaatmani, Mohamed; Daoud, Mohamed; Zegzouti, Abdelwahed

    2009-08-15

    The double phosphate Ca{sub 9}Eu(PO{sub 4}){sub 7}, obtained by solid state reaction, was found to be isotypic with Ca{sub 3}(PO{sub 4}){sub 2}, with space group R3c and unit cell parameters a=10.4546(1) A, c=37.4050(3) A, V=3540.67(9) A{sup 3}, Z=6. The structure parameters refined using the Rietveld method showed that europium shares positions M1, M2 and M3 with calcium, contradicting previously published Moessbauer results. Low temperature luminescence under selective excitation of Eu{sup 3+} in Ca{sub 9}Y{sub 1-x}Eu{sub x}(PO{sub 4}){sub 7} and in Ca{sub 9}Eu(PO{sub 4}){sub 7} samples was studied, confirming the Eu{sup 3+} distribution into these sites. At 10 K, {sup 5}D{sub 0}->{sup 7}F{sub 0} emission lines of Eu{sup 3+} were observed at 578.5, 579.5, 580.1 nm for the M3, M1 and M2 sites, respectively. High temperature X-ray powder diffraction evidenced a second-order phase transition around 573 deg. C. - Graphical Abstract: Emission spectra of Ca{sub 9}Eu(PO{sub 4}){sub 7} recorded at 10 K evidencing the three different sites for Eu{sup 3+} dopant cation.

  19. Insights into the structure of mixed CO2/CH4sub> in gas hydrates

    SciTech Connect

    Everett, S. Michelle; Rawn, Claudia J.; Chakoumakos, Bryan C.; Keffer, David J.; Huq, Ashfia; Phelps, Tommy J.

    2015-05-12

    The exchange of carbon dioxide for methane in natural gas hydrates is an attractive approach to harvesting CH4sub> for energy production while simultaneously sequestering CO2. In addition to the energy and environmental implications, the solid solution of clathrate hydrate (CH4sub>)1-x(CO2)x·5.75H2O provides a model system to study how the distinct bonding and shapes of CH4sub> and CO2 influence the structure and properties of the compound. In this paper, high-resolution neutron diffraction was used to examine mixed CO2/CH4sub> gas hydrates. CO2-rich hydrates had smaller lattice parameters, which were attributed to the higher affinity of the CO2 molecule interacting with H2O molecules that form the surrounding cages, and resulted in a reduction in the unit-cell volume. Experimental nuclear scattering densities illustrate how the cage occupants and energy landscape change with composition. Finally, these results provide important insights on the impact and mechanisms for the structure of mixed CH4sub>/CO2 gas hydrate.

  20. Magnetic structures of the {alpha}-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3-} {sub x} (AsO{sub 4}) {sub x} (x=1, 1.5, 2, 3) solid solution

    SciTech Connect

    Goni, Aintzane; Wattiaux, Alain; Olazcuaga, Roger; Isabel Arriortua, Maria . E-mail: teo.rojo@ehu.es

    2006-01-15

    Moessbauer spectroscopy and neutron diffraction studies have been carried out for the {alpha}-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3-} {sub x} (AsO{sub 4}) {sub x} (x=1, 1.5, 2, 3) solid solution, potential candidate for the cathode material of the lithium secondary batteries. The crystal and magnetic structures of all these phases are based on the structural and magnetic model corresponding to the {alpha}-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3} phosphate parent, but with some differences promoted by the arsenate substitution. The PO{sub 4} and AsO{sub 4} groups have a random distribution in the structure. In all compounds the coupling of the magnetic moments takes place in the (001) plane, but the value of the angle between the moments and the x direction decreases from 38.3 deg. ({alpha}-Li{sub 3}Fe{sub 2}(AsO{sub 4}){sub 3}) to 4.7{sup o} ({alpha}-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 2}(AsO{sub 4}){sub 1}). This rotation arises from the change in the tilt angle between the Fe(1)O{sub 6} and Fe(2)O{sub 6} crystallographically and magnetically independent octahedra in the structures, and affects the effectiveness of the magnetic exchange pathways. The ordering temperature T{sub N} decreases with the increase of phosphate amount in the compounds. The existence of a phenomenon of canting and the evolution of the ferrimagnetic behavior in this solid solution is also discussed.

  1. ATRX immunostaining predicts IDH and H3F3A status in gliomas.

    PubMed

    Ebrahimi, Azadeh; Skardelly, Marco; Bonzheim, Irina; Ott, Ines; Mühleisen, Helmut; Eckert, Franziska; Tabatabai, Ghazaleh; Schittenhelm, Jens

    2016-01-01

    Gliomas are the most frequent intraaxial CNS neoplasms with a heterogeneous molecular background. Recent studies on diffuse gliomas have shown frequent alterations in the genes involved in chromatin remodelling pathways such as α-thalassemia/mental-retardation-syndrome-X-linked gene (ATRX). Yet, the reliability of ATRX in predicting isocitrate dehydrogenase (IDH) and H3 histone, family 3A (H3F3A) mutations in gliomas, is unclear.We analysed the ATRX expression status by immunohistochemistry, in a large series of 1064 gliomas and analysed the results in correlation to IDH, H3F3A and loss of heterozygosity (LOH) 1p/19q status in these tumors. We also investigated the prognostic potential of ATRX concerning the clinical outcome of patients with diffuse gliomas.According to our results, loss of nuclear ATRX expression was accompanied with an astrocytic tumor lineage and a younger age of onset. ATRX loss in astrocytomas was also strongly associated with IDH1/2 and H3F3A mutation (p < 0.0001). Among 196 glial tumors with nuclear ATRX loss, 173 (89 %) had an IDH1 or IDH2 mutation. Among the remaining 23 cases (11 %) with ATRX loss and IDH wild type status, 7 cases had a H3F3A G34R mutation (3 %) and 2 cases had a H3F3A K27M mutation (1 %). ATRX retention in IDH1/2 mutant tumors was strongly associated with LOH 1p/19q and oligodendroglioma histology (p < 0.0001). We also confirmed the significant prognostic role of ATRX. Diffuse gliomas with ATRX loss (n = 137, median 1413 days, 95 % CI: 1065-1860 days) revealed a significantly better clinical outcome compared with tumors with ATRX retention (n = 335, median: 609, 95 % CI: 539-760 days, HR = 1.81, p < 0.0001).In conclusion, ATRX is a potential marker for prediction of IDH/H3F3A mutations and substratification of diffuse gliomas into survival relevant tumor groups. Such classification is of great importance for further clinical decision making especially concerning the therapeutic options

  2. Synthesis and crystal structures of new oxyapatites BiCa{sub 4-x}La{sub x}(VO{sub 4}){sub 3-x}(GeO{sub 4}){sub x}O, x=1-3

    SciTech Connect

    Zhuravlev, V.D.; Tyutyunnik, A.P.; Zubkov, V.G.; Perelyaeva, L.A.; Baklanova, I.V.; Blinova, A.L.

    2012-10-15

    New germanate-vanadates with the general formula BiCa{sub 4-x}La{sub x}(VO{sub 4}){sub 3-x}(GeO{sub 4}){sub x}O, x=1-3, have been synthesized by the nitrate-citrate method and characterized. Structural refinement based on X-ray powder diffraction data showed that these compounds are isostructural with BiCa{sub 4}(VO{sub 4}){sub 3}O (space group P6{sub 3}/m (N 176), Z=2, a=9.8327-9.8755(3), and c=7.1203-7.2133(2) ). They may be viewed as continuous series of solid solutions where Ca{sup 2+} and V{sup 5+} cations in the crystal lattice of vanadate BiCa{sub 4}(VO{sub 4}){sub 3}O are replaced by La{sup 3+} and Ge{sup 4+} cations. In the process of substitution, the La{sup 3+} cations occupy mainly the 4f lattice sites of the germanate-vanadate oxyapatites, but the filling of the 4f and 6h lattice sites in the germanate BiCaLa{sub 3}(GeO{sub 4}){sub 3} is equivalent. IR and Raman spectra were studied. The Raman spectra clearly show a two-mode behavior: the lines of GeO{sub 4} and VO{sub 4} are separated from each other, and the (V/Ge)O{sub 4} tetrahedra exhibit a quasi-independent behavior. - Graphical abstract: Schematic drawing of the BiCa{sub 3}La(VO{sub 4}){sub 2}(GeO{sub 4})O structure in projection on the ac plane. Green-V and Ge, red-Ca(1) and La(1), yellow-Ca(2), La(2) and Bi, dark-blue-O(1)-O(4), blue-O(5). Highlights: Black-Right-Pointing-Pointer The citrate synthesis of germanate-vanadate oxyapatites. Black-Right-Pointing-Pointer The synthesized compounds crystallize in the hexagonal symmetry. Black-Right-Pointing-Pointer A single series of solid solutions BiCa{sub 4-x}La{sub x}(VO{sub 4}){sub 3-x}(GeO{sub 4}){sub x}O, (x=0-3). Black-Right-Pointing-Pointer IR an Raman spectra of mixed crystals.

  3. Biodiesel production using lipase immobilized on epoxychloropropane-modified Fe3O4 sub-microspheres.

    PubMed

    Zhang, Qian; Zheng, Zhong; Liu, Changxia; Liu, Chunqiao; Tan, Tianwei

    2016-04-01

    Superparamagnetic Fe3O4 sub-microspheres with diameters of approximately 200 nm were prepared via a solvothermal method, and then modified with epoxychloropropane. Lipase was immobilized on the modified sub-microspheres. The immobilized lipase was used in the production of biodiesel fatty acid methyl esters (FAMEs) from acidified waste cooking oil (AWCO). The effects of the reaction conditions on the biodiesel yield were investigated using a combination of response surface methodology and three-level/three-factor Box-Behnken design (BBD). The optimum synthetic conditions, which were identified using Ridge max analysis, were as follows: immobilized lipase:AWCO mass ratio 0.02:1, fatty acid:methanol molar ratio 1:1.10, hexane:AWCO ratio 1.33:1 (mL/g), and temperature 40 °C. A 97.11% yield was obtained under these conditions. The BBD and experimental data showed that the immobilized lipase could generate biodiesel over a wide temperature range, from 0 to 40 °C. Consistently high FAME yields, in excess of 80%, were obtained when the immobilized lipase was reused in six replicate trials at 10 and 20 °C. PMID:26803008

  4. Mechanisms for pressure-induced crystal-crystal transition, amorphization, and devitrification of Snl4sub>

    SciTech Connect

    Liu, Hanyu; Tse, John S.; Hu, Michael Y.; Bi, Wenli; Zhao, Jiyong; Alp, E. Ercan; Pasternak, Moshe; Taylor, R. Dean; Lashley, Jason C.

    2015-10-27

    The pressure-induced amorphization and subsequent recrystallization of SnI4sub> have been investigated using first principles molecular dynamics calculations together with high-pressure 119Sn nuclear resonant inelastic x-ray scattering measurements. Above ~8 GPa, we observe a transformation from an ambient crystalline phase to an intermediate crystal structure and a subsequent recrystallization into a cubic phase at ~64 GPa. The crystalline-to-amorphous transition was identified on the basis of elastic compatibility criteria. The measured tin vibrational density of states shows large amplitude librations of SnI4sub> under ambient conditions. Although high pressure structures of SnI4sub> were thought to be determined by random packing of equal-sized spheres, we detected electron charge transfer in each phase. As a result, this charge transfer results in a crystal structure packing determined by larger than expected iodine atoms. (C) 2015 AIP Publishing LLC.

  5. Spin Hall magnetoresistance in CoFe2O4sub>/Pt films

    SciTech Connect

    Wu, Hao; Qintong, Zhang; Caihua, Wan; Ali, Syed Shahbaz; Yuan, Zhonghui; You, Lu; Wang, Junling; Choi, Yongseong; Han, Xiufeng

    2015-05-13

    Pulse laser deposition and magnetron sputtering techniques have been employed to prepare MgO(001)//CoFe2O4sub>/Pt samples. Cross section transmission electron microscope results prove that the CoFe2O4sub> film epitaxially grew along (001) direction. X-ray magnetic circular dichroism results show that magnetic proximity effect in this sample is negligible. Magnetoresistance (MR) properties confirm that spin Hall MR (SMR) dominates in this system. Spin Hall effect-induced anomalous Hall voltage was also observed in this sample. Lastly, these results not only demonstrate the universality of SMR effect but also demonstrate the utility in spintronics of CoFe2O4sub> as a new type of magnetic insulator.

  6. Lack of carcinogenicity of tragacanth gum in B6C3F1 mice.

    PubMed

    Hagiwara, A; Boonyaphiphat, P; Kawabe, M; Naito, H; Shirai, T; Ito, N

    1992-08-01

    Tragacanth gum was administered at dietary levels of 0 (control), 1.25 and 5.0% to groups of 50 male and 50 female B6C3F1 mice for 96 wk after which all animals were maintained on a basal diet without tragacanth gum for a further 10 wk. Mean body weights of females in the 5.0% and 1.25% groups were lower than those of the controls after 11 and 16 wk, respectively. However, there were no treatment-related clinical signs or adverse effects on survival rate, urinalysis, haematology, blood biochemistry and organ weight. While detailed histopathology revealed the development of squamous cell hyperplasias, papillomas and one carcinoma in the forestomach, there was no significant treatment-related increase in the incidence of any preneoplastic or neoplastic lesion. Thus, under the experimental conditions used, tragacanth gum was not carcinogenic in B6C3F1 mice of either sex.

  7. Homogeneous and Heterogeneous Reaction Mechanisms in CH3F-O2 Inductively Coupled Plasmas

    NASA Astrophysics Data System (ADS)

    Donnelly, Vincent M.; Karakas, Erdinc; Kaler, Sanbir; Lou, Qiaowei; Economou, Demetre J.

    2013-09-01

    CH3F/O2 containing plasmas are used in selective Si3N4 etching over Si or SiO2. Fundamental plasma studies in these gas mixtures are scarce. In this work, optical emission rare gas actinometry and a global chemistry model were employed to study inductively couple plasmas in CH3F/O2 gas mixtures. For constant CH3F and O2 flow rates, the absolute H, F and O atom densities increased linearly with power. The feedstock gas was highly dissociated and most of the fluorine and oxygen was contained in reaction products HF, CO, CO2, H2O and OH. Measured number densities as a function of O2 addition to CH3F/O2 changed abruptly for H, O, and particularly F atoms (factor of 4) at 48% O2 A corresponding transition was also observed in electron density, electron temperature and gas temperature, as well as in C, CF and CH optical emission. These abrupt transitions were attributed to the reactor wall reactivity, changing from a polymer-coated surface to a polymer-free surface, and vice-versa, as the O2 content in the feed gas crossed 48%. Homogeneous chemistry dominates above 48% O2; a kinetic model with no adjustable parameters is in excellent agreement with the absolute F and H and relative HF number density dependence on power and pressure. CH3F/O2 containing plasmas are used in selective Si3N4 etching over Si or SiO2. Fundamental plasma studies in these gas mixtures are scarce. In this work, optical emission rare gas actinometry and a global chemistry model were employed to study inductively couple plasmas in CH3F/O2 gas mixtures. For constant CH3F and O2 flow rates, the absolute H, F and O atom densities increased linearly with power. The feedstock gas was highly dissociated and most of the fluorine and oxygen was contained in reaction products HF, CO, CO2, H2O and OH. Measured number densities as a function of O2 addition to CH3F/O2 changed abruptly for H, O, and particularly F atoms (factor of 4) at 48% O2 A corresponding transition was also observed in electron density

  8. Dark Matter Search Results from the PICO-2L C3F8 Bubble Chamber

    SciTech Connect

    Amole, C.; Ardid, M.; Asner, David M.; Baxter, D.; Behnke, E.; Bhattacharjee, P. S.; Borsodi, H.; Bou-Cabo, M.; Brice, S. J.; Broemmelsiek, D.; Clark, K.; Collar, J. I.; Cooper, P. S.; Crisler, M.; Dahl, C. E.; Daley, S.; Das, Madhusmita; Debris, F.; Dhungana, N.; Farine, J.; Felis, I.; Filgas, R.; Fines-Neuschild, M.; Girard, Francoise; Giroux, G.; Hai, M.; Hall, Jeter C.; Harris, O.; Jackson, C. M.; Jin, M.; Krauss, C. B.; Lafreniere, M.; Laurin, M.; Lawson, I.; Levine, I.; Lippincott, W. H.; Mann, E.; Martin, J. P.; Maurya, D.; Mitra, Pitam; Neilson, R.; Noble, A. J.; Plante, A.; Podviianiuk, R. B.; Priya, S.; Robinson, A. E.; Ruschman, M.; Scallon, O.; Seth, S.; Sonnenschein, Andrew; Starinski, N.; Stekl, I.; Vazquez-Jauregui, E.; Wells, J.; Wichoski, U.; Zacek, V.; Zhang, J.

    2015-06-12

    New data are reported from the operation of a 2-liter C3F8 bubble chamber in the 2100 meter deep SNOLAB underground laboratory, with a total exposure of 211.5 kg-days at four different recoil energy thresholds ranging from 3.2 keV to 8.1 keV. These data show that C3F8 provides excellent electron recoil and alpha rejection capabilities at very low thresholds, including the rst observation of a dependence of acoustic signal on alpha energy. Twelve single nuclear recoil event candidates were observed during the run. The candidate events exhibit timing characteristics that are not consistent with the hypothesis of a uniform time distribution, and no evidence for a dark matter signal is claimed. These data provide the most sensitive direct detection constraints on WIMP-proton spin-dependent scattering to date, with signicant sensitivity at low WIMP masses for spin-independent WIMP-nucleon scattering.

  9. Coupled Lorenz systems in an optically pumped CH3F laser

    NASA Technical Reports Server (NTRS)

    Rabinovich, W. S.; Lawandy, N. M.

    1987-01-01

    The output emission of a short CH3F metallic waveguide laser pumped by an injection-locked CO2 transversely excited atmosphere laser is studied experimentally. The output is found to be extremely unpredictable when lasing occurs in both the excited and ground vibrational states on two separate transitions (496 and 452 microns, respectively). The dynamics and sensitivity to initial conditions are explained in terms of two Lorenz lasers with pump coupled population inversions.

  10. Luminescence spectroscopy of K3WO3F3 oxyfluoride crystals

    NASA Astrophysics Data System (ADS)

    Kozlov, A. V.; Pustovarov, V. A.

    2016-09-01

    Spectra of photoluminescence (PL) in region of 1.5-5.5 eV, PL excitation spectra (3-22 eV), PL decay kinetics, the temperature dependence of the PL were measured for single crystals and ceramics K3WO3F3 as well as irradiate ceramics K3WO3F3. Synchrotron radiation was used for low temperature PL experiments with time resolution. Single crystals are transparent in microwave, visible and near UV range, inter-band transition energy is Eg = 4.3 eV. The intrinsic luminescence of tungstates is usually ascribed to the radiative relaxation of exciton-like excitations localized on WO6 octahedra or WO4 tetrahedra. In K3WO3F3 the wide band luminescence in the region of 2.5 eV with the Stokes shift of 1.5 eV with the microsecond decay kinetics is connected with luminescence of triplet self-trapped excitons (STE). This luminescence is formed by electronic transitions in [WO3F3] octahedron. Different distortion of KWOF crystal lattice is manifested in the change of the Stokes shift of STE luminescence band. The 3.2 eV emission band in low-temperature PL spectrum with decay times of 1.8 ns and 11 ns corresponds to singlet STE luminescence. A new 2.9 eV emission band is discovered in low-temperature PL spectrum in the samples irradiated by fast electrons (E = 10 MeV, D = 160 kGy). This emission band is excited not intracenter mechanism, and through the creation of excitons bound on the defects. It is suggested that it is F-like centers of anionic sublattice induced by the mechanism of elastic collision.

  11. Collisional narrowing in the optically pumped CH3OH and CH3F lasers

    NASA Technical Reports Server (NTRS)

    Lawandy, N. M.; Koepf, G. A.

    1982-01-01

    The gain linewidth of the optically pumped CH3F laser is observed to narrow and rebroaden with the addition of He. In addition, the same effect is observed in the CH3OH laser with the addition of the polyatomic buffer gases SF6 and CS2. These results offer conclusive evidence of the Dicke narrowing phenomena in these inverted pure rotational transitions. The effect is observed using a high harmonic mixing technique in a Schottky barrier diode.

  12. A high performance hybrid battery based on aluminum anode and LiFePO4sub> cathode

    SciTech Connect

    Sun, Xiao-Guang; Bi, Zhonghe; Liu, Hansan; Bridges, Craig A.; Paranthaman, Mariappan Parans; Dai, Sheng; Brown, Gilbert M.

    2015-12-07

    A unique battery hybrid utilizes an aluminum anode, a LiFePO4sub> cathode and an acidic ionic liquid electrolyte based on 1-ethyl-3-methylimidazolium chloride (EMImCl) and aluminum trichloride (AlCl 3) (EMImCl-AlCl 3, 1-1.1 in molar ratio) with or without LiAlCl4sub> is proposed. This hybrid ion battery delivers an initial high capacity of 160 mAh g-1 at a current rate of C/5. It also shows good rate capability and cycling performance.

  13. The factor XIIa blocking antibody 3F7: a safe anticoagulant with anti-inflammatory activities

    PubMed Central

    Worm, Marie; Köhler, Elodie C.; Panda, Rachita; Long, Andy; Butler, Lynn M.; Stavrou, Evi X.; Nickel, Katrin F.; Fuchs, Tobias A.

    2015-01-01

    The plasma protein factor XII (FXII) is the initiating protease of the procoagulant and proinflammatory contact system. FXII activates both the bradykinin (BK) producing kallikrein-kinin system and the intrinsic pathway of coagulation. Contact with negatively charged surfaces induces auto-activation of zymogen FXII that results in activated FXII (FXIIa). Various in vivo activators of FXII have been identified including heparin, misfolded protein aggregates, nucleic acids and polyphosphate. Murine models have established a central role of FXII in arterial and venous thromboembolic diseases. Despite the central function of FXII in pathologic thrombosis, its deficiency does not impair hemostasis in animals or humans. The selective role of FXIIa in thrombosis, but not hemostasis, offers an exciting novel strategy for safe anticoagulation based on interference with FXIIa. We have generated the recombinant fully human FXIIa-blocking antibody 3F7, which abolished FXIIa enzymatic activity and prevented thrombosis in a cardiopulmonary bypass system in large animals, in the absence of increased therapy-associated bleeding. Furthermore, 3F7 also interfered with BK-driven edema in the severe swelling disorder hereditary angioedema (HAE) type III. Taken together, targeting FXIIa with 3F7 appears to be a promising approach to treat edema disorders and thrombosis. PMID:26605293

  14. Growth, structure and optical properties of nonlinear optical crystal BaZnBO3F

    NASA Astrophysics Data System (ADS)

    Xia, Mingjun; Li, R. K.

    2016-01-01

    Nonlinear optical (NLO) crystal BaZnBO3F (BZBF) with the size of about 20×20×0.5 mm3 is obtained from BaF2-NaF flux, and single crystal X-ray diffraction reveals that it belongs to space group P 6 ̅ with cell parameters of a=5.1045(6) Å, c=4.3116(10) Å and Z=1. In the structure of BZBF, the BO3 planar triangles are interconnected through O atoms from ZnO3F2 trigonal bipyramid to form (Zn3B3O6F6) twelve-membered rings (12-MRs), then the layers which are built with condensation from 12-MRs at ab plane, are further linked by the apical F from ZnO3F2 to form three dimensional framework along the c direction. The title crystal exhibits high transmittance in the range of 300-3000 nm with a UV transmission cutoff at 223 nm according to transmission spectra. Powder SHG tests indicate that the effective NLO coefficient of BZBF crystal is about 2.8 times that of KH2PO4 (KDP) crystal due to perfect alignment of the BO3 groups.

  15. Dark matter limits from a 2L C3F8 filled bubble chamber

    NASA Astrophysics Data System (ADS)

    Robinson, Alan Edward

    The PICO-2L C3F8 bubble chamber search for Weakly Interacting Massive Particle (WIMP) dark matter was operated in the SNOLAB underground laboratory at the same location as the previous CF3I filled COUPP-4kg detector. Neutron calibrations using photoneutron sources in C3F8 and CF3I filled calibration bubble chambers were performed to verify the sensitivity of these target fluids to dark matter scattering. This data was combined with similar measurements using a low-energy neutron beam at the University of Montreal and in situ calibrations of the PICO-2L and COUPP-4kg detectors. C3F 8 provides much greater sensitivity to WIMP-proton scattering than CF 3I in bubble chamber detectors. PICO-2L searched for dark matter recoils with energy thresholds below 10 keV. Radiopurity assays of detector materials were performed and the expected neutron recoil background was evaluated to be 1.6 +0.3-0.9 single bubble events during the 211.5 kg-day exposure. Twelve single bubble dark matter candidate events were observed. These events were not uniformly distributed in time, and were likely caused by particulates in the active volume. Despite this background, PICO-2L sets a world-leading upper limit to the WIMP-proton spin dependent scattering cross-section.

  16. The Seasonal and Interannual Variability of the Budgets of N2O and CCl3F

    NASA Technical Reports Server (NTRS)

    Wong, Sun; Prather, Michael J.; Rind, David H.

    1999-01-01

    The 6-year wind archives from the Goddard Institute for Space Studies/Global Climate-Middle Atmosphere Model (GISS/GCMAM) were in- put to the GISS/Harvard/Irvine Chemical Transport Model (G/H/I CTM) to study the seasonal and interannual variability of the budgets and distributions of nitrous oxide (N2O) and trichlorofluoromethane (CCl3F), with the corresponding chemical loss frequencies recycled and boundary conditions kept unchanged from year to year. The effects of ozone feedback and quasi-biennial oscillation (QBO) were not included. However, the role of circulation variation in driving the lifetime variability is investigated. It was found that the global loss rates of these tracers are related to the extratropical planetary wave activity, which drives the tropical upward mass flux. For N2O, a semiannual signal in the loss rate variation is associated with the interhemispheric asymmetry in the upper stratospheric wave activity. For CCl3F, the semiannual signal is weaker, associated with the comparatively uniform wave episodes in the lower stratosphere. The loss rates lag behind the wave activity by about 1-2 months. The interannual variation of the GCM generated winds drives the interannual variation of the annually averaged lifetime. The year-to-year variations of the annually averaged lifetimes can be about 3% for N2O and 4% for CCl3F.

  17. Dark Matter Limits From a 2L C3F8 Filled Bubble Chamber

    SciTech Connect

    Robinson, Alan Edward

    2015-12-01

    The PICO-2L C3F8 bubble chamber search forWeakly Interacting Massive Particle (WIMP) dark matter was operated in the SNOLAB underground laboratory at the same location as the previous CF3I lled COUPP-4kg detector. Neutron calibrations using photoneutron sources in C3F8 and CF3I lled calibration bubble chambers were performed to verify the sensitivity of these target uids to dark matter scattering. This data was combined with similar measurements using a low-energy neutron beam at the University of Montreal and in situ calibrations of the PICO-2L and COUPP-4kg detectors. C3F8 provides much greater sensitivity to WIMP-proton scattering than CF3I in bubble chamber detectors. PICO-2L searched for dark matter recoils with energy thresholds below 10 keV. Radiopurity assays of detector materials were performed and the expected neutron recoil background was evaluated to be 1.6+0:3

  18. Structural and conductivity studies of CsK(SO{sub 4}){sub 0.32}(SeO{sub 4}){sub 0.68}Te(OH){sub 6}

    SciTech Connect

    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.

  19. A new three-dimensional cobalt phosphate: Co{sub 5}(OH{sub 2}){sub 4}(HPO{sub 4}){sub 2}(PO{sub 4}){sub 2}

    SciTech Connect

    Han Zhangang . E-mail: hanzg116@yahoo.com.cn; Tian Aixiang; Peng Jun . E-mail: jpeng@nenu.edu.cn; Zhai Xueliang

    2006-10-15

    A three-dimensional (3D) cobalt phosphate: Co{sub 5}(OH{sub 2})PO{sub 4}){sub 2}(PO{sub 4}){sub 2} (1), has been synthesized by hydrothermal reaction and characterized by single-crystal X-ray diffraction, thermogravimetric analysis, and magnetic techniques. The title compound is a template free cobalt phosphate. Compound 1 exhibits a complex net architecture based on edge- and corner-sharing of CoO{sub 6} and PO{sub 4} polyhedra. The magnetic susceptibility measurements indicated that the title compound obeys Curie-Weiss behavior down to a temperature of 17 K at which an antiferromagnetic phase transition occurs. - Graphical abstract: A 3D cobalt phosphate with a neutral framework: Co{sub 5}(OH{sub 2}){sub 4}(HPO{sub 4}){sub 2}(PO{sub 4}){sub 2} (1), has been synthesized and characterized. Compound 1 exhibits a complex net architecture based on edge- and corner-sharing of CoO{sub 6} and PO{sub 4} polyhedra. Its magnetic property was researched.

  20. The axon guidance molecule semaphorin 3F is a negative regulator of tumor progression and proliferation in ileal neuroendocrine tumors.

    PubMed

    Bollard, Julien; Massoma, Patrick; Vercherat, Cécile; Blanc, Martine; Lepinasse, Florian; Gadot, Nicolas; Couderc, Christophe; Poncet, Gilles; Walter, Thomas; Joly, Marie-Odile; Hervieu, Valérie; Scoazec, Jean-Yves; Roche, Colette

    2015-11-01

    Gastro-intestinal neuroendocrine tumors (GI-NETs) are rare neoplasms, frequently metastatic, raising difficult clinical and therapeutic challenges due to a poor knowledge of their biology. As neuroendocrine cells express both epithelial and neural cell markers, we studied the possible involvement in GI-NETs of axon guidance molecules, which have been shown to decrease tumor cell proliferation and metastatic dissemination in several tumor types. We focused on the role of Semaphorin 3F (SEMA3F) in ileal NETs, one of the most frequent subtypes of GI-NETs.SEMA3F expression was detected in normal neuroendocrine cells but was lost in most of human primary tumors and all their metastases. SEMA3F loss of expression was associated with promoter gene methylation. After increasing endogenous SEMA3F levels through stable transfection, enteroendocrine cell lines STC-1 and GluTag showed a reduced proliferation rate in vitro. In two different xenograft mouse models, SEMA3F-overexpressing cells exhibited a reduced ability to form tumors and a hampered liver dissemination potential in vivo. This resulted, at least in part, from the inhibition of mTOR and MAPK signaling pathways.This study demonstrates an anti-tumoral role of SEMA3F in ileal NETs. We thus suggest that SEMA3F and/or its cellular signaling pathway could represent a target for ileal NET therapy.

  1. Regulation of mTOR Signaling by Semaphorin 3F-Neuropilin 2 Interactions In Vitro and In Vivo

    PubMed Central

    Nakayama, Hironao; Bruneau, Sarah; Kochupurakkal, Nora; Coma, Silvia; Briscoe, David M.; Klagsbrun, Michael

    2015-01-01

    Semaphorin 3F (SEMA3F) provides neuronal guidance cues via its ability to bind neuropilin 2 (NRP2) and Plexin A family molecules. Recent studies indicate that SEMA3F has biological effects in other cell types, however its mechanism(s) of function is poorly understood. Here, we analyze SEMA3F-NRP2 signaling responses in human endothelial, T cell and tumor cells using phosphokinase arrays, immunoprecipitation and Western blot analyses. Consistently, SEMA3F inhibits PI-3K and Akt activity, and responses are associated with the disruption of mTOR/rictor assembly and mTOR-dependent activation of the RhoA GTPase. We also find that the expression of vascular endothelial growth factor, as well as mTOR-inducible cellular activation responses and cytoskeleton stability are inhibited by SEMA3F-NRP2 interactions in vitro. In vivo, local and systemic overproduction of SEMA3F reduces tumor growth in NRP2-expressing xenografts. Taken together, SEMA3F regulates mTOR signaling in diverse human cell types, suggesting that it has broad therapeutic implications. PMID:26156437

  2. Knockdown of linc-POU3F3 suppresses the proliferation, apoptosis, and migration resistance of colorectal cancer

    PubMed Central

    Shan, Ti-Dong; Xu, Ji-Hao; Yu, Tao; Li, Jie-Yao; Zhao, Lin-Na; Ouyang, Hui; Luo, Su; Lu, Xi-Ji; Huang, Can-Ze; Lan, Qiu-Shen; Zhong, Wa; Chen, Qi-Kui

    2016-01-01

    Long intergenic noncoding RNAs (lincRNAs) play important roles in regulating the biological functions and underlying molecular mechanisms of colorectal cancer (CRC). Here, we investigated the association of linc-POU3F3 and prognosis in CRC. We demonstrated that linc-POU3F3 was overexpressed in CRC tissues and positively correlated with tumor grade and N stage. Inhibition of linc-POU3F3 resulted in inhibition of cell proliferation and G1 cell cycle arrest, which was mediated by cyclin D1, CDK4, p18, Rb, and phosphorylated Rb. Inhibition of linc-POU3F3 induced apoptosis, and suppressed migration and invasion in LOVO and SW480 cell lines. This inhibition also increased the expressions of epithelial markers and decreased the expressions of mesenchymal markers, thus inhibiting the cancer epithelial-mesenchymal transition. The decreased migration and invasion following linc-POU3F3 knockdown were mediated by an increased BMP signal. Furthermore, autophagy was enhanced by linc-POU3F3 knockdown, suggesting the involvement of autophagy in the induced apoptosis. Collectively, linc-POU3F3 might be crucial in pro-proliferation, anti-apoptosis, and metastasis in LOVO and SW480 cells by regulating the cell cycle, intrinsic apoptosis, BMP signaling and autophagy. Thus, linc-POU3F3 is a potential therapeutic target and novel molecular biomarker for CRC. PMID:26510906

  3. A facile solvothermal synthesis of octahedral Fe3O4sub> nanoparticles

    SciTech Connect

    DuChene, Joseph S.; Qiu, Jingjing; Graham, Jeremy O.; Engelhard, Mark H.; Cao, Guixin; Gai, Zheng; Wei, Wei David; Ooi, Frances

    2015-01-26

    Anisotropic Fe3O4sub> octahedrons are obtained via a simple solvothermal synthesis with appropriate sizes for various technological applications. Here, a complete suite of materials characterization methods confirms the magnetite phase for these structures, which exhibit substantial saturation magnetization and intriguing morphologies for a wide range of applications.

  4. Anisotropic magnetic behaviors of monoclinic Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3}

    SciTech Connect

    He, Zhangzhen; Guo, Wenbin; Cheng, Wendan; Itoh, Mitsuru

    2014-07-01

    Large sized α-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3} single crystals with high quality are successfully grown by a flux method. Magnetic behaviors of the grown crystals are investigated by means of magnetic susceptibility, magnetization, and heat capacity measurements along different directions. The results confirm that α-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3} exhibits weak ferrimagnetic behaviors at low temperature, which are in good agreement with those reported previously. However magnetic anisotropy is confirmed for the first time, suggesting that the c-axis is the likely magnetic easy axis and the a-axis is the magnetic hard one. Two anomalies are clearly observed in magnetic susceptibility along the a-axis and heat capacity data at zero field, suggesting the appearance of two successive magnetic transitions at ∼26 and ∼22 K in the system. - Graphical abstract: Magnetic anisotropy is confirmed for the first time using a single crystal sample of α-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3} obtained by the flux method. - Highlights: • Large-sized single crystals of α-Li{sub 3}Fe{sub 2}(PO{sub 4}){sub 3} are grown by the flux method. • Magnetic anisotropy is confirmed for the first time in the system. • Two successive magnetic transitions are observed along the a-axis.

  5. New mixed-valence chromium structure type: NH{sub 4}Cr(CrO{sub 4}){sub 2}

    SciTech Connect

    Casari, Barbara M. . E-mail: casari@chem.gu.se; Wingstrand, Erica; Langer, Vratislav

    2006-01-15

    Synthesis and crystal structure of a new structure type of mixed Cr(III)/Cr(VI) chromates is reported. NH{sub 4}Cr(CrO{sub 4}){sub 2} was prepared from CrO{sub 3} in the presence of (NH{sub 4}){sub 2}Ce(NO{sub 3}){sub 6}. Since this is the first preparation of mixed valence ternary chromium oxides from aqueous solution, a reaction pathway for this synthesis is suggested. The crystal structure of NH{sub 4}Cr(CrO{sub 4}){sub 2} has been determined from three-dimensional X-ray data collected at low temperature, 173K. The structure belongs to the orthorhombic space group Pnma, with a=14.5206(10), b=5.4826(4), c=8.7041(7)A and Z=4. The title compound consists of corner-sharing chromium(III) octahedra and chromium(VI) tetrahedra forming a three-dimensional network with the composition [Cr(CrO{sub 4}){sub 2}]{sub n}{sup n-}, containing channels in which zigzag rows of ammonium ions balance the net charge.

  6. Determination of CCl 3F and CCl 2F 2 in seawater and air

    NASA Astrophysics Data System (ADS)

    Bullister, J. L.; Weiss, R. F.

    1988-05-01

    An improved analytical technique has been developed for the rapid and accurate shipboard measurement of two anthropogenically produced chlorofluorocarbons (CFCs), CCl 3F (F-11) and CCl 2F 2 (F-12) in air and seawater. Gas samples (dry air or standard) are injected into a stream of purified gas and then concentrated in a low temperature trap. Seawater samples collected in oceanographic Niskin bottles are transferred into glass syringes for storage until analysis. An aliquot of approximately 30 cm 3 of seawater is introduced into a glass stripping chamber where the dissolved gases are purged with purified gas, and the evolved CFCs are concentrated in the same cold trap. The trap is subsequently isolated and heated, and the CFCs are automatically transferred by a stream of carrier gas into a precolumn and then a chromatographic separating column. The CCl 3F and CCl 2F 2 peaks are detected by an electron capture detector (ECD) and their areas are integrated digitally. CFC amounts are calculated using fitted calibration curves, generated by injection of various multiple aliquots of gas standard containing known concentrations of CFCs. Preliminary concentration values for these compounds are printed at the completion of each analysis. Total analysis time for air and water samples is < 10 min, allowing detailed vertical profiles of the concentrations of these compounds in the water column and concentrations in the overlying atmosphere to be determined within a few hours of the completion of a hydrographic station. Typical relative standard deviations for analyses of CCl 3F and CCl 2F 2 in near-surface seawater containing equilibrium levels of these compounds are approximately 1%. Limits of detection for both compounds in 30 cm 3 seawater samples are about 0.005 × 10 -12 mol kg -1.

  7. Thermodynamic Model for BiPO 4sub>(cr) and Bi(OH)3(am) Solubility in the Aqueous Na+–H+–H2PO- 4sub> –HPO 2- 4sub> –PO 3- 4 sub>–OH- –Cl- –H2O System

    SciTech Connect

    Rai, Dhanpat; Yui, Mikazu; Schaef, Herbert T; Kitamura, Akira

    2010-07-10

    Prior to this study no data for the solubility product of BiPO 4sub>(cr) or the complexation constants of Bi with phosphate were available. The solubility of BiPO 4sub>(cr) was studied at 23 ± 2 °C from both the over- and under-saturation directions as functions of a wide range in time (6–309 days), pH values (0–15), and phosphate concentrations (reaching as high as 1.0 mol·kg-1). HCl or NaOH were used to obtain a range in pH values. Steady state concentrations and equilibrium were reached in <6 days. The data were interpreted using the SIT model. These extensive data provided a solubility product value for BiPO 4sub>(cr) and an upper limit value for the formation of BiPO 4sub>(aq). Because the aqueous system in this study involved relatively high concentrations of chloride, reliable values for the complexation constants of Bi with chloride were required to accurately interpret the solubility data. Therefore as a part of this investigation, existing Bi–Cl data were critically reviewed and used to obtain values of equilibrium constants for various Bi–Cl complexes at zero ionic strength along with the values for various SIT ion interaction parameters. Predictions based on these thermodynamic quantities agreed closely with our experimental data, the chloride concentrations of which ranged as high as 0.7 mol·kg-1. The study showed that BiPO 4sub>(cr) is stable at pH values <9.0. At pH values >9.0, Bi(OH)3(am) is the solubility controlling phase. Reliable values for the Bi(OH)3(am) solubility reactions involving Bi(OH)3(aq) and Bi(OH) - 4sub> and the formation constants of these aqueous species are also reported.

  8. Synthesis and photoluminescence of Tb{sup 3+} Activated NaY(WO{sub 4}){sub 2} phosphors

    SciTech Connect

    Liu, Xiaohua; Xiang, Wendou; Chen, Fengming; Zhang, Wei; Hu, Zhengfa

    2012-11-15

    Graphical abstract: The phosphor powders of NaY(WO{sub 4}){sub 2}:Tb{sup 3+} were prepared by solid state reaction. The dependence of luminescence intensity on the Tb{sup 3+} concentration was investigated. Highlights: ► We synthesize NaY(WO{sub 4}){sub 2}:Tb{sup 3+} phosphors by the solid-state reaction technique. ► We observe and explain the blue shifting of excitation peak positions of CTBs. ► The PL from {sup 5}D{sub 3} level become less probable with increasing the Tb{sup 3+} content. ► The PL intensity increases with Tb{sup 3+} content without concentration quenching. ► NaY(WO{sub 4}){sub 2}:Tb{sup 3+} has potential application as a green emitting phosphor in lamps. -- Abstract: The novel yellowish green phosphor powders of NaY(WO{sub 4}){sub 2} doped with Tb{sup 3+} were prepared by solid-state reaction. The powder samples were characterized by X-ray diffraction and photoluminescence. X-ray diffraction analysis showed that the phosphors sintered at 900 °C for 6 h were a pure NaY(WO{sub 4}){sub 2} phase for all the Tb{sup 3+} doping concentrations. The room temperature excitation spectra vary with the Tb{sup 3+} concentration and consist of an intense charge transfer band of WO{sub 4}{sup 2−} group and weak intra-4f{sup 8} transition absorption peaks of Tb{sup 3+} ions. The photoluminescence spectra, excited at the peak wavelengths of charge transfer bands, consist of the characteristic Tb{sup 3+} emission transitions from {sup 5}D{sub 3} and {sup 5}D{sub 4} excited levels to {sup 7}F{sub J} (J = 3–6) levels. The dependence of luminescence intensity on the Tb{sup 3+} concentration in NaY(WO{sub 4}){sub 2}:Tb phosphors was investigated.

  9. Dark Matter Search Results from the PICO-2L C3F8 Bubble Chamber.

    PubMed

    Amole, C; Ardid, M; Asner, D M; Baxter, D; Behnke, E; Bhattacharjee, P; Borsodi, H; Bou-Cabo, M; Brice, S J; Broemmelsiek, D; Clark, K; Collar, J I; Cooper, P S; Crisler, M; Dahl, C E; Daley, S; Das, M; Debris, F; Dhungana, N; Farine, J; Felis, I; Filgas, R; Fines-Neuschild, M; Girard, F; Giroux, G; Hai, M; Hall, J; Harris, O; Jackson, C M; Jin, M; Krauss, C B; Lafrenière, M; Laurin, M; Lawson, I; Levine, I; Lippincott, W H; Mann, E; Martin, J P; Maurya, D; Mitra, P; Neilson, R; Noble, A J; Plante, A; Podviianiuk, R B; Priya, S; Robinson, A E; Ruschman, M; Scallon, O; Seth, S; Sonnenschein, A; Starinski, N; Štekl, I; Vázquez-Jáuregui, E; Wells, J; Wichoski, U; Zacek, V; Zhang, J

    2015-06-12

    New data are reported from the operation of a 2 liter C3F8 bubble chamber in the SNOLAB underground laboratory, with a total exposure of 211.5 kg days at four different energy thresholds below 10 keV. These data show that C3F8 provides excellent electron-recoil and alpha rejection capabilities at very low thresholds. The chamber exhibits an electron-recoil sensitivity of <3.5×10(-10) and an alpha rejection factor of >98.2%. These data also include the first observation of a dependence of acoustic signal on alpha energy. Twelve single nuclear recoil event candidates were observed during the run. The candidate events exhibit timing characteristics that are not consistent with the hypothesis of a uniform time distribution, and no evidence for a dark matter signal is claimed. These data provide the most sensitive direct detection constraints on WIMP-proton spin-dependent scattering to date, with significant sensitivity at low WIMP masses for spin-independent WIMP-nucleon scattering. PMID:26196790

  10. Dark Matter Search Results from the PICO-2L C3F8 Bubble Chamber.

    PubMed

    Amole, C; Ardid, M; Asner, D M; Baxter, D; Behnke, E; Bhattacharjee, P; Borsodi, H; Bou-Cabo, M; Brice, S J; Broemmelsiek, D; Clark, K; Collar, J I; Cooper, P S; Crisler, M; Dahl, C E; Daley, S; Das, M; Debris, F; Dhungana, N; Farine, J; Felis, I; Filgas, R; Fines-Neuschild, M; Girard, F; Giroux, G; Hai, M; Hall, J; Harris, O; Jackson, C M; Jin, M; Krauss, C B; Lafrenière, M; Laurin, M; Lawson, I; Levine, I; Lippincott, W H; Mann, E; Martin, J P; Maurya, D; Mitra, P; Neilson, R; Noble, A J; Plante, A; Podviianiuk, R B; Priya, S; Robinson, A E; Ruschman, M; Scallon, O; Seth, S; Sonnenschein, A; Starinski, N; Štekl, I; Vázquez-Jáuregui, E; Wells, J; Wichoski, U; Zacek, V; Zhang, J

    2015-06-12

    New data are reported from the operation of a 2 liter C3F8 bubble chamber in the SNOLAB underground laboratory, with a total exposure of 211.5 kg days at four different energy thresholds below 10 keV. These data show that C3F8 provides excellent electron-recoil and alpha rejection capabilities at very low thresholds. The chamber exhibits an electron-recoil sensitivity of <3.5×10(-10) and an alpha rejection factor of >98.2%. These data also include the first observation of a dependence of acoustic signal on alpha energy. Twelve single nuclear recoil event candidates were observed during the run. The candidate events exhibit timing characteristics that are not consistent with the hypothesis of a uniform time distribution, and no evidence for a dark matter signal is claimed. These data provide the most sensitive direct detection constraints on WIMP-proton spin-dependent scattering to date, with significant sensitivity at low WIMP masses for spin-independent WIMP-nucleon scattering.

  11. Optical and magnetic properties of Ba5(BO3)3F single crystals.

    PubMed

    Yelisseyev, A P; Jiang, Xingxing; Solntsev, V P; Bekker, T B; Lin, Zheshuai

    2014-12-01

    Ba5(BO3)3F single crystals of high optical quality and up to 1.5 cm in diameter were grown. Its transparency range is 0.23 to 6.6 μm (on 10% level). Direct allowed electronic transitions at the Γ-point give band gap values of 5.31 and 5.40 eV at 300 and 80 K, respectively. Luminescence is excited in the near-edge absorption bands near 265 and 365 nm. X-ray irradiation induces an additional absorption in dominant 252, 317 and 710 nm bands. Combined electron spin-resonance spectroscopy and theoretical analysis allow one to associate the three absorption peaks with O(5-), O(1-) and e6(-) (fluorine vacancy), respectively. The original transparency is restored after heating the crystal to 400 K and charge carrier release from traps with ET = 0.87 eV and s = 10(12) s(-1). Dispersion curves for the refractive indices were calculated and Sellmeier equations were built. Theoretical analysis shows strong localization of the Ba 5s and F 2s orbitals, strong ionicity of the Ba cations and strong covalency of the B-O bond. The optical properties of Ba5(BO3)3F are dominantly determined by electron transitions within the (BO3)(3-) groups, despite the transition between barium and oxygen also having a little contribution. PMID:25322208

  12. SU (3)F gauge family model and new symmetry breaking scale from FCNC processes

    NASA Astrophysics Data System (ADS)

    Bao, Shou-Shan; Liu, Zhuo; Wu, Yue-Liang

    2016-03-01

    Based on the SU (3)F gauge family symmetry model which was proposed to explain the observed mass and mixing pattern of neutrinos, we investigate the symmetry breaking, the mixing pattern in quark and lepton sectors, and the contribution of the new gauge bosons to some flavour changing neutral currents (FCNC) processes at low energy. With the current data of the mass differences in the neutral pseudo-scalar P0-Pbar0 systems, we find that the SU (3)F symmetry breaking scale can be as low as 300 TeV and the mass of the lightest gauge boson be about 100 TeV. Other FCNC processes, such as the lepton flavour number violation process μ- →e-e+e- and the semi-leptonic rare decay K → π ν bar ν, contain contributions via the new gauge bosons exchanging. With the constrains obtained from P0-Pbar0 system, we estimate that the contribution of the new physics is around 10-16, far below the current experimental bounds.

  13. Dark Matter Search Results from the PICO-2L C3F8 Bubble Chamber

    NASA Astrophysics Data System (ADS)

    Amole, C.; Ardid, M.; Asner, D. M.; Baxter, D.; Behnke, E.; Bhattacharjee, P.; Borsodi, H.; Bou-Cabo, M.; Brice, S. J.; Broemmelsiek, D.; Clark, K.; Collar, J. I.; Cooper, P. S.; Crisler, M.; Dahl, C. E.; Daley, S.; Das, M.; Debris, F.; Dhungana, N.; Farine, J.; Felis, I.; Filgas, R.; Fines-Neuschild, M.; Girard, F.; Giroux, G.; Hai, M.; Hall, J.; Harris, O.; Jackson, C. M.; Jin, M.; Krauss, C. B.; Lafrenière, M.; Laurin, M.; Lawson, I.; Levine, I.; Lippincott, W. H.; Mann, E.; Martin, J. P.; Maurya, D.; Mitra, P.; Neilson, R.; Noble, A. J.; Plante, A.; Podviianiuk, R. B.; Priya, S.; Robinson, A. E.; Ruschman, M.; Scallon, O.; Seth, S.; Sonnenschein, A.; Starinski, N.; Štekl, I.; Vázquez-Jáuregui, E.; Wells, J.; Wichoski, U.; Zacek, V.; Zhang, J.; PICO Collaboration

    2015-06-01

    New data are reported from the operation of a 2 liter C3F8 bubble chamber in the SNOLAB underground laboratory, with a total exposure of 211.5 kg days at four different energy thresholds below 10 keV. These data show that C3F8 provides excellent electron-recoil and alpha rejection capabilities at very low thresholds. The chamber exhibits an electron-recoil sensitivity of <3.5 ×1 0-10 and an alpha rejection factor of >98.2 %. These data also include the first observation of a dependence of acoustic signal on alpha energy. Twelve single nuclear recoil event candidates were observed during the run. The candidate events exhibit timing characteristics that are not consistent with the hypothesis of a uniform time distribution, and no evidence for a dark matter signal is claimed. These data provide the most sensitive direct detection constraints on WIMP-proton spin-dependent scattering to date, with significant sensitivity at low WIMP masses for spin-independent WIMP-nucleon scattering.

  14. Dark matter search results from the PICO-2L C$_3$F$_8$ bubble chamber

    DOE PAGES

    Amole, C.

    2015-06-11

    New data are reported from the operation of a 2 liter C3F8 bubble chamber in the SNOLAB underground laboratory, with a total exposure of 211.5 kg days at four different energy thresholds below 10 keV. These data show that C3F8 provides excellent electron-recoil and alpha rejection capabilities at very low thresholds. The chamber exhibits an electron-recoil sensitivity of < 3.5 × 10–10 and an alpha rejection factor of > 98.2%. These data also include the first observation of a dependence of acoustic signal on alpha energy. Twelve single nuclear recoil event candidates were observed during the run. The candidate eventsmore » exhibit timing characteristics that are not consistent with the hypothesis of a uniform time distribution, and no evidence for a dark matter signal is claimed. Lastly, these data provide the most sensitive direct detection constraints on WIMP-proton spin-dependent scattering to date, with significant sensitivity at low WIMP masses for spin-independent WIMP-nucleon scattering.« less

  15. BNg3F3: the first three noble gas atoms inserted into mono-centric neutral compounds - a theoretical study.

    PubMed

    Chen, Wei; Chen, Guang-Hui; Wu, Di; Wang, Qiang

    2016-06-29

    Following the study of HXeOXeH and HXeCCXeH, in which two Xe atoms were inserted into H2O and C2H2 theoretically and experimentally, the structures and stability of BNg3F3 (Ng = Ar, Kr and Xe), in which three Ng atoms are inserted into BF3, have been explored theoretically using DFT and ab initio calculations. It is shown that BNg3F3 (Ng = Ar, Kr and Xe) with D3h symmetry are local minima with short B-Ng bond lengths of 1.966, 2.027 and 2.214 Å at the CCSD(T)/aug-cc-pVTZ/LJ18 level, which are close to their covalent limits. Note that although BNg3F3 (Ng = Kr and Xe) are energetically higher than the dissociation products 3Ng + BF3, they are still kinetically stable as metastable species with protecting barriers of 13.38 and 17.99 kcal mol(-1) for BKr3F3 and BXe3F3. Moreover, BKr3F3, the tri-Kr-inserted compound, even has comparable kinetic stability to HXeOXeH and HXeOXeF. In addition, upon the formation of BNg3F3, there is a large amount of charge transferred from B to Ng of at least 0.619 e. The calculated Wiberg Bond Indices (WBI) suggest that B-Ng bonds are naturally singly bonded; the large vibrational frequencies of B-Ng and Ng-F stretching modes and the negative Laplacian electron density of B-Ng bonds confirm further that BNg3F3 are stiff molecules with covalent B-Ng bonds. It should be noted that three Ng atoms inserted into mono-centric neutral molecules have not been reported previously. We hope that the present theoretical study may provide important evidence for the experimental synthesis of BNg3F3.

  16. Pou3f4-Mediated Regulation of Ephrin-B2 Controls Temporal Bone Development in the Mouse

    PubMed Central

    Raft, Steven; Coate, Thomas M.; Kelley, Matthew W.; Crenshaw, E. Bryan; Wu, Doris K.

    2014-01-01

    The temporal bone encases conductive and sensorineural elements of the ear. Mutations of POU3F4 are associated with unique temporal bone abnormalities and X-linked mixed deafness (DFNX2/DFN3). However, the target genes and developmental processes controlled by POU3F4 transcription factor activity have remained largely uncharacterized. Ephrin-B2 (Efnb2) is a signaling molecule with well-documented effects on cell adhesion, proliferation, and migration. Our analyses of targeted mouse mutants revealed that Efnb2 loss-of-function phenocopies temporal bone abnormalities of Pou3f4 hemizygous null neonates: qualitatively identical malformations of the stapes, styloid process, internal auditory canal, and cochlear capsule were present in both mutants. Using failed/insufficient separation of the stapes and styloid process as a quantitative trait, we found that single gene Efnb2 loss-of-function and compound Pou3f4/Efnb2 loss-of-function caused a more severe phenotype than single gene Pou3f4 loss-of-function. Pou3f4 and Efnb2 gene expression domains overlapped at the site of impending stapes-styloid process separation and at subcapsular mesenchyme surrounding the cochlea; at both these sites, Efnb2 expression was attenuated in Pou3f4 hemizygous null mutants relative to control. Results of immunoprecipitation experiments using chromatin isolated from nascent middle ear mesenchyme supported the hypothesis of a physical association between Pou3f4 and specific non-coding sequence of Efnb2. We propose that Efnb2 is a target of Pou3f4 transcription factor activity and an effector of mesenchymal patterning during temporal bone development. PMID:25299585

  17. Magnetic structure of the antiferromagnetic Kondo lattice compounds CeRhAl4sub>Si2 and CeIrAl4sub>Si2

    SciTech Connect

    Ghimire, N. J.; Calder, S.; Janoschek, M.; Bauer, E. D.

    2015-06-01

    In this article, we have investigated the magnetic ground state of the antiferromagnetic Kondo-lattice compounds CeMAl4sub>Si2(M = Rh, Ir) using neutron powder diffraction. Although both of these compounds show two magnetic transitions TN1 and TN2 in the bulk properties measurements, evidence for magnetic long-range order was only found below the lower transition TN2. Analysis of the diffraction profiles reveals a commensurate antiferromagnetic structure with a propagation vector k = (0, 0, 1/2). The magnetic moment in the ordered state of CeRhAl4sub>Si2 and CeIrAl4sub>Si2 were determined to be 1.14(2) and 1.41(3) μB/Ce, respectively, and are parallel to the crystallographic c-axis in agreement with magnetic susceptibility measurements.

  18. Sensitive CH4sub> detection applying quantum cascade laser based optical feedback cavity-enhanced absorption spectroscopy.

    PubMed

    Lang, N; Macherius, U; Wiese, M; Zimmermann, H; Röpcke, J; van Helden, J H

    2016-03-21

    We report on sensitive detection of atmospheric methane employing quantum cascade laser based optical feedback cavity-enhanced absorption spectroscopy (OF-CEAS). An instrument has been built utilizing a continuous-wave distributed feedback quantum cascade laser (cw-QCL) with a V-shaped cavity, a common arrangement that reduces feedback to the laser from non-resonant reflections. The spectrometer has a noise equivalent absorption coefficient of 3.6 × 10-9 cm-1 Hz-1/2 for a spectral scan of CH4sub> at 7.39 μm. From an Allan-Werle analysis a detection limit of 39 parts per trillion of CH4sub> at atmospheric pressure within 50 s acquisition time was found.

  19. Investigation of room temperature ferromagnetic nanoparticles of Gd5Si4sub>

    SciTech Connect

    Hadimani, R. L.; Gupta, S.; Harstad, S. M.; Pecharsky, V. K.; Jiles, D. C.

    2015-07-06

    Gd5(SixGe1-x)4sub> compounds undergo first-order phase transitions close to room temperature when x ~ = 0.5, which are accompanied by extreme changes of properties. We report the fabrication of the nanoparticles of one of the parent compounds-Gd5Si4sub>-using high-energy ball milling. Crystal structure, microstructure, and magnetic properties have been investigated. Particles agglomerate at long milling times, and the particles that are milled >20 min lose crystallinity and no longer undergo magnetic phase transition close to 340 K, which is present in a bulk material. The samples milled for >20 min exhibit a slightly increased coercivity. As a result, magnetization at a high temperature of 275K decreases with the increase in the milling time.

  20. Single crystal growth of Yb doped NaGd(WO{sub 4}){sub 2} and structural and spectroscopic studies

    SciTech Connect

    Singh, S. G.; Singh, A. K.; Desai, D. G.; Tiwari, B.; Tyagi, M.

    2014-04-24

    High quality single crystals of NaGd(WO{sub 4}){sub 2} doped with 5 mol % Yb and oriented along <001> have been grown by the Czochralski technique in Ar atmosphere. The tetragonal space group I41/a accounts for all the reflections observed in the powder X-ray diffraction analysis. Polarized optical spectroscopy at room temperature revealed a direction dependence of absorption at different wavelength. As a novel uniaxial laser host for Yb{sup 3+}, NaGd(WO{sub 4}){sub 2} is characterized with respect to its transparency and band-edge. The emission spectrum of Yb{sup 3+} (excitation: 980-990 nm diode laser) was also recorded.

  1. Effects of Nickel Doping on the Multiferroic and Magnetic Phases of MnWO 4sub>

    SciTech Connect

    Poudel, N.; Lorenz, B.; Lv, B.; Wang, Y. Q.; Ye, F.; Wang, Jinchen; Fernandez-baca, J. A.; Chu, C. W.

    2015-12-15

    There are various orders in multiferroic materials with a frustrated spiral spin modulation inducing a ferroelectric state are extremely sensitive to small perturbations such as magnetic and electric fields, external pressure, or chemical substitutions. A classical multiferroic, the mineral Hubnerite with chemical formula MnWO4sub>, shows three different magnetic phases at low temperature. The intermediate phase between 7.5K < T < 12.7K is multiferroic and ferroelectricity is induced by an inversion symmetry breaking spiral Mn-spin order and strong spin-lattice interactions. Furthermore, the substitution of Ni2+ (spin 1) for Mn2+ (spin 5/2) in MnWO4sub> and its effects on the magnetic and multiferroic phases are studied. The ferroelectric phase is stabilized for low Ni content (up to 10%). Upon further Ni doping, the polarization in the ferroelectric phase is quickly suppressed while a collinear and commensurate magnetic phase, characteristic of the magnetic structure in NiWO4sub>, appears first at higher temperature, gradually extends to lower temperature, and becomes the ground state above 30% doping. Between 10% and 30%, the multiferroic phase coexists with the collinear commensurate phase. In this concentration region, the spin spiral plane is close to the a-b plane which explains the drop of the ferroelectric polarization. Finally, the phase diagram of Mn1-xNixWO4sub> is derived by a combination of magnetic susceptibility, specific heat, electric polarization, and neutron scattering measurements.

  2. Crystal chemistry of M{sup II}M′{sup IV}(PO{sub 4}){sub 2} double monophosphates

    SciTech Connect

    Bregiroux, Damien; Popa, Karin; Wallez, Gilles

    2015-10-15

    M{sup II}M′{sup IV}(PO{sub 4}){sub 2} compounds have been extensively studied for several decades for their potential applications in the field of several domains such as matrices for actinides conditioning, phosphors etc. In this paper, the relationships between composition and crystal structure of these compounds are established. A review of the various processes used for the synthesis of these compounds is also proposed, as well as their most reported properties. M{sup II}M′{sup IV}(PO{sub 4}){sub 2} structures stem from two different archetypes: the cheralite and the yavapaiite structures, with some exceptions that are also described in this article. The ratio of the cations radii appears to be the most relevant parameter. The high ratio between the ionic radii of the divalent and tetravalent cations in yavapaiite derivates results in the ordering of these cations into well-differentiated polyhedra whereas cheralite is the only non-ordered structure encountered for M{sup II}M′{sup IV}(PO{sub 4}){sub 2} compounds. - Graphical abstract: In this paper, the relationships between composition and crystal structure of M{sup II}M′{sup IV}(PO{sub 4}){sub 2} compounds are established. A review of the various processes used for the synthesis of these compounds is also proposed, as well as their most reported properties. - Highlights: • Crystal structure–composition relationships of MIIM′IV(PO4)2 compounds. • Review of the various processes used for the synthesis of these compounds. • Their most reported properties are described and discussed.

  3. Crystal structure of Rb{sub 2}[Ti(VO{sub 2}){sub 3}(PO{sub 4}){sub 3}

    SciTech Connect

    Yakubovich, O. V. Yakovleva, E. V.; Dimitrova, O. V.

    2010-03-15

    The crystal structure of the new compound Rb{sub 2}[Ti(VO{sub 2}){sub 3}(PO{sub 4}){sub 3}] obtained by hydrothermal synthesis in the RbCl-TiPO{sub 4}-V{sub 2}O{sub 5}-B{sub 2}O{sub 3}-H{sub 2}O system (a = 13.604(2) A, c = 9.386(2) A, sp. gr. P6cc, Z = 4, {rho}{sub calcd} = 3.32 g/cm{sup 3}) has been studied by X-ray diffraction (Xcalibur-S-CCD diffractometer, R = 0.038). It is shown that the isotypism of Rb{sub 2}[Ti(VO{sub 2}){sub 3}(PO{sub 4}){sub 3}] and Cs{sub 2}[Ti(VO{sub 2}){sub 3}(PO{sub 4}){sub 3}] is caused by the flexibility of a mixed anionic framework composed of phosphorus tetrahedra, vanadium five-vertex polyhedra, and titanium octahedra (bases of the crystal structures of these compounds). The topological correlations between the structures of titanium-vanadyl phosphates and benitoite and beryl silicates are analyzed.

  4. Growth and characterization of Pt-protected Gd5Si4sub> thin films

    SciTech Connect

    Hadimani, R L; Mudryk, Y; Prost, T E; Pecharsky, V K; Gschneidner, K A; Jiles, D C

    2014-05-07

    Successful growth and characterization of thin films of giant magnetocaloric Gd5(SixGe1-x)4sub> were reported in the literature with limited success. The inherent difficulty in producing this complex material makes it difficult to characterize all the phases present in the thin films of this material. Therefore, thin film of binary compound of Gd5Si4sub> was deposited by pulsed laser deposition. It was then covered with platinum on the top of the film to protect against any oxidation when the film was exposed to ambient conditions. The average film thickness was measured to be approximately 350 nm using a scanning electron microscopy, and the composition of the film was analyzed using energy dispersive spectroscopy. X-ray diffraction analysis indicates the presence of Gd5Si4sub> orthorhombic structure along with Gd5Si3 secondary phase. The transition temperature of the film was determined from magnetic moment vs. temperature measurement. The transition temperature was between 320 and 345 K which is close to the transition temperature of the bulk material. Magnetic moment vs. magnetic field measurement confirmed that the film was ferromagnetic below 342 K.

  5. Luminescence properties of Yb:Er:KY3F10 nanophosphor and thermal treatment effects

    NASA Astrophysics Data System (ADS)

    Gomes, Laércio; Linhares, Horácio Marconi da Silva M. D.; Ichikawa, Rodrigo Uchida; Martinez, Luis Gallego; Baldochi, Sonia Licia

    2016-04-01

    In this work, we present the spectroscopic properties of KY3F10 nanocrystals activated with erbium and codoped with ytterbium ions. The most important processes that lead to the erbium upconversion of green and red emissions of Er3+ were identified. A time-resolved luminescence spectroscopy technique was employed to measure the luminescence decays of 4S3/2 and 4F9/2 excited levels of Er3+ and to determine the upconversion processes and the luminescence efficiencies of erbium in the visible. Analysis of the luminescence kinetics in Yb:Er:KY3F10 shows a rapid upconversion (Up1) for the green emission with a time constant of 0.31 μs after pulsed laser excitation at 972 nm for as synthesized nanocrystals, which is faster than the time constant measured for the bulk crystal (23 μs). In addition, it is observed a second upconversion process (non-resonant) (Up2) responsible for the red emission (Er3+), which competes with Up1 process. However, the luminescence efficiency of the green emission (4S3/2) is observed to be very low (1.6%) for the as synthesized nanocrystal (25 °C). Nevertheless, it increases with the nanopowder heat treatment reaching an efficiency of 99% (T = 550 °C) relative to the bulk crystal. Similar luminescence behavior was observed for the 4F9/2 level (Er3+) that emits red emission. X-ray diffraction analysis of nanopowder by Rietveld method reveled that the mean crystallite size remains unchanged (8.3-12.3 nm) after thermal treatments with T ∼ 400 °C, while the 4S3/2 luminescence efficiency strongly increases to 20%. The luminescence dynamics indicates that Er3+ ions distribution plays a determinant role in the luminescence efficiency of green and red emissions of Er3+ besides also the strong influence on the upconversions processes. The observed luminescence effect is caused by the non-uniform Er3+ (and Yb3+) ions distribution due to the nanocrystal grown, which introduces a concentration gradient that increases towards the nanoparticle

  6. Characteristics and nature of the halogen-bonding interactions between CCl3F and ozone: a supermolecular and SAPT study

    NASA Astrophysics Data System (ADS)

    Esrafili, Mehdi D.; Yourdkhani, Sirous; Bahrami, Aidin

    2013-12-01

    The strength and nature of the halogen-bond interactions in CCl3F...O3 complexes were examined by means of ab initio quantum-chemical calculations and symmetry-adapted perturbation theory (SAPT). Our calculations predict a trifurcated C-Cl...O interaction for the global minimum of CCl3F...O3 complex and several local minima, differing slightly in energy, separated by very low barriers. The calculations, which include a rigorous decomposition of the interaction energies, also indicate that the interaction of CCl3F molecule with O3 is characterised by contributions from both electrostatic and dispersion energies, with the contribution of the latter being dominant. The evaluated SAPT interaction energies for the CCl3F...O3 complexes are generally in good agreement with those obtained using the supermolecule CCSD(T) method, suggesting that SAPT is a proper method to study the intermolecular interactions in these complexes.

  7. The Rice Eukaryotic Translation Initiation Factor 3 Subunit f (OseIF3f) Is Involved in Microgametogenesis

    PubMed Central

    Li, Qi; Deng, Zhuyun; Gong, Chunyan; Wang, Tai

    2016-01-01

    Microgametogenesis is the post-meiotic pollen developmental phase when unicellular microspores develop into mature tricellular pollen. In rice, microgametogenesis can influence grain yields to a great degree because pollen abortion occurs more easily during microgametogenesis than during other stages of pollen development. However, our knowledge of the genes involved in microgametogenesis in rice remains limited. Due to the dependence of pollen development on the regulatory mechanisms of protein expression, we identified the encoding gene of the eukaryotic translation initiation factor 3, subunit f in Oryza sativa (OseIF3f). Immunoprecipitation combined with mass spectrometry confirmed that OseIF3f was a subunit of rice eIF3, which consisted of at least 12 subunits including eIF3a, eIF3b, eIF3c, eIF3d, eIF3e, eIF3f, eIF3g, eIF3h, eIF3i, eIF3k, eIF3l, and eIF3m. OseIF3f showed high mRNA levels in immature florets and is highly abundant in developing anthers. Subcellular localization analysis showed that OseIF3f was localized to the cytosol and the endoplasmic reticulum in rice root cells. We further analyzed the biological function of OseIF3f using the double-stranded RNA-mediated interference (RNAi) approach. The OseIF3f-RNAi lines grew normally at the vegetative stage but displayed a large reduction in seed production and pollen viability, which is associated with the down-regulation of OseIF3f. Further cytological observations of pollen development revealed that the OseIF3f-RNAi lines showed no obvious abnormalities at the male meiotic stage and the unicellular microspore stage. However, compared to the wild-type, OseIF3f-RNAi lines contained a higher percentage of arrested unicellular pollen at the bicellular stage and a higher percentage of arrested unicellular and bicellular pollen, and aborted pollen at the tricellular stage. These results indicate that OseIF3f plays a role in microgametogenesis. PMID:27200010

  8. NbRABG3f, a member of Rab GTPase, is involved in Bamboo mosaic virus infection in Nicotiana benthamiana.

    PubMed

    Huang, Ying-Ping; Jhuo, Jia-Hua; Tsai, Meng-Shan; Tsai, Ching-Hsiu; Chen, Hong-Chi; Lin, Na-Sheng; Hsu, Yau-Heiu; Cheng, Chi-Ping

    2016-06-01

    The screening of differentially expressed genes in plants after pathogen infection can uncover the potential host factors required for the pathogens. In this study, an up-regulated gene was identified and cloned from Nicotiana benthamiana plants after Bamboo mosaic virus (BaMV) inoculation. The up-regulated gene was identified as a member of the Rab small guanosine triphosphatase (GTPase) family, and was designated as NbRABG3f according to its in silico translated product with high identity to that of RABG3f of tomato. Knocking down the expression of NbRABG3f using a virus-induced gene silencing technique in a protoplast inoculation assay significantly reduced the accumulation of BaMV. A transiently expressed NbRABG3f protein in N. benthamiana plants followed by BaMV inoculation enhanced the accumulation of BaMV to approximately 150%. Mutants that had the catalytic site mutation (NbRABG3f/T22N) or had lost their membrane-targeting capability (NbRABG3f/ΔC3) failed to facilitate the accumulation of BaMV in plants. Because the Rab GTPase is responsible for vesicle trafficking between organelles, a mutant with a fixed guanosine diphosphate form was used to identify the donor compartment. The use of green fluorescent protein (GFP) fusion revealed that GFP-NbRABG3f/T22N clearly co-localized with the Golgi marker. In conclusion, BaMV may use NbRABG3f to form vesicles derived from the Golgi membrane for intracellular trafficking to deliver unidentified factors to its replication site; thus, both GTPase activity and membrane-targeting ability are crucial for BaMV accumulation at the cell level.

  9. Carcinogenicity study of cochineal in B6C3F1 mice.

    PubMed

    Mori, H; Iwata, H; Tanaka, T; Morishita, Y; Mori, Y; Kojima, T; Okumura, A

    1991-09-01

    The carcinogenicity of cochineal, a red colouring used in food and other products, was studied in a 2-yr bioassay in B6C3F1 mice. Groups of 50-55 mice of each sex were given 0, 3 or 6% cochineal in the diet for 2 yr. Mice of all groups developed tumours including hepatocellular adenomas or carcinomas, pulmonary adenomas or adenocarcinomas and lymphomas or lymphatic leukaemias, and the incidences of these tumours were not significantly different in treated and control groups. The results indicate that cochineal lacks carcinogenicity in mice and are consistent with those of in vitro short-term assays of cochineal and of carminic acid, an active principle of cochineal. PMID:1937288

  10. Tumor induction by monoenergetic neutrons in B6C3F1 mice.

    PubMed

    Watanabe, Hiromitsu; Kashimoto, Naoki; Kajimura, Junko; Ishikawa, Masayori; Kamiya, Kenji

    2007-05-01

    This study was undertaken to investigate induction of tumors by monoenergetic neutrons in B6C3F1 mice. Individual groups of 6 week-old animals of both sexes (about 30 mice/group) were exposed to 0.5 Gy of various monoenergetic neutrons (dose rate 0.5 cGy/min) and then observed for 13 months. The incidences of tumors (mainly liver neoplasms) in non-irradiated male and female controls were 11% and 0%, respectively. In the irradiated animals, the incidences were 53%, 50%, 60% and 43% in males, and 75%, 81%, 71%, and 85% in females, after 0.18, 0.32, 0.6 and 1.0 MeV neutron exposure, respectively. There were no significant differences in the tumor induction rate among the different energy groups.

  11. Useful ion yields for Cameca IMS 3f and 6f SIMS: Limits on quantitative analysis

    USGS Publications Warehouse

    Hervig, R.L.; Mazdab, F.K.; Williams, Pat; Guan, Y.; Huss, G.R.; Leshin, L.A.

    2006-01-01

    The useful yields (ions detected/atom sputtered) of major and trace elements in NIST 610 glass were measured by secondary ion mass spectrometry (SIMS) using Cameca IMS 3f and 6f instruments. Useful yields of positive ions at maximum transmission range from 10-4 to 0.2 and are negatively correlated with ionization potential. We quantified the decrease in useful yields when applying energy filtering or high mass resolution techniques to remove molecular interferences. The useful yields of selected negative ions (O, S, Au) in magnetite and pyrite were also determined. These data allow the analyst to determine if a particular analysis (trace element contents or isotopic ratio) can be achieved, given the amount of sample available and the conditions of the analysis. ?? 2005 Elsevier B.V. All rights reserved.

  12. Ne matrix spectra of the sym-C6Br3F3+ radical cation

    USGS Publications Warehouse

    Bondybey, V.E.; Sears, T.J.; Miller, T.A.; Vaughn, C.; English, J.H.; Shiley, R.S.

    1981-01-01

    The electronic absorption and laser excited, wavelength resolved fluorescence spectra of the title cation have been observed in solid Ne matrix and vibrationally analysed. The vibrational structure of the excited B2A2??? state shows close similarity to the parent compound. The X2E??? ground state structure is strongly perturbed and irregular owing to a large Jahn-Teller distortion. The data are analysed in terms of a recently developed, sophisticated multimode Jahn-Teller theoretical model. We have generated the sym-C6Br3F3+ cations in solid Ne matrix and obtained their wavelength resolved emission and absorption spectra. T ground electronic X2E??? state exhibits an irregular and strongly perturbed vibrational structure, which can be successfully modeled using sophisticated multimode Jahn-Teller theory. ?? 1981.

  13. Glycidol modulation of the immune responses in female B6C3F1 mice.

    PubMed

    Guo, T L; McCay, J A; Brown, R D; Musgrove, D L; Butterworth, L; Munson, A E; Germolec, D R; White, K L

    2000-08-01

    The immunotoxic potential of glycidol was evaluated in female B6C3F1 mice using a battery of functional assays and three host resistance models. Glycidol was administered to the animals by oral gavage as a solution in sterile distilled water daily for 14 days at doses of 25, 125 and 250 mg/kg. In tier I, we observed that glycidol exposure produced a dose-related decrease in splenocyte IgM antibody-forming cell response to sheep red blood cells (sRBC); the spleen natural killer (NK) cell activity was also decreased. A decrease in B cell proliferative responses to anti-IgM F(ab')2 and/or interleukin-4 (IL-4) was observed while the splenocyte proliferative responses to T cell mitogen ConA and B cell mitogen LPS were not affected. The splenocyte proliferative response to allogeneic cells as evaluated in the mixed leukocyte reaction (MLR) to DBA/2 spleen cells was not affected. In tier II, we found that exposure to glycidol decreased the number and percentage of B cells and the absolute number of CD4+ T cells in the spleen while the number of total T cells, CD8+ T cells and CD4+CD8+ T cells was not affected. The cytotoxic T lymphocyte (CTL) response to mitomycin C-treated P815 mastocytoma was not affected; the cytotoxic activity of peritoneal macrophages was not suppressed. Moreover, the host resistance to Listeria monocytogenes was not affected although a slight increase in host resistance to Streptococcus pneumoniae was observed. However, exposure to glycidol decreased host resistance to the B16F10 melanoma tumor model with the maximal tumor formation in lung observed in the high dose group. Overall, these dada support the finding that glycidol is an immunosuppressive agent in female B6C3F1 mice.

  14. Vibrational relaxation of matrix-isolated CH/sub 3/F and HCl

    SciTech Connect

    Young, L.

    1981-08-01

    Kinetic and spectroscopic studies have been performed on CH/sub 3/F and HCl as a function of host matrix and temperature. Temporally and spectrally resolved infrared fluorescence was used to monitor the populations of both the initially excited state and the lower lying levels which participate in the relaxation process. For CH/sub 3/F, relaxation from any of the levels near 3.5 ..mu.., i.e. the CH stretching fundamentals or bend overtones, occurs via rapid (< 5 ns) V ..-->.. V transfer to 2..nu../sub 3/ with subsequent relaxation of the ..nu../sub 3/ (CF stretch) manifold. Lifetimes of 2..nu../sub 3/ and ..nu../sub 3/ were determined through overtone, ..delta..V = 2, and fundamental fluorescence. These lifetimes show a dramatic dependence on host lattice, an increase of two orders of magnitude in going from Xe and Ar matrices. Lifetimes depend only weakly on temperature. The relaxation of 2..nu../sub 3/ and ..nu../sub 3/ is consistent with a model in which production of a highly rotationally excited guest via collisions with the repulsive wall of the host is the rate limiting step. For HCl, lifetimes of v = 1,2,3 have been determined. In all hosts, the relaxation is non-radiative. For a given vibrational state, v, the relaxation rate increases in the series k(Ar) < k(Kr) < k(Xe). The dependence of the relaxation rate; on v is superlinear in all matrices, the deviation from linearity increasng in the order Ar < Kr < Xe. The relaxation rates become more strongly temperature dependent with increasing vibrational excitation. The results are consistent with a mechanism in which complex formation introduces the anisotropy necessary to induce a near resonant V ..-->.. R transition in the rate limiting step.

  15. IT3F: a web-based tool for functional analysis of transcription factors in plants.

    PubMed

    Bailey, Paul C; Dicks, Jo; Wang, Trevor L; Martin, Cathie

    2008-10-01

    A web-based tool, the Interspecies Transcription Factor Function Finder (IT3F), has been developed to display both evolutionary gene relationships and expression data for plant transcription factors, focussing primarily on the R2R3MYB gene subfamily for proof of concept. The graphical display of information allows users to make direct comparisons between structurally related genes and to identify those genes that are potentially orthologous, thereby assisting with their understanding of gene function. A key feature of the website is the provision of an interrogative phylogenetic tree that allows submission of new sequences corresponding to a transcription factor family or subfamily and maps their relative positions to the products of other genes on an 'existing' tree containing proteins encoded by Arabidopsis and rice genes, along with key proteins encoded by genes from other species that have been characterised functionally. In addition, a feature to select clusters of related sequences has been developed so that more detailed phylogenetic analysis can be performed to highlight potential orthologous and paralogous genes within related clusters. Arabidopsis genes that reside on duplicated regions of the genome are indicated on the tree, providing further information for interpreting gene function. An additional feature of the website allows a selected number of key Arabidopsis and rice microarray experiments to be visualised alongside the tree as a tabulated heat map of expression intensity values. Through this display, it is possible to observe relative expression levels across a whole gene family and the extent to which the expression of closely related genes within subgroups has altered since their ancestral divergence. The website is available at http://jicbio.nbi.ac.uk/IT3F/.

  16. New open-framework in the uranyl vanadates A{sub 3}(UO{sub 2}){sub 7}(VO{sub 4}){sub 5}O (A=Li, Ag) with intergrowth structure between A(UO{sub 2}){sub 4}(VO{sub 4}){sub 3} and A{sub 2}(UO{sub 2}){sub 3}(VO{sub 4}){sub 2}O

    SciTech Connect

    Obbade, S. Renard, C.; Abraham, F.

    2009-03-15

    New uranyl vanadates A{sub 3}(UO{sub 2}){sub 7}(VO{sub 4}){sub 5}O (M=Li (1), Na (2), Ag (3)) have been synthesized by solid-state reaction and their structures determined from single-crystal X-ray diffraction data for 1 and 3. The tetragonal structure results of an alternation of two types of sheets denoted S for {sub {infinity}}{sup 2}[UO{sub 2}(VO{sub 4}){sub 2}]{sup 4-} and D for {sub {infinity}}{sup 2}[(UO{sub 2}){sub 2}(VO{sub 4}){sub 3}]{sup 5-} built from UO{sub 6} square bipyramids and connected through VO{sub 4} tetrahedra to {sub {infinity}}{sup 1}[U(3)O{sub 5}-U(4)O{sub 5}]{sup 8-} infinite chains of edge-shared U(3)O{sub 7} and U(4)O{sub 7} pentagonal bipyramids alternatively parallel to a- and b-axis to construct a three-dimensional uranyl vanadate arrangement. It is noticeable that similar {sub {infinity}}[UO{sub 5}]{sup 4-} chains are connected only by S-type sheets in A{sub 2}(UO{sub 2}){sub 3}(VO{sub 4}){sub 2}O and by D-type sheets in A(UO{sub 2}){sub 4}(VO{sub 4}){sub 3}, thus A{sub 3}(UO{sub 2}){sub 7}(VO{sub 4}){sub 5}O appears as an intergrowth structure between the two previously reported series. The mobility of the monovalent ion in the mutually perpendicular channels created in the three-dimensional arrangement is correlated to the occupation rate of the sites and by the geometry of the different sites occupied by either Na, Ag or Li. Crystallographic data: 293 K, Bruker X8-APEX2 X-ray diffractometer equipped with a 4 K CCD detector, MoK{alpha}, {lambda}=0.71073 A, tetragonal symmetry, space group P4-bar m2, Z=1, full-matrix least-squares refinement on the basis of F{sup 2}; 1,a=7.2794(9) A, c=14.514(4) A, R1=0.021 and wR2=0.048 for 62 parameters with 782 independent reflections with I{>=}2{sigma}(I); 3, a=7.2373(3) A, c=14.7973(15) A, R1=0.041 and wR2=0.085 for 60 parameters with 1066 independent reflections with I{>=}2{sigma}(I). - Abstract: A view of the three-dimensional structure of Li{sub 3}(UO{sub 2}){sub 7}(VO{sub 4}){sub 5}O

  17. Characterization of the myelotoxicity of chloramphenicol succinate in the B6C3F1 mouse.

    PubMed

    Turton, John A; Fagg, Rajni; Sones, William R; Williams, Thomas C; Andrews, C Michael

    2006-04-01

    Chloramphenicol (CAP) is haemotoxic in man, inducing two types of toxicity. First, a dose-related, reversible anaemia with reticulocytopenia, sometimes seen in conjunction with leucopenia and thrombocytopenia; this form of toxicity develops during drug treatment. The second haemotoxicity is aplastic anaemia (AA) which is evident in the blood as severe pancytopenia. AA development is not dose-related and occurs weeks or months after treatment. We wish, in the longer term, to investigate CAP-induced AA in the busulphan-pretreated mouse. However, as a prelude to that study, we wanted to characterize in detail the reversible haemotoxicity of CAP succinate (CAPS), administered at high dose levels in the mouse, and follow the recovery of the bone marrow in the post-dosing period. Female B6C3F1 mice were gavaged with CAPS at 0, 2500 and 3500 mg/kg, daily, for 5 days and sampled (n = 5) at 1, 7, 14 and 21 days post-dosing. Blood, bone marrow and spleen samples were analysed and clonogenic assays carried out. At day 1 post-dosing, at both CAPS dose levels, decreases were seen in erythrocytes and erythrocyte precursors; marrow erythroid cells were reduced. Reductions were also evident in splenic nucleated cell counts, blood high fluorescence ratio (HFR) reticulocyte counts and total reticulocyte counts; burst-forming units-erythroid and colony-forming units-erythroid showed decreases. At day 7 post-dosing (2500 mg/kg CAPS), there was regeneration of erythrocyte production, with marked splenic erythropoietic activity, and raised blood HFR reticulocytes. At day 7, at 3500 mg/kg CAPS, erythrocyte and reticulocyte parameters remained depressed. At 14 days post-dosing (2500 mg/kg CAPS), many erythrocyte parameters had returned to normal; at 3500 mg/kg CAPS, there was erythroid regeneration. By 21 days post-dosing, at both CAPS dose levels, most erythrocytic parameters were equivalent to control values. For leucocyte parameters, there was some depression at day 1 post-dosing (at

  18. Field Evaluation of Transgenic Switchgrass Plants Overexpressing PvMYB4sub> for Reduced Biomass Recalcitrance

    SciTech Connect

    Baxter, Holly L.; Poovaiah, Charleson R.; Yee, Kelsey L.; Mazarei, Mitra; Rodriguez, Miguel; Thompson, Olivia A.; Shen, Hui; Turner, Geoffrey B.; Decker, Stephen R.; Sykes, Robert W.; Chen, Fang; Davis, Mark F.; Mielenz, Jonathan R.; Davison, Brian H.; Dixon, Richard A.; Stewart, C. Neal

    2015-01-07

    High biomass yields and minimal agronomic input requirements have made switchgrass, Panicum virgatum L., a leading candidate lignocellulosic bioenergy crop. Large-scale lignocellulosic biofuel production from such crops is limited by the difficulty to deconstruct cell walls into fermentable sugars: the recalcitrance problem. In this study, we assessed the field performance of switchgrass plants overexpressing the switchgrass MYB4sub> (PvMYB4sub>) transcription factor gene. PvMYB4sub> transgenic switchgrass can have great lignin reduction, which commensurately increases sugar release and biofuel production. Our results over two growing seasons showed that one transgenic event (out of eight) had important gains in both biofuel (32% more) and biomass (63% more) at the end of the second growing season relative to non-transgenic controls. These gains represent a doubling of biofuel production per hectare, which is the highest gain reported from any field-grown modified feedstock. In contrast to this transgenic event, which had relatively low ectopic overexpression of the transgene, five of the eight transgenic events planted did not survive the first field winter. The dead plants were all high-overexpressing events that performed well in the earlier greenhouse studies. Disease susceptibility was not compromised in any transgenic events over the field experiments. These results demonstrate the power of modifying the expression of an endogenous transcription factor to improve biofuel and biomass simultaneously, and also highlight the importance of field studies for "sorting" transgenic events. In conclusion, further research is needed to develop strategies for fine-tuning temporal-spatial transgene expression in feedstocks to optimize desired phenotypes.

  19. Acrylonitrile is a multisite carcinogen in male and female B6C3F1 mice.

    PubMed

    Ghanayem, Burhan I; Nyska, Abraham; Haseman, Joseph K; Bucher, John R

    2002-07-01

    Acrylonitrile is a heavily produced unsaturated nitrile, which is used in the production of synthetic fibers, plastics, resins, and rubber. Acrylonitrile is a multisite carcinogen in rats after exposure via gavage, drinking water, or inhalation. No carcinogenicity studies of acrylonitrile in a second animal species were available. The current studies were designed to assess the carcinogenicity of acrylonitrile in B6C3F1 mice of both sexes. Acrylonitrile was administered by gavage at 0, 2.5, 10, or 20 mg/kg/day, 5 days per week, for 2 years. Urinary thiocyanate and N-acetyl-S-(2-cyanoethyl)-L-cysteine were measured as markers of exposure to acrylonitrile. In general, there were dose-related increases in urinary thiocyanate and N-acetyl-S-(2-cyanoethyl)-L-cysteine concentrations in all dosed groups of mice and at all time points. Survival was significantly (p < 0.001) reduced in the top dose (20 mg/kg) group of male and female mice relative to controls. The incidence of forestomach papillomas and carcinomas was increased in mice of both sexes in association with an increase in forestomach epithelial hyperplasia. The incidence of Harderian gland adenomas and carcinomas was also markedly increased in the acrylonitrile-dosed groups. In female mice, the incidence of benign or malignant granulosa cell tumors (combined) in the ovary in the 10 mg/kg dose group was greater than that in the vehicle control group, but because of a lack of dose response, this was considered an equivocal finding. In addition, the incidences of atrophy and cysts in the ovary of the 10 and 20 mg/kg dose groups were significantly increased. The incidences of alveolar/bronchiolar adenoma or carcinoma (combined) were significantly increased in female mice treated with acrylonitrile at 10 mg/kg/day for 2 years. This was also considered an equivocal result. In conclusion, these studies demonstrated that acrylonitrile causes multiple carcinogenic effects after gavage administration to male and female B6

  20. Inhalation pharmacokinetics of ethylbenzene in B6C3F1 mice

    SciTech Connect

    Charest-Tardif, G.; Tardif, R.; Krishnan, K. . E-mail: Kannan.krishnan@umontreal.ca

    2006-01-15

    The objective of the present study was to characterize the inhalation pharmacokinetics of ethylbenzene (EB) in male and female B6C3F1 mice following single and repeated exposures. Initially, groups of 28 male and female mice were exposed for 4 h to 75, 200, 500, or 1000 ppm in order to determine potential non-linearity in the kinetics of EB. Then, groups of male and female mice were exposed for 6 h to 75 ppm and 750 ppm (corresponding to the NTP exposures) for 1 or 7 consecutive days, to evaluate whether EB kinetics was altered during repeated exposures, The maximal blood concentration (C {sub max}; mean {+-} SD, n = 4) observed in female mice at the end of a 4-h exposure to 75, 200, 500, and 1000 ppm was 0.53 {+-} 0.18, 2.26 {+-} 0.38, 19.17 {+-} 2.74, and 82.36 {+-} 16.66 mg/L, respectively. The areas under the concentration vs. time curve (AUCs) following 4-h exposure to 75, 200, 500, and 1000 ppm were 88.5, 414.0, 3612.2, and 19,104.1 mg/L/min, respectively, in female mice, and 116.7, 425.7, 3148.3, and 16,039.1 mg/L/min in male mice. The comparison of C {sub max} and the kinetic profile of EB in mice exposed to 75 ppm suggests that they are similar between 1-day and 7-day exposures. However, at 750 ppm, the rate of EB elimination would appear to be greater after repeated exposures than single exposure, the pattern being evident in both male and female mice. Overall, the single and repeated exposure pharmacokinetic data collected in the present study suggest that EB kinetics is saturable at exposure concentrations exceeding 500 ppm (and therefore at 750 ppm used in the NTP mouse cancer bioassay) but is in the linear range at the lower concentration used in the bioassay (75 ppm). These data suggest that consideration of the nature and magnitude of non-linear kinetics and induction of metabolism during repeated exposures is essential for the conduct of a scientifically sound analysis of EB cancer dose-response data collected in B6C3F1 mice.

  1. Infrared-to-visible upconversion in thin films of LaEr(MoO{sub 4}){sub 3}

    SciTech Connect

    Bubb, D.M.; Cohen, D.; Qadri, S.B.

    2005-09-26

    LaEr(MoO{sub 4}){sub 3} thin films have been grown by pulsed laser deposition. The films were characterized by x-ray diffraction, Rutherford backscattering, and fluorescence measurements. The results show that the deposited films were epitaxial with their c axis oriented along the surface normal. Films illuminated with 980 nm laser light show visible emission spectra. This visible emission arises as a result of the Er 4f-4f transitions and their lifetimes. Such so-called 'upconverting phosphors' are important to the development of new chemical and biological sensing applications.

  2. trans-K3[TcO2(CN)4sub>

    SciTech Connect

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

    2010-07-14

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

  3. Femtosecond pulse generation with an a-cut Nd:CaYAlO4sub> disordered crystal.

    PubMed

    Liu, Shan-De; Dong, Lu-Lu; Xu, Yan; Zhang, Xiao; Ren, Ting-Qi; Xu, Xiao-Dong; Peng, Yan-Dong; Zhang, Yu-Ping; Zhang, Hui-Yun; Li, De-Hua; Zhang, Bai-Tao; He, Jing-Liang

    2016-09-20

    We experimentally demonstrated a diode-pumped 587 fs ultrafast laser by using an a-cut Nd:CaYAlO4sub> crystal. Pumped by an 808 nm fiber-coupled laser diode, a stable continuous-wave mode-locked ultrafast laser was achieved with a semiconductor saturable absorber. The ultrafast pulses had a repetition rate of 75 MHz at the center wavelength of 1080.8 nm. A maximum average output power of the mode-locked laser reached 375 mW delivering a slope efficiency of 9%. PMID:27661595

  4. Tailoring the surface properties of LiNi0.4sub>Mn0.4sub>Co0.2O₂ by titanium substitution for improved high voltage cycling performance

    SciTech Connect

    Wolff-Goodrich, Silas; Xin, Huolin L.; Lin, Feng; Markus, Isaac M.; Nordlund, Dennis; Asta, Mark; Doeff, Marca M.

    2015-07-30

    The present research aims to provide insights into the behavior of LiNi0.4Mn0.4Co0.2O2 (NMC442) and LiNi0.4sub>Mn0.4sub>Co0.2O₂ (NMC442-Ti02) cathode materials under galvanostatic cycling to high potentials, in the context of previous work which predicted that Ti-substituted variants should deliver higher capacities and exhibit better cycling stability than the unsubstituted compounds. It is found that NMC cathodes containing Ti show equivalent capacity fading but greater specific capacity than those without Ti in the same potential range. When repeatedly charged to the same degree of delithiation, NMC cathodes containing Ti showed better capacity retention. Soft x-ray absorption spectroscopy (XAS) spectra for Mn and Co indicated increased reduction in these elements for NMC cathodes without Ti, indicating that the substitution of Ti for Co acts to suppress the formation of a high impedance rock salt phase at the surface of NMC cathode particles. The results of this study validate the adoption of a facile change to existing NMC chemistries to improve cathode capacity retention under high voltage cycling conditions.

  5. Heterogeneous Nature of Relaxation Dynamics of Room-Temperature Ionic Liquids (EMIm)2[Co(NCS)4sub>] and (BMIm)2[Co(NCS)4sub>

    SciTech Connect

    Hensel-Bielowka, Stella; Wojnarowska, Zaneta; Dzida, Marzena; Zorębski, Edward; Zorębski, Michał; Geppert-Rybczyńska, Monika; Peppel, Tim; Grzybowska, Katarzyna; Wang, Yangyang; Sokolov, Alexei P.; Paluch, Marian

    2015-08-11

    Dynamic crossover above Tg has been recognized as a characteristic feature of molecular dynamics of liquids approaching glass transition. Experimentally, it is manifested as a change in Vogel–Fulcher–Tammann dependence or a breakdown of the Stokes–Einstein and related relations. In this study, we report the exception from this rather general pattern of behavior. By means of dielectric, ultrasonic, rheological, and calorimetric methods, dynamics of two good ionic conductors (BMIm)2[Co(NCS)4sub>] and (EMIm)2[Co(NCS)4sub>] of less common stoichiometry (2:1) was studied in a very broad temperature range. However, none of the mentioned dynamic changes was observed in the entire studied temperature range. On the contrary, the single VFT and the same fractional Walden coefficient were found for conductivity and viscosity changes over 12 decades. Finally and moreover, ultrasonic studies revealed that the data at temperatures which cover the normal liquid region cannot be fitted by a single exponential decay, and the Cole–Cole function should be used instead.

  6. Morphology control of open-framework zinc phosphate Zn{sub 4}(H{sub 3}O)(NH{sub 4}){sub 3}(PO{sub 4}){sub 4} via microwave-assisted technique

    SciTech Connect

    Ding, Ling; Song, Yu; Yang, Wei; Xue, Run-Miao; Zhai, Shang-Ru; An, Qing-Da

    2013-08-15

    Open-framework zinc phosphates were synthesized by microwave-assisted technique, and it was shown that the morphology of as-prepared materials could be easily tailored by changing synthesis temperature, reaction time and pH value. During the synthesis, when the reaction temperature increases from 130 °C to 220 °C, the products transformed from hexagonal prisms to polyhedron along with the disappearance of the hexagonal prisms vertical plane. Simultaneously, both the reaction time and pH value could promote the nucleation and growth of crystal particles. More interestingly, the target products with different morphologies could be obtained by varying the usage of NaOH or NH{sub 3}·H{sub 2}O at 130 °C during the microwave synthesis process. - Graphical abstract: Zinc phosphates with variable morphologies can be obtained by simply tuning the microwave-heating temperatures. Display Omitted - Highlights: • Synthesis of open-framework Zn{sub 4} (H{sub 3}O) (NH{sub 4}){sub 3}(PO{sub 4}){sub 4} compounds employing microwave technique. • Dependence of morphology on the reaction conditions. • Morphology transformation from hexagonal prisms to polyhedron was observed.

  7. Synthesis, crystal structure and properties of a new lead fluoride borate, Pb{sub 3}OBO{sub 3}F

    SciTech Connect

    Zhao, Wenwu; Pan, Shilie; Dong, Xiaoyu; Li, Junjie; Tian, Xuelin; Fan, Xiaoyun; Chen, Zhaohui; Zhang, Fangfang

    2012-04-15

    Graphical abstract: The structure of Pb{sub 3}OBO{sub 3}F consists of two distortional Pb-centered tetrahedra and BO{sub 3} triangles which are all symmetrical with each other respectively in the gestalt structure to the extent that the Pb{sub 3}OBO{sub 3}F compound crystallizes in the symmetrical space group. Highlights: Black-Right-Pointing-Pointer Pb{sub 3}OBO{sub 3}F has been grown from PbO-PbF{sub 2}-B{sub 2}O{sub 3} system for the first time. Black-Right-Pointing-Pointer It crystallizes in the orthorhombic system, space group Pbcm. Black-Right-Pointing-Pointer Pb{sub 3}OBO{sub 3}F consists of Pb(1)O{sub 3}F tetrahedra, Pb(2)O{sub 4} tetrahedra and BO{sub 3} triangles. -- Abstract: A new compound, Pb{sub 3}OBO{sub 3}F, has been grown by the high temperature solution method from the PbO-PbF{sub 2}-B{sub 2}O{sub 3} system. It crystallizes in the orthorhombic system, space group Pbcm with unit-cell parameters a = 7.6313(14) Angstrom-Sign , b = 6.5229(12) Angstrom-Sign , c = 11.906(2) Angstrom-Sign , Z = 4, volume = 592.66(19) Angstrom-Sign {sup 3}. The structure of the compound is solved by the direct methods and refined to R{sub 1} = 0.0528 and wR{sub 2} = 0.1400. Pb{sub 3}OBO{sub 3}F consists of Pb(1)O{sub 3}F tetrahedra, Pb(2)O{sub 4} tetrahedra and BO{sub 3} triangles which build up the symmetrical chains extended along the c-axis. The powder X-ray diffraction pattern of the Pb{sub 3}OBO{sub 3}F has been measured. Functional groups presented in the sample were identified by Fourier transform infrared spectrum.

  8. Study of calcium-containing orthophosphates of NaZr{sub 2}(PO{sub 4}){sub 3} structural type by high-temperature X-ray diffraction

    SciTech Connect

    Orlova, A. I.; Kanunov, A. E.; Samoilov, S. G.; Kazakova, A. Yu.; Kazantsev, G. N.

    2013-03-15

    Orthophosphates Ca{sub 0.5}Ti{sub 2}(PO{sub 4}){sub 3}, Ca{sub 0.5}Zr{sub 2}(PO{sub 4}){sub 3}, Ca{sub 0.75}Zr{sub 2}(SiO{sub 4}){sub 0.5}(PO{sub 4}){sub 2.5}, and CaMg{sub 0.5}Zr{sub 1.5}(PO{sub 4}){sub 3} (structural type NaZr{sub 2}(PO{sub 4}){sub 3}), having different occupancies of interframework positions by calcium, have been prepared by the sol-gel method with the subsequent thermal treatment of dried gels and investigated by IR spectroscopy and X-ray diffraction. The analytical indexing of X-ray diffraction patterns is performed within the sp. gr. R3{sup -}. High-temperature X-ray diffraction was used to investigate the behavior of the orthophosphates upon heating: thermal expansion in the temperature range of 20-610 Degree-Sign C (up to 500 Degree-Sign C for Ca{sub 0.5}Zr{sub 2}(PO{sub 4}){sub 3}). The coefficients of thermal expansion are calculated from the shift of diffraction peaks. The unit-cell parameters of crystals at different temperatures are determined. The dependences of thermal expansion and its anisotropy on the occupancy of cation M positions by calcium are revealed.

  9. Comparative analysis of the gene-inactivating potential of retroviral restriction factors APOBEC3F and APOBEC3G.

    PubMed

    Bélanger, Kasandra; Langlois, Marc-André

    2015-09-01

    APOBEC3 (A3) proteins are host-encoded restriction factors that inhibit retrovirus infection by mutagenic deamination of cytosines in minus-strand DNA replication intermediates. APOBEC3F (A3F) and APOBEC3G (A3G) are two of the most potent A3 enzymes in humans with each having a different target DNA specificity. A3G prefers to deaminate cytosines preceded by a cytosine (5'-CC), whereas A3F preferentially targets cytosines preceded by a thymine (5'-TC). Here we performed a detailed comparative analysis of retrovirus-encoded gene sequences edited by A3F and A3G, with the aim of correlating the context and intensity of the mutations with their effects on gene function. Our results revealed that, when there are few (TGG) tryptophan codons in the sequence, both enzymes alter gene function with a similar efficiency when given equal opportunities to deaminate in their preferred target DNA context. In contrast, tryptophan-rich genes are efficiently inactivated in the presence of a low mutational burden, through termination codon generation by A3G but not A3F. Overall, our results clearly demonstrated that the target DNA specificity of an A3 enzyme along with the intensity of the mutational burden and the tryptophan content of the gene being targeted are the factors that have the most forceful influence on whether A3-induced mutations will favour either terminal inactivation or genetic diversification of a retrovirus. PMID:26048885

  10. Cytoplasmic Mislocalization of POU3F4 Due to Novel Mutations Leads to Deafness in Humans and Mice

    PubMed Central

    Parzefall, Thomas; Shivatzki, Shaked; Lenz, Danielle R.; Rathkolb, Birgit; Ushakov, Kathy; Karfunkel, Daphne; Shapira, Yisgav; Wolf, Michael; Mohr, Manuela; Wolf, Eckhard; Sabrautzki, Sibylle; De Angelis, Martin Hrabé; Frydman, Moshe; Brownstein, Zippora; Avraham, Karen B.

    2013-01-01

    POU3F4 is a POU domain transcription factor that is required for hearing. In the ear, POU3F4 is essential for mesenchymal remodeling of the bony labyrinth and is the causative gene for DFNX2 human non-syndromic deafness. Ear abnormalities underlie this form of deafness, characterized previously in multiple spontaneous, radiation-induced and transgenic mouse mutants. Here we report three novel mutations in the POU3F4 gene that result in profound hearing loss in both humans and mice. A p.Gln79* mutation was identified in a child from an Israeli family, revealed by massively parallel sequencing (MPS). This strategy demonstrates the strength of MPS for diagnosis with only one affected individual. A second mutation, p.Ile285Argfs*43, was identified by Sanger sequencing. A p.Cys300* mutation was found in an ENU-induced mutant mouse, schwindel (sdl), by positional cloning. The mutation leads to a predicted truncated protein, similar to the human mutations, providing a relevant mouse model. The p.Ile285Argfs*43 and p.Cys300* mutations lead to a shift of Pou3f4 nuclear localization to the cytoplasm, demonstrated in cellular localization studies and in the inner ears of the mutant mice. The discovery of these mutations facilitates a deeper comprehension of the molecular basis of inner ear defects due to mutations in the POU3F4 transcription factor. PMID:23606368

  11. Carcinogenicity of glycidol in F344 rats and B6C3F1 mice.

    PubMed

    Irwin, R D; Eustis, S L; Stefanski, S; Haseman, J K

    1996-01-01

    Glycidol, a simple aliphatic epoxide, was administered by gavage in water to groups of male and female F344/N rats and B6C3F1 mice. Rats received 0, 37.5 or 75 mg kg-1 and mice received 0, 25 or 50 mg kg-1 daily, 5 days per week for 2 years. Exposure to glycidol was associated with dose-related increases in the incidences of neoplasms in numerous tissues in both rats and mice. Survival of rats that received glycidol was markedly reduced compared to the control because of the early induction of neoplastic disease. In male rats, mesothelioma arising in the tunica vaginalis and frequently metastasizing to the peritoneum were considered the major cause of early death. Early deaths in female rats were associated with mammary gland neoplasms. Survival of female mice that received 50 mg kg-1 was lower than the control after week 101 due primarily to euthanasia of moribund animals with mammary gland neoplasms. Survival of male mice and female mice that received 25 mg kg-1 was comparable to the control. In mice, exposure to glycidol was associated with increased incidences of neoplasms of the harderian gland in males and females, the forestomach in males and the mammary gland in females.

  12. Noncollinear magnetization between surface and bulk Y3F e5O12

    NASA Astrophysics Data System (ADS)

    Wu, Po-Hsun; Huang, Ssu-Yen

    2016-07-01

    Yttrium iron garnet (YIG, Y3F e5O12 ) is a magnetic insulator that has been widely used to generate spin-wave spin current via the longitudinal spin Seebeck effect. Spin current can be converted to charge current by the inverse spin Hall effect (ISHE) in an attached metal layer with a spin direction given by the magnetization of the YIG. However, both the ISHE voltage from the thermal transport measurement and the magnetoresistance (MR) from the electrical transport measurement of the metal/YIG structure show a clear plateau behavior in the low-field range, which is inconsistent with the magnetization reversal behavior of the YIG slab. In this work, we provide direct evidences by using the highly sensitive micro-magneto-optic Kerr effect (micro-MOKE) measurement to demonstrate that the plateau behavior in the thermal and electrical transport measurement of metal/YIG is due to the noncollinear magnetization configuration between the bulk and surface of YIG. In addition, keeping the measured surface of YIG unaltered, we show that its surface magnetization can be systematically controlled by varying the thickness. We further demonstrate that the magnetic coupling between the surface magnetization of YIG and an attached ferromagnetic layer exhibits long-range interaction due to the magnetic dipole-dipole interaction.

  13. Benzene-induced hematotoxicity and bone marrow compensation in B6C3F1 mice.

    PubMed

    Farris, G M; Robinson, S N; Gaido, K W; Wong, B A; Wong, V A; Hahn, W P; Shah, R S

    1997-04-01

    Long-term inhalation exposure of benzene has been shown to cause hematotoxicity and an increased incidence of acute myelogenous leukemia in humans. The progression of benzene-induced hematotoxicity and the features of the toxicity that may play a major role in the leukemogenesis are not known. We report the hematological consequences of benzene inhalation in B6C3F1 mice exposed to 1, 5, 10, 100, and 200 ppm benzene for 6 hr/day, 5 days/week for 1, 2, 4, or 8 weeks and a recovery group. There were no significant effects on hematopoietic parameters from exposure to 10 ppm benzene or less. Exposure of mice to 100 and 200 ppm benzene reduced the number of total bone marrow cells, progenitor cells, differentiating hematopoietic cells, and most blood parameters. Replication of primitive progenitor cells in the bone marrow was increased during the exposure period as a compensation for the cytotoxicity induced by 100 and 200 ppm benzene. In mice exposed to 200 ppm benzene, the primitive progenitor cells maintained an increased percentage of cells in S-phase through 25 days of recovery compared with controls. The increased replication of primitive progenitor cells in concert with the reported genotoxicity induced by benzene provides the components necessary for producing an increased incidence of lymphoma in mice. Furthermore, we propose this mode of action as a biologically plausible mechanism for benzene-induced leukemia in humans exposed to high concentrations of benzene.

  14. Sum Rules of Charm C P Asymmetries beyond the SU(3 ) F Limit

    NASA Astrophysics Data System (ADS)

    Müller, Sarah; Nierste, Ulrich; Schacht, Stefan

    2015-12-01

    We find new sum rules between direct C P asymmetries in D meson decays with coefficients that can be determined from a global fit to branching ratio data. Our sum rules eliminate the penguin topologies P and P A , which cannot be determined from branching ratios. In this way, we can make predictions about direct C P asymmetries in the standard model without ad hoc assumptions on the sizes of penguin diagrams. We consistently include first-order SU(3 ) F breaking in the topological amplitudes extracted from the branching ratios. By confronting our sum rules with future precise data from LHCb and Belle II, one will identify or constrain new-physics contributions to P or P A . The first sum rule correlates the C P asymmetries aCP dir in D0→K+K-, D0→π+π- , and D0→π0π0. We study the region of the aCP dir(D0→π+π-)-aCP dir(D0→π0π0) plane allowed by current data and find that our sum rule excludes more than half of the allowed region at 95% C.L. Our second sum rule correlates the direct C P asymmetries in D+→K¯0K+, Ds+→K0π+, and Ds+→K+π0.

  15. Sum Rules of Charm CP Asymmetries beyond the SU(3)_{F} Limit.

    PubMed

    Müller, Sarah; Nierste, Ulrich; Schacht, Stefan

    2015-12-18

    We find new sum rules between direct CP asymmetries in D meson decays with coefficients that can be determined from a global fit to branching ratio data. Our sum rules eliminate the penguin topologies P and PA, which cannot be determined from branching ratios. In this way, we can make predictions about direct CP asymmetries in the standard model without ad hoc assumptions on the sizes of penguin diagrams. We consistently include first-order SU(3)_{F} breaking in the topological amplitudes extracted from the branching ratios. By confronting our sum rules with future precise data from LHCb and Belle II, one will identify or constrain new-physics contributions to P or PA. The first sum rule correlates the CP asymmetries a_{CP}^{dir} in D^{0}→K^{+}K^{-}, D^{0}→π^{+}π^{-}, and D^{0}→π^{0}π^{0}. We study the region of the a_{CP}^{dir}(D^{0}→π^{+}π^{-})-a_{CP}^{dir}(D^{0}→π^{0}π^{0}) plane allowed by current data and find that our sum rule excludes more than half of the allowed region at 95% C.L. Our second sum rule correlates the direct CP asymmetries in D^{+}→K[over ¯]^{0}K^{+}, D_{s}^{+}→K^{0}π^{+}, and D_{s}^{+}→K^{+}π^{0}. PMID:26722915

  16. Sum Rules of Charm CP Asymmetries beyond the SU(3)_{F} Limit.

    PubMed

    Müller, Sarah; Nierste, Ulrich; Schacht, Stefan

    2015-12-18

    We find new sum rules between direct CP asymmetries in D meson decays with coefficients that can be determined from a global fit to branching ratio data. Our sum rules eliminate the penguin topologies P and PA, which cannot be determined from branching ratios. In this way, we can make predictions about direct CP asymmetries in the standard model without ad hoc assumptions on the sizes of penguin diagrams. We consistently include first-order SU(3)_{F} breaking in the topological amplitudes extracted from the branching ratios. By confronting our sum rules with future precise data from LHCb and Belle II, one will identify or constrain new-physics contributions to P or PA. The first sum rule correlates the CP asymmetries a_{CP}^{dir} in D^{0}→K^{+}K^{-}, D^{0}→π^{+}π^{-}, and D^{0}→π^{0}π^{0}. We study the region of the a_{CP}^{dir}(D^{0}→π^{+}π^{-})-a_{CP}^{dir}(D^{0}→π^{0}π^{0}) plane allowed by current data and find that our sum rule excludes more than half of the allowed region at 95% C.L. Our second sum rule correlates the direct CP asymmetries in D^{+}→K[over ¯]^{0}K^{+}, D_{s}^{+}→K^{0}π^{+}, and D_{s}^{+}→K^{+}π^{0}.

  17. Etude des transitions de phases dans les systèmes K 3MO 3F 3- A3MO 3F 3( A= Na, Rb; M= Mo, W)

    NASA Astrophysics Data System (ADS)

    Fouad, M.; Chaminade, J. P.; Ravez, J.; Sadel, A.

    1996-06-01

    RésuméX-ray diffraction, differential thermal analysis, polarized light microscopy, and dielectric measurements have been used to study phase transitions and solid solutions in the K3MO3F3-A3MO3F3(A= Rb, Na;M= Mo, W) systems. K3MO3F3-Na3MO3F3(M= Mo, W) systems show two solid solutions; the first (SSI) nearx= 0 (K3-xNaxMO3F3) involves only one transition atTCwhich is practically independent of composition. The sharp transition atT1(3F3retains cubic symmetry down to 80 K. Rb3MO3F3-K3MO3F3systems show three solid solutions. The SS1 and SS3 exist close to the rubidium and potassium extremes of the binary lines. The pure phases display transitions atT1andTC. For compositions far fromy= 0 ory= 3 (Rb3-yKyMO3F3),TCdecreases andT1decreases abruptly and for SS1 becomes indetectable. The solid solution SS2 (neary= 1) has cubic symmetry down to 80 K forM= W, and a cubic-noncubic transition at low temperature forM= Mo. In any case, the phase transitions are of first order, reversible, and improper character. The transition atTCis ferroelectric, ferroelastic-paraelectric, prototype. The extent of each solid solution depends on the ratio of alcaline cations present in the 6- and 12-fold coordination sites of the perovskite structure. Des techniques expérimentales variées ont permis d'étudier les transitions de phases au sein des différentes solutions solides obtenues dans les systèmes K3MO3F3-A3MO3F3(A= Na, Rb;M= Mo, W): diffraction des rayons X, analyse thermique différentielle, microscopie optique en lumière polarisée. Les systèmes K3MO3F3-Na3MO3F3(M= Mo, W) présentent deux solutions solides. La première (SS1) au voisinage dex= 0 (K3-xNaxMO3F3) ne présente qu'une seule transition àTCqui reste pratiquement constante lorsque la composition varie; la transition qui était franche pourx= 0 àT1

  18. First-principles predicted low-energy structures of NaSc(BH{sub 4}){sub 4}

    SciTech Connect

    Tran, Huan Doan Amsler, Maximilian; Goedecker, Stefan; Botti, Silvana; Marques, Miguel A. L.

    2014-03-28

    According to previous interpretations of experimental data, sodium-scandium double-cation borohydride NaSc(BH{sub 4}){sub 4} crystallizes in the crystallographic space group Cmcm where each sodium (scandium) atom is surrounded by six scandium (sodium) atoms. A careful investigation of this phase based on ab initio calculations indicates that the structure is dynamically unstable and gives rise to an energetically and dynamically more favorable phase with C222{sub 1} symmetry and nearly identical x-ray diffraction pattern. By additionally performing extensive structural searches with the minima-hopping method we discover a class of new low-energy structures exhibiting a novel structural motif in which each sodium (scandium) atom is surrounded by four scandium (sodium) atoms arranged at the corners of either a rectangle with nearly equal sides or a tetrahedron. These new phases are all predicted to be insulators with band gaps of 7.9–8.2 eV. Finally, we estimate the influence of these structures on the hydrogen-storage performance of NaSc(BH{sub 4}){sub 4}.

  19. X-Ray Powder Diffraction Study of Synthetic Palmierite, K{sub 2}Pb(SO{sub 4}){sub 2}

    SciTech Connect

    TISSOT JR.,RALPH G.; RODRIGUEZ,MARK A.; SIPOLA,DIANA L.; VOIGT,JAMES A.

    2000-12-19

    Palmierite (K{sub 2}Pb(SO{sub 4}){sub 2}) has been prepared via a chemical synthesis method. Intensity differences were observed when X-ray powder data from the newly synthesized compound were compared to the published powder diffraction card (PDF) 29-1015 for Palmierite. Investigation of these differences indicated the possibility of preferred orientation and/or chemical inhomogeneity affecting intensities, particularly those of the basal (00{ell}) reflections. Annealing of the Palmierite was found to reduce the effects of preferred orientation. Electron microprobe analysis confirmed K:Pb:S as 2:1:2 for the annealed Palmierite powder. Subsequent least-squares refinement and Rietveld analysis of the annealed powder showed peak intensities very close to that of a calculated Palmierite pattern (based on single crystal data), yet substantially higher than many of the PDF 29-1015 published intensities. Further investigation of peak intensity variation via calculated patterns suggested that the intensity discrepancies between the annealed sample and those found in PDF 29-1015 were potentially due to chemical variation in the K{sub 2}Pb(SO{sub 4}){sub 2} composition. X-ray powder diffraction and crystal data for Palmierite are reported for the annealed sample. Palmierite is Trigonal/Hexagonal with unit cell parameters a = 5.497(1){angstrom}, c = 20.864(2) {angstrom}, space group R-3m (166), and Z = 3.

  20. Nanocrystalline K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}: Eu for proton beam dosimetry

    SciTech Connect

    Bahl, Shaila; Lochab, S. P.; Pandey, A.; Aleynikov, V. E.; Molokanov, A.; Kumar, Pratik

    2012-06-05

    This paper investigates the Thermoluminescent response of nanocrystalline K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}: Eu, prepared by Co-precipitation technique to 150 MeV proton beam. The particle size was calculated to be 45 nm by the broadening of the XRD peaks using Scherrer's formula. Samples in the form of pellets were irradiated by 150 MeV proton beam with dose range of 0.1 Gy to 325 Gy. Thermoluminescence (TL) glow curves of the irradiated samples were recorded and studied. It has been found that the phosphor shows a characteristic single peak at around 420 K. The TL response is linear in the range upto 200 Gy and then saturates for higher doses. The wider linear TL response of nanocrystalline K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}: Eu and low fading makes it a superior candidate as a dosimeter to be used for detecting the doses of protons beams for its various applications in the field of space, therapy and research.

  1. Alignment of CH3F in para-H2 crystal studied by IR quantum cascade laser polarization spectroscopy

    NASA Astrophysics Data System (ADS)

    Kawasaki, Hiroyuki; Mizoguchi, Asao; Kanamori, Hideto

    2016-05-01

    In order to investigate the alignment of CH3F in para-H2 crystals, high resolution polarization spectroscopy of the ν3 vibrational band is studied using a quantum cascade laser at 1040 cm-1. It is found that the main and satellite series of peaks in the ν3 vibrational band of CH3F have the same polarization dependence. This result supports the previously proposed cluster model with ortho-H2 in first and second nearest neighbor sites. The observed polarization dependence function is well described by a simple six-axis void model in which CH3F is not aligned along the c-axis of the crystal but tilted to 64.9(3)° from it.

  2. Alignment of CH3F in para-H2 crystal studied by IR quantum cascade laser polarization spectroscopy.

    PubMed

    Kawasaki, Hiroyuki; Mizoguchi, Asao; Kanamori, Hideto

    2016-05-14

    In order to investigate the alignment of CH3F in para-H2 crystals, high resolution polarization spectroscopy of the ν3 vibrational band is studied using a quantum cascade laser at 1040 cm(-1). It is found that the main and satellite series of peaks in the ν3 vibrational band of CH3F have the same polarization dependence. This result supports the previously proposed cluster model with ortho-H2 in first and second nearest neighbor sites. The observed polarization dependence function is well described by a simple six-axis void model in which CH3F is not aligned along the c-axis of the crystal but tilted to 64.9(3)° from it.

  3. POSTERIOR REVERSIBLE ENCEPHALOPATHY SYNDROME IN NEUROBLASTOMA PATIENTS RECEIVING ANTI-GD2 3F8 MONOCLONAL ANTIBODY

    PubMed Central

    Kushner, Brian H.; Modak, Shakeel; Basu, Ellen M.; Roberts, Stephen S.; Kramer, Kim; Cheung, Nai-Kong V.

    2014-01-01

    Background Posterior reversible encephalopathy syndrome (PRES) comprises clinical and radiologic findings with rapid onset and potentially dire consequences. Patients experience hypertension, seizures, headache, visual disturbance, and/or altered mentation. Magnetic resonance imaging shows edematous changes in brain (especially parietal and occipital lobes). We report PRES associated with anti-GD2 monoclonal antibody (MoAb) immunotherapy which is now standard for high-risk neuroblastoma but has not previously been implicated in PRES. Methods Successive clinical trials using the anti-GD2 MoAb 3F8 for neuroblastoma patients involved multiple cycles of standard-dose 3F8 (SD-3F8) (20 mg/m2/day, x5 days/cycle) or two cycles of high-dose 3F8 (HD-3F8) (80 mg/m2/day, x5 days/cycle) followed by cycles of SD-3F8. Results PRES was diagnosed in 5/215 (2.3%) patients, including 3/160 (1.9%) patients receiving SD-3F8 and 2/55 (3.6%) patients receiving HD-3F8 (p=0.6). All five patients had a rapid return to clinical-radiologic baseline. PRES occurred in 3/26 (11.5%) patients whose prior treatment included external-beam radiotherapy to the brain (2/6 patients status-post total body irradiation plus 1/20 patients status-post craniospinal irradiation) compared to 2/189 (1.1%) patients without prior brain irradiation (p=0.01). Hypertension, which is strongly linked to PRES, reached grade 3 toxicity in 12/215 (5.6%) patients, including the five patients with PRES and seven patients without PRES. Conclusions Patients receiving anti-GD2 MoAb immunotherapy should be closely monitored for, and undergo urgent treatment or evaluation of, symptoms (e.g., hypertension or headaches) that might herald PRES. Prior brain irradiation may be a predisposing factor for PRES with this immunotherapy. PMID:23633099

  4. Thermoluminescence and photoluminescence study of KY3F10:Ho3+ commercial phosphor powder

    NASA Astrophysics Data System (ADS)

    Debelo, N. G.; Dejene, F. B.; Roro, Kittessa

    2016-06-01

    Thermoluminescence (TL) and photoluminescence (PL) properties of KY3F10:Ho3+ phosphor powder is reported. The TL measurements were carried out for different heating rates and for various durations of UV exposure. The TL intensity increases with the duration of UV exposure up to 20 min and then decreases. A decrease of the glow peak height was observed for the glow curves with an increasing heating rate. The area under the TL-time plot is calculated for each heating rate at a constant UV dose and it is found to be constant and independent of the heating rate. It is found that the observed decrement in intensity of each glow curve following an increment in the heating rate is not attributed to the thermal quenching effect. Important TL kinetic parameters namely, the activation energy (E) and the frequency factor (s) were calculated using a variable heating rate (VHR) method. The glow peaks obey first order kinetics. PL emission spectra were also investigated at four main excitation wavelengths; namely, 362, 416, 454 and 486 nm. Green emission at 540 nm and faint red emission at 750 nm were observed for all the excitations. The green emission at 540 nm is ascribed to the 5F4-5I8 and 5S2-5I8 transitions and the faint red emission at 750 nm is due to the 5F4-5I7 and 5S2-5I7 transitions. In addition to the sharp green emission at 540 nm, a broad emission centered at 600 nm was observed for excitation wavelength of 362 nm.

  5. Chronic bioassays of chlorinated humic acids in B6C3F1 mice

    SciTech Connect

    van Duuren, B.L.; Melchionne, S.; Seidman, I.; Pereira, M.A.

    1986-11-01

    Humic acids (Fluka), chlorinated to carbon:chlorine (C:Cl) ratios of 1:1 and 1:0.3, were administered to B6C3F1 mice, 50 males and 50 females per group, in the drinking water at a total organic carbon (TOC) level of 0.5 g/L. The mice were 6 to 8 weeks old at the beginning of the bioassays. The doses used were based on short-term (8 weeks) evaluations for toxicity, palatability, and weight gain. The chronic bioassays included the following control groups: unchlorinated humic acids (0.5 g/L), no-treatment (100 males and 100 females), dibromoethane (DBE, 2.0 mM in drinking water; positive control) and 0.44% sodium chloride in drinking water, i.e., at the same concentration as those receiving chlorinated humic acids. The chlorinated humic acids were prepared freshly and chemically assayed once per week. All chemicals were, with the exception of DBE, administered for 24 months; DBE was administered for 18 months. The volumes of solutions consumed were measured once weekly. All treatment groups showed normal weight gain except the DBE group. No markedly significant increases in tumor incidences were evident in any of the organs and tissues examined in the chlorinated humic acid groups compared to unchlorinated humic acids and the no-treatment control groups. DBE caused the expected high incidence of squamous carcinomas of the forestomach. The chlorinated humic acids tested contained direct-acting alkylating agents, based on their reactivity with p-nitrobenzylpyridine (PNBP), and showed mutagenic activity in S. typhimurium.

  6. Chronic bioassays of chlorinated humic acids in B6C3F1 mice.

    PubMed Central

    Van Duuren, B L; Melchionne, S; Seidman, I; Pereira, M A

    1986-01-01

    Humic acids (Fluka), chlorinated to carbon:chlorine (C:Cl) ratios of 1:1 and 1:0.3, were administered to B6C3F1 mice, 50 males and 50 females per group, in the drinking water at a total organic carbon (TOC) level of 0.5 g/L. The mice were 6 to 8 weeks old at the beginning of the bioassays. The doses used were based on short-term (8 weeks) evaluations for toxicity, palatability, and weight gain. The chronic bioassays included the following control groups: unchlorinated humic acids (0.5 g/L), no-treatment (100 males and 100 females), dibromoethane (DBE, 2.0 mM in drinking water; positive control) and 0.44% sodium chloride in drinking water, i.e., at the same concentration as those receiving chlorinated humic acids. The chlorinated humic acids were prepared freshly and chemically assayed once per week. All chemicals were, with the exception of DBE, administered for 24 months; DBE was administered for 18 months. The volumes of solutions consumed were measured once weekly. All treatment groups showed normal weight gain except the DBE group. At the completion of exposure, the animals were sacrificed and necropsied, and tissue sections were taken for histopathology. No markedly significant increases in tumor incidences were evident in any of the organs and tissues examined in the chlorinated humic acid groups compared to unchlorinated humic acids and the no-treatment control groups. DBE caused the expected high incidence of squamous carcinomas of the forestomach. The chlorinated humic acids tested contained direct-acting alkylating agents, based on their reactivity with p-nitrobenzylpyridine (PNBP), and showed mutagenic activity in S. typhimurium. PMID:2949967

  7. Photoluminescence performance of thulium doped Li{sub 4}SrCa(SiO{sub 4}){sub 2} under irradiation of ultraviolet and vacuum ultraviolet lights

    SciTech Connect

    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.

  8. Crystal structure, thermally stability and photoluminescence properties of novel Sr{sub 10}(PO{sub 4}){sub 6}O:Eu{sup 2+} phosphors

    SciTech Connect

    Guo, Qingfeng; Liao, Libing Mei, Lefu; Liu, Haikun

    2015-03-15

    A series of novel luminescent phosphors Sr{sub 10}(PO{sub 4}){sub 6}O:Eu{sup 2+} with apatite structure were synthesized via a high temperature solid-state reaction. The phase structure, photoluminescence (PL) properties, the PL thermal stability, as well as the fluorescence decay curves of the samples were investigated to characterize the resulting samples, and the selected Sr{sub 9.97}(PO{sub 4}){sub 6}O:0.03Eu{sup 2+} phosphor exhibits strong thermal quenching resistance, retaining the luminance of 88.73% at 150 °C. The quenching concentration of Eu{sup 2+} in Sr{sub 10}(PO{sub 4}){sub 6}O was about 0.03 attributing to the dipole–quadrupole interaction. The Sr{sub 10}(PO{sub 4}){sub 6}O:Eu{sup 2+} phosphor exhibited a broad-band blue emission at 439 nm upon excitation at 346 nm. The results indicate that Sr{sub 10}(PO{sub 4}){sub 6}O:Eu{sup 2+} phosphors have potential applications as near UV-convertible phosphors for white-light UV LEDs. - Graphical abstract: Sr{sub 10}(PO{sub 4}){sub 6}O:Eu{sup 2+} phosphors have potential applications as near UV-convertible phosphors for white-light UV LEDs. - Highlights: • Sr{sub 9.97}(PO{sub 4}){sub 6}O:0.03Eu{sup 2+} phosphor exhibits strong thermal quenching resistance. • Two different Eu{sup 2+} emission centers exists in Sr{sub 10}(PO{sub 4}){sub 6}O. • The activation energy was also estimated for the Eu{sup 2+} luminescence center.

  9. Investigation of the physical properties of the tetragonal CeMAl4sub>Si2 (M = Rh, Ir, Pt) compounds

    SciTech Connect

    Ghimire, N. J.; Ronning, F.; Williams, D. J.; Scott, B. L.; Luo, Yongkang; Thompson, J. D.; Bauer, E. D.

    2014-12-15

    The synthesis, crystal structure and physical properties studied by means of x-ray diffraction, magnetic, thermal and transport measurements of CeMAl4sub>Si2 (M = Rh, Ir, Pt) are reported, along with the electronic structure calculations for LaMAl4sub>Si2 (M = Rh, Ir, Pt). These materials adopt a tetragonal crystal structure (space group P4/mmm) comprised of BaAl4sub> blocks, separated by MAl2 units, stacked along the c-axis. Both CeRhAl4sub>Si2 and CeIrAl4sub>Si2 order antiferromagnetically below TN1 = 14 and 16 K, respectively, and undergo a second antiferromagnetic transitition at lower temperature (TN2 = 9 and 14 K, respectively). CePtAl4sub>Si2 orders ferromagnetically below TC = 3 K with an ordered moment of μsat = 0.8 μB for a magnetic field applied perpendicular to the c-axis. Electronic structure calculations reveal quasi-2D character of the Fermi surface.

  10. Controlled synthesis, characterization and photoluminescence property of olive-like tetragonal α-Nd{sub 2}(MoO{sub 4}){sub 3}

    SciTech Connect

    Zhang, Youjin; Zheng, Ao; Yang, Xiaozhi; He, Hongmei; Fan, Yun

    2012-09-15

    Highlights: ► The olive-like tetragonal α-Nd{sub 2}(MoO{sub 4}){sub 3} was gained with EDTA assisted hydrothermal method. ► The product was characterized by XRD, XPS, FTIR, FESEM, and PL. ► The possible formation mechanism for olive-like α-Nd{sub 2}(MoO{sub 4}){sub 3} was proposed. ► The PL in visible region of the olive-like α-Nd{sub 2}(MoO{sub 4}){sub 3} was studied. -- Abstract: The olive-like tetragonal α-Nd{sub 2}(MoO{sub 4}){sub 3} was obtained by a convenient and facile complex agent assisted hydrothermal method. The product was characterized by X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS), Fourier transform infrared (FTIR) spectroscopy, field-emission scanning electron microscopy (FESEM) and photoluminescence (PL). The possible formation mechanism of the olive-like α-Nd{sub 2}(MoO{sub 4}){sub 3} was proposed. The photoluminescence property in visible region of the olive-like tetragonal α-Nd{sub 2}(MoO{sub 4}){sub 3} was studied.

  11. Synthesis of 9H-furo [2,3-f]Chromene Derivatives by Promoting ZnO Nanoparticles.

    PubMed

    Rostami-Charati, Faramarz; Hossaini, Zinatossadat; Sheikholeslami-Farahani, Fatemeh; Azizi, Zahra; Siadati, Seyyed Amir

    2015-01-01

    Three- component reactions of 1-(6-hydroxy-2-isopropenyl-1-benzofuran-yl)-1-ethanone, aldehydes and malononitrile or ethyl cyanoacetate in the presence of nanoparticles of ZnO as catalyst are explained as effective and green synthetic method for generating 9H- furo[2,3-f]chromenes in good yield. PMID:26004051

  12. Search and Rescue Aircrewman/HH3F Avionics, 2-11. Military Curriculum Materials for Vocational and Technical Education.

    ERIC Educational Resources Information Center

    Ohio State Univ., Columbus. National Center for Research in Vocational Education.

    This self-paced, individualized course, adapted from military curriculum materials for use in vocational and technical education, teaches students the skills needed to become a qualified avionics worker and aircrew rescuer on the HH-3F helicopter. The course materials consist of four pamphlets: two student workbooks and two student syllabuses. The…

  13. Immunotoxicological Profile of Chloroform in Female B6c3f1 Mice When Administered In Drinking Water

    EPA Science Inventory

    Chloroform can be formed as a disinfection by-product during water chlorination, one of the primary modalities for purifying municipal water supplies for human consumption. The goal of this study was to characterize the immunotoxic effects of chloroform in female B6C3F1 mice when...

  14. Evaluation of Radial Flow Fluidized Filter (R3F) Followed by Microfiltration and Ultrafiltration Systems in Calimesa, California

    EPA Science Inventory

    U.S. EPA coordinated a field study with South Mesa Water Utility to look for treatment alternatives for California State Project Water in the small community of Calimesa, California. EPA evaluated the performance of a system comprised of Radial Flow Fluidized Filtration (R3f) fo...

  15. 29 CFR 780.105 - “Primary” and “secondary” agriculture under section 3(f).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 29 Labor 3 2011-07-01 2011-07-01 false âPrimaryâ and âsecondaryâ agriculture under section 3(f... EXEMPTIONS APPLICABLE TO AGRICULTURE, PROCESSING OF AGRICULTURAL COMMODITIES, AND RELATED SUBJECTS UNDER THE FAIR LABOR STANDARDS ACT General Scope of Agriculture Introductory § 780.105 “Primary” and...

  16. Lattice site dependent cathodoluminescence behavior and surface chemical changes in a Sr5(PO4)3F host

    NASA Astrophysics Data System (ADS)

    Nagpure, I. M.; Pitale, Shreyas S.; Coetsee, E.; Ntwaeaborwa, O. M.; Terblans, J. J.; Swart, H. C.

    2012-05-01

    Eu activated Sr5(PO4)3F phosphor powders have been subjected to the electron bombardment at 2 keV (10 μA) at an oxygen pressure of 1×10-6 Torr. The synthesized Sr5(PO4)3F phosphor was identical to the hexagonal apatite structure, with the Sr present at two different sites Cs (S1) and C3 (S2) in the Sr5(PO4)3F host, as inferred from the crystallographic study. Cathodoluminescence (CL) and Auger electron spectroscopy of the phosphor excited by the same electron beam were used to monitor changes in the surface state during prolonged electron bombardment. A direct correlation between the surface reactions and the degradation of the CL brightness was observed. Both C and F were depleted from the surface during electron bombardment. The postulated mechanism for the electron stimulated chemical reactions on the phosphor surface is electron beam dissociation of molecular species to atomic species, which subsequently react with C to form volatile compounds CO2, CH4, etc. and with Sr5(PO4)3F to form a non luminescence layer of metal oxides of Sr and P.

  17. 29 CFR 780.105 - “Primary” and “secondary” agriculture under section 3(f).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 29 Labor 3 2010-07-01 2010-07-01 false âPrimaryâ and âsecondaryâ agriculture under section 3(f). 780.105 Section 780.105 Labor Regulations Relating to Labor (Continued) WAGE AND HOUR DIVISION, DEPARTMENT OF LABOR STATEMENTS OF GENERAL POLICY OR INTERPRETATION NOT DIRECTLY RELATED TO REGULATIONS EXEMPTIONS APPLICABLE TO AGRICULTURE, PROCESSING...

  18. Inhibition of LINE-1 and Alu retrotransposition by exosomes encapsidating APOBEC3G and APOBEC3F.

    PubMed

    Khatua, Atanu K; Taylor, Harry E; Hildreth, James E K; Popik, Waldemar

    2010-04-25

    Human cytidine deaminases, including APOBEC3G (A3G) and A3F, are part of a cellular defense system against retroviruses and retroelements including non-LTR retrotransposons LINE-1 (L1) and Alu. Expression of cellular A3 proteins is sufficient for inhibition of L1 and Alu retrotransposition, but the effect of A3 proteins transferred in exosomes on retroelement mobilization is unknown. Here, we demonstrate for the first time that exosomes secreted by CD4(+)H9 T cells and mature monocyte-derived dendritic cells encapsidate A3G and A3F and inhibit L1 and Alu retrotransposition. A3G is the major contributor to the inhibitory activity of exosomes, however, the contribution of A3F in H9 exosomes cannot be excluded. Additionally, we show that exosomes encapsidate mRNAs coding for A3 proteins. A3G mRNA, and less so A3F, was enriched in exosomes secreted by H9 cells. Exosomal A3G mRNA was functional in vitro. Whether exosomes inhibit retrotransposons in vivo requires further investigation.

  19. A combined diffraction (XRD, electron and neutron) and electrical study of Na 3MoO 3F 3

    NASA Astrophysics Data System (ADS)

    Brink, Frank J.; Norén, Lasse; Goossens, Darren J.; Withers, Ray L.; Liu, Yun; Xu, Chao-Nan

    2003-09-01

    Na 3MoO 3F 3, a member of the A2BMVIO 3F 3 family of elpasolite-related oxyfluorides, has been prepared by the reaction of NaF with MoO 3 at 650°C. It is shown by a combined X-ray, electron and neutron diffraction study, that the true symmetry of Na 3MoO 3F 3 is not monoclinic (pseudo-orthorhombic) as previously reported but instead triclinic (metrically rhombohedral) P1. The superstructure unit cell is given by a=- aR+ bR, b= cR, c=( aR+ bR+ cR), when expressed with respect to the underlying rhombohedral parent structure. Neutron diffraction refinement of the rhombohedral sub-structure shows O and F to be fully ordered with alternate (111) R planes being occupied by O and then F. The nature of the distortion away from the high temperature Fm 3¯m parent structure is consistent with a combination of φφφ type rotations of the octahedral framework together with ppp type displacements of the octahedral cations, which is not observed in any of the closely related A2BMVIO 3F 3 family members. Bond valence arguments are used to give a plausible explanation for this difference in behavior.

  20. Hyperfine interactions of Ho3+ ions in KY3F10: Electron paramagnetic resonance and optical spectroscopy studies

    NASA Astrophysics Data System (ADS)

    Pytalev, D. S.; Chukalina, E. P.; Popova, M. N.; Shakurov, G. S.; Malkin, B. Z.; Korableva, S. L.

    2012-09-01

    We use high-frequency electron paramagnetic resonance (EPR) and high-resolution optical Fourier spectroscopies to characterize hyperfine interactions of the impurity Ho3+ ions in KY3F10 crystals. Well-resolved hyperfine structure is observed in the EPR spectra for several transitions within the ground 5I8 multiplet of the Ho3+ ion and in the optical spectra for many lines in the infrared and visible ranges. The observed hyperfine patterns and field dependences of the resonance frequencies in the EPR spectra are well reproduced by calculations based on the crystal field (CF) theory. This favors reliability of calculated energies and wave functions of the electron-nuclear states within the ground and excited levels of Ho3+ in KY3F10. Finally, the dc magnetic susceptibility of the concentrated KHo3F10 crystal taken from literature is successfully modeled in the temperature range 0.01-20 K, using CF parameters of the impurity Ho3+ ions in KY3F10.

  1. Refractive indices of (NH{sub 4}){sub 2}SO{sub 4} crystals under uniaxial pressure

    SciTech Connect

    Stadnyk, V. Yo. Romanyuk, M. O.; Andrievskii, B. V.; Tuzyak, N. R.

    2009-03-15

    The effect of uniaxial pressure {sigma}{sub m} {<=} 200 bar on the spectral (300-800 nm) and temperature (300-77 K) dependences of the refractive indices of(NH{sub 4}){sub 2}SO{sub 4} crystals has been investigated. The baric dependences of the electronic polarizability, specific refraction, and parameters of the Sellmeier formula have been calculated. It is established that uniaxial pressure increases the refractive indices, mainly because of the narrowing of the band gap, increase in the oscillator density, and redshift of the UV absorption band maximum. The anomalies arising as a result of ferroelectric phase transition are related to the occurrence of spontaneous deformation and polarization (the latter is a superposition of two sublattice polarizations). The spectral and temperature dependences of the piezooptic constants are analyzed and the values of electro-optic coefficients are estimated.

  2. Enhanced Thermoelectric Properties of Cu2ZnSnSe4sub> with Ga-doping

    SciTech Connect

    Wei, Kaya; Beauchemin, Laura; Wang, Hsin; Porter, Wallace D.; Martin, Joshua; Nolas, George S.

    2015-08-10

    Gallium doped Cu2ZnSnSe4sub> quaternary chalcogenides with and without excess Cu were synthesized by elemental reaction and densified using hot pressing in order to investigate their high temperature thermoelectric properties. The resistivity, , and Seebeck coefficient, S, for these materials decrease with increased Ga-doping while both mobility and effective mass increase with Ga doping. The power factor (S2/ρ) therefore increases with Ga-doping. The highest thermoelectric figure of merit (ZT = 0.39 at 700 K) was obtained for the composition that had the lowest thermal conductivity. Our results suggest an approach to achieving optimized thermoelectric properties and are part of the continuing effort to explore different quaternary chalcogenide compositions and structure types, as this class of materials continues to be of interest for thermoelectrics applications.

  3. Ionic liquid assisted microwave synthesis route towards color-tunable luminescence of lanthanide- doped BiPO4sub>

    SciTech Connect

    Cybinska, Joanna; Lorbeer, Chantal; Mudring, Anja -Verena

    2015-07-08

    Ln3+-doped (Ln=Sm, Eu, Tb, Dy) nanoparticles of BiPO4sub> with a particle size below 10 nm were synthesized in a straightforward manner from the appropriate mixture of the respective metal acetates and the task-specific ionic liquids choline or butylammonium dihydrogen-phosphate by conversion in a laboratory microwave (120 °C, 10 min). The ionic liquid acts not only as a solvent and microwave susceptor, but also as the reaction partner and nanoparticle stabilizer. The materials were thoroughly characterized not only with respect to their optical properties but also by PXRD, FT-IR, TEM techniques. Furthermore, depending on the lanthanide, the nanomaterial shows intense luminescence of different colors such as: orange (Sm3+), red (Eu3+), green (Tb3+) or even white (Dy3+).

  4. Luminescent and lasing characteristics of heavily doped Yb{sup 3+}:KY(WO{sub 4}){sub 2} crystals

    SciTech Connect

    Kisel', V E; Troshin, A E; Shcherbitskii, V G; Kuleshov, N V; Pavlyuk, A A; Brunner, F; Paschotta, R; Morier-Genoud, F; Keller, U

    2006-04-30

    The luminescence decay times are measured taking into account reabsorption for KY(WO{sub 4}){sub 2}:Yb(KYW:Yb) crystals with atomic concentrations of active ions from 0.2% to 30%. The radiative lifetime of Yb{sup 3+} ions was measured to be 233 {mu}s. The cw output power of 1.46 and 1.62 W was achieved with the slope efficiency 52% and 47% for Yb:KYW lasers with the atomic concentration of Yb{sup 3+} ions equal to 10% and 30%, respectively. Using a semiconductor mirror with a saturable absorber (SESAM) in the passive mode-locking regime, pulses of duration 194 and 180 fs were obtained at wavelengths of 1042 and 1039 nm for crystals with Yb{sup 3+} concentrations equal to 10% and 30%, respectively, the average output power being 0.63 and 0.75 W. (lasers and amplifiers)

  5. Altered global histone-trimethylation code and H3F3A-ATRX mutation in pediatric GBM.

    PubMed

    Pathak, Pankaj; Jha, Prerana; Purkait, Suvendu; Sharma, Vikas; Suri, Vaishali; Sharma, Mehar C; Faruq, Mohammed; Suri, Ashish; Sarkar, Chitra

    2015-02-01

    Mutations in H3.3-ATRX-DAXX chromatin remodeling pathway have been reported in pediatric GBMs. H3.3 (H3F3A) mutations may affect transcriptional regulation by altered global histone-methylation. Therefore, we analyzed yet partly understood global histone code (H3K-4/9/27/36) trimethylation pattern in H3F3A-ATRX mutants and wild-type. H3F3A, HIST1H3B, IDH1, ATRX, DAXX and Tp53 mutations were identified by sequencing/immunohistochemistry in 27 pediatric GBMs. Global histone-methylation H3K-4/9/27/36me3 and Polycomb-protein EZH2 expression were evaluated by immunohistochemistry. H3F3A-ATRX mutation was observed in 66.7 % (18/27) of pediatric GBMs. K27M and G34R-H3F3A mutations were found in 37 % (10/27) and 14.8 % (4/27) patients respectively. G34V-H3F3A, HIST1H3B and IDH1 mutations were absent. Notably, commonest global histone-methylation mark lost was H3K27me3 (17/25, 68 %) followed by H3K4me3 (45.5 %, 10/22) and H3K9me3 (18.2 %, 4/22). Global H3K36me3 showed no loss. Most significant observation was loss of one or more histone-trimethylation mark in 80 % (20/25) pediatric GBMs. Notably, simultaneous loss of H3K27me3 and H3K4me3 were present in 7/22 (31.8 %) of pediatric GBMs. Low expression of EZH2 was found in 12/24 (50 %) of cases. However no significant correlation of loss of histone-marks or EZH2 expression with H3F3A-ATRX mutants (loss of at least one histone-marks in 87.5 % (14/16) cases) versus wild-types (loss of at least one histone-marks in 75 % (6/8) cases) was seen. The present study highlights for the first time combinatorial loss of one or more histone-trimethylation marks associated with majority of pediatric GBMs and the finding suggests significant role of histone-code in the molecular biology that underlies pediatric GBMs. Hence therapies for patients with particular combinations of histone modifications present opportunity to design innovative patient-tailored treatment protocols. PMID:25479829

  6. Optical emission spectroscopic studies and comparisons of CH{sub 3}F/CO{sub 2} and CH{sub 3}F/O{sub 2} inductively coupled plasmas

    SciTech Connect

    Lou, Qiaowei; Kaler, Sanbir; Donnelly, Vincent M. Economou, Demetre J.

    2015-03-15

    A CH{sub 3}F/CO{sub 2} inductively coupled plasma (ICP), sustained in a compact plasma reactor, was investigated as a function of power (5–400 W) and feed gas composition, at a pressure of 10 mTorr, using optical emission spectroscopy and rare gas actinometry. Number densities of H, F, and O increased rapidly between 74% and 80% CO{sub 2}, ascribed to the transition from polymer-covered to polymer-free reactor walls, similar to that found previously in CH{sub 3}F/O{sub 2} ICPs at 48% O{sub 2}. Below 40% O{sub 2} or CO{sub 2}, relative emission intensity ratios were almost identical for most key species in CH{sub 3}F/O{sub 2} and CH{sub 3}F/CO{sub 2} ICPs except for higher OH/Xe (a qualitative measure of OH and H{sub 2}O densities) over the full range of CH{sub 3}F/O{sub 2} composition. The number density of H, F, and O increased with power in CH{sub 3}F/CO{sub 2} (20%/80%) plasmas (polymer-free walls), reaching 4.0, 0.34, and 1.6 × 10{sup 13}/cm{sup 3}, respectively, at 300 W. The CO number density increased with power and was estimated, based on self-actinometry, to be 8.8 × 10{sup 13}/cm{sup 3} at 300 W. The CO{sub 2} number density was independent of power below 40 W (where very little decomposition occurred), and then decreased rapidly with increasing power, reaching 2.8 × 10{sup 13}/cm{sup 3} at 300 W, corresponding to 83% dissociation. Films deposited on p-Si, 10 cm from the open, downstream end of the plasma reactor, were analyzed by x-ray photoelectron spectroscopy. Between 10% and 40% CO{sub 2} or O{sub 2} addition to CH{sub 3}F, film deposition rates fell and O content in the films increased. Faster deposition rates in CH{sub 3}F/CO{sub 2} plasmas were ascribed mainly to a larger thermodynamic driving force to form solid carbon, compared with CH{sub 3}F/O{sub 2} plasmas. Oxygen content in the films increased with increasing CO{sub 2} or O{sub 2} addition, but for the same deposition rate, no substantial differences were

  7. Synthesis, structural and spectroscopic properties of acentric triple molybdate Cs{sub 2}NaBi(MoO{sub 4}){sub 3}

    SciTech Connect

    Savina, A.A.; Atuchin, V.V.; Solodovnikov, S.F.; Solodovnikova, Z.A.; Krylov, A.S.; Maximovskiy, E.A.; Molokeev, M.S.; Oreshonkov, A.S; Pugachev, A.M.; and others

    2015-05-15

    New ternary molybdate Cs{sub 2}NaBi(MoO{sub 4}){sub 3} is synthesized in the system Na{sub 2}MoO{sub 4}–Cs{sub 2}MoO{sub 4}–Bi{sub 2}(MoO{sub 4}){sub 3}. The structure of Cs{sub 2}NaBi(MoO{sub 4}){sub 3} of a new type is determined in noncentrosymmetric space group R3c, a=10.6435(2), c=40.9524(7) Å, V=4017.71(13) Å{sup 3}, Z=12 in anisotropic approximation for all atoms taking into account racemic twinning. The structure is completely ordered, Mo atoms are tetrahedrally coordinated, Bi(1) and Bi(2) atoms are in octahedra, and Na(1) and Na(2) atoms have a distorted trigonal prismatic coordination. The Cs(1) and Cs(2) atoms are in the framework cavities with coordination numbers 12 and 10, respectively. No phase transitions were found in Cs{sub 2}NaBi(MoO{sub 4}){sub 3} up to the melting point at 826 K. The compound shows an SHG signal, I{sub 2w}/I{sub 2w}(SiO{sub 2})=5 estimated by the powder method. The vibrational properties are evaluated by Raman spectroscopy, and 26 narrow lines are measured. - Graphical abstract: - Highlights: • The crystal structure of Cs{sub 2}NaBi(MoO{sub 4}){sub 3} is defined. • The molybdate Cs{sub 2}NaBi(MoO{sub 4}){sub 3} is stable up to melting point at 826 K. • Vibrational properties of Cs{sub 2}NaBi(MoO{sub 4}){sub 3} are evaluated by Raman spectroscopy.

  8. First-Principles Design of a Deep-Ultraviolet Nonlinear-Optical Crystal from KBe2BO3F2 to NH4Be2BO3F2.

    PubMed

    Kang, Lei; Luo, Siyang; Peng, Guang; Ye, Ning; Wu, Yicheng; Chen, Chuangtian; Lin, Zheshuai

    2015-11-16

    KBe2BO3F2 (KBBF) is so far the sole nonlinear-optical (NLO) material that can be practically applied in the deep-ultraviolet (DUV) region. For the purpose of overcoming its layering tendency in crystal growth, herein a computer-assisted material design system is employed to design a new KBBF analogue, ammonia beryllium fluoroborate (NH4Be2BO3F2, ABBF). The first-principles calculations demonstrate that ABBF possesses NLO properties very close to those of KBBF, thus exhibiting good DUV NLO capability. Moreover, owing to the relatively strong chemical binding between layers, ABBF would have a better growth habit compared with KBBF. Upon synthesis, ABBF would be a very promising DUV NLO material. PMID:26509702

  9. First-Principles Design of a Deep-Ultraviolet Nonlinear-Optical Crystal from KBe2BO3F2 to NH4Be2BO3F2.

    PubMed

    Kang, Lei; Luo, Siyang; Peng, Guang; Ye, Ning; Wu, Yicheng; Chen, Chuangtian; Lin, Zheshuai

    2015-11-16

    KBe2BO3F2 (KBBF) is so far the sole nonlinear-optical (NLO) material that can be practically applied in the deep-ultraviolet (DUV) region. For the purpose of overcoming its layering tendency in crystal growth, herein a computer-assisted material design system is employed to design a new KBBF analogue, ammonia beryllium fluoroborate (NH4Be2BO3F2, ABBF). The first-principles calculations demonstrate that ABBF possesses NLO properties very close to those of KBBF, thus exhibiting good DUV NLO capability. Moreover, owing to the relatively strong chemical binding between layers, ABBF would have a better growth habit compared with KBBF. Upon synthesis, ABBF would be a very promising DUV NLO material.

  10. The mechanism of the area negative thermal expansion in KBe2BO3F2 family crystals: A first-principles study

    NASA Astrophysics Data System (ADS)

    Jiang, Xingxing; Molokeev, Maxim S.; Li, Wei; Wu, Shaofan; Lin, Zheshuai; Wu, Yicheng; Chen, Chuangtian

    2016-02-01

    A very recent study demonstrated that the KBe2BO3F2 (KBBF) family of crystals, including KBBF, RbBe2BO3F2, and CsBe2BO3F2, are the only known borates exhibiting a rarely occurring isotropic area negative thermal expansion (NTE) behavior, over a very large temperature range. In the present work, the NTE mechanism in these crystals is comprehensively investigated using the first-principles calculations. It is revealed that the area NTE behavior mainly originates from the concerted distortion of [BeO3F] tetrahedra in the two-dimensional [Be2BO3F2]∞ framework with respect to temperature, while the [BO3] triangles remain almost rigid. Moreover, the different magnitude of NTE effect in the three crystals is attributed to the interaction difference between the alkali metal atoms (K, Rb, or Cs) and the [Be2BO3F2]∞ layer.

  11. Synthesis, structures and properties of the new lithium cobalt(II) phosphate Li{sub 4}Co(PO{sub 4}){sub 2}

    SciTech Connect

    Glaum, R.; Gerber, K.; Schulz-Dobrick, M.

    2012-04-15

    {alpha}-Li{sub 4}Co(PO{sub 4}){sub 2} has been synthesized and crystallized by solid-state reactions. The new phosphate crystallizes in the monoclinic system (P2{sub 1}/a, Z=4, a=8.117(3) Angstrom-Sign , b=10.303(8) Angstrom-Sign , c=8.118(8) Angstrom-Sign , {beta}=104.36(8) Angstrom-Sign ) and is isotypic to {alpha}-Li{sub 4}Zn(PO{sub 4}){sub 2}. The structure of {alpha}-Li{sub 4}Co(PO{sub 4}){sub 2} has been determined from single-crystal X-ray diffraction data {l_brace}R{sub 1}=0.040, wR{sub 2}=0.135, 2278 unique reflections with F{sub o}>4{sigma}(F{sub o}){r_brace}. The crystal structure, which might be regarded as a superstructure of the wurtzite structure type, is build of layers of regular CoO{sub 4}, PO{sub 4} and Li1O{sub 4} tetrahedra. Lithium atoms Li2, Li3 and Li4 are located between these layers. Thermal investigations by in-situ XRPD, DTA/TG and quenching experiments suggest decomposition followed by formation and phase transformation of Li{sub 4}Co(PO{sub 4}){sub 2}: {alpha}-Li{sub 4}Co(PO{sub 4}){sub 2} Long-Rightwards-Double-Arrow {sup 442 Degree-Sign C}{beta}-Li{sub 3}PO{sub 4}+LiCoPO{sub 4} Rightwards-Harpoon-Over-Leftwards-Harpoon {sup 773 Degree-Sign C}{beta}-Li{sub 4}Co(PO{sub 4}){sub 2} Long-Rightwards-Double-Arrow {sup quenchingto25 Degree-Sign C}{alpha}-Li{sub 4} Co(PO{sub 4}){sub 2} According to HT-XRPD at {theta}=850 Degree-Sign C{beta}-Li{sub 4}Co(PO{sub 4}){sub 2} (Pnma, Z=2, 10.3341(8) A, b=6.5829(5) A, c=5.0428(3) Angstrom-Sign ) is isostructural to {gamma}-Li{sub 3}PO{sub 4}. The powder reflectance spectrum of {alpha}-Li{sub 4}Co(PO{sub 4}){sub 2} shows the typical absorption bands for the tetrahedral chromophore [Co{sup II}O{sub 4}]. - Graphical abstract: The complex formation and decomposition behavior of Li{sub 4}Co(PO{sub 4}){sub 2} with temperature has been elucidated. The crystal structure of its {alpha}-phase was determined from single crystal data, HT-XRPD allowed derivation of a structure model for the {beta}-phase. Both

  12. CuCo2O4sub> ORR/OER Bi-functional catalyst: Influence of synthetic approach on performance

    SciTech Connect

    Serov, Alexey; Andersen, Nalin I.; Roy, Aaron J.; Matanovic, Ivana; Artyushkova, Kateryna; Atanassov, Plamen

    2015-02-07

    A series of CuCo2O4sub> catalysts were synthesized by pore forming, sol-gel, spray pyrolysis and sacrificial support methods. Catalysts were characterized by XRD, SEM, XPS and BET techniques. The electrochemical activity for the oxygen reduction and oxygen evolution reactions (ORR and OER) was evaluated in alkaline media by RRDE. Density Functional Theory was used to identify two different types of active sites responsible for ORR/OER activity of CuCo2O4sub> and it was found that CuCo2O4 sub>can activate the O-O bond by binding molecular oxygen in bridging positions between Co or Co and Cu atoms. It was found that the sacrificial support method (SSM) catalyst has the highest performance in both ORR and OER and has the highest content of phase-pure CuCo2O4sub>. It was shown that the presence of CuO significantly decreases the activity in oxygen reduction and oxygen evolution reactions. As a result, the half-wave potential (E1/2) of CuCo2O4sub>-SSM was found as 0.8 V, making this material a state-of-the-art, unsupported oxide catalyst.

  13. Preparation of porous glass-ceramics with a skeleton of NASICON-type crystal CuTi{sub 2}(PO{sub 4}){sub 3}

    SciTech Connect

    Yamamoto, Kousuke, Kasuga, Toshihiro; Abe, Yoshihiro

    1997-03-01

    A novel porous glass-ceramic with a skeleton of CuTi{sub 2}(PO{sub 4}){sub 3} was prepared by controlled crystallization of a glass and subsequent chemical leaching of the resulting dense glass-ceramic. A volume-crystallized dense glass-ceramic composed of CuTi{sub 2}(PO{sub 4}){sub 3} and Cu{sub 3}(PO{sub 4}){sub 2} whose surface was covered by a CuO thin layer was prepared by reheating a glass with a nominal composition of 50 CuO{center_dot}20TiO{sub 2}{center_dot}30P{sub 2}O{sub 5} (in mol%) glass in air. When the resultant glass-ceramic was leached with dilute H{sub 2}SO{sub 4}, Cu{sub 3}(PO{sub 4}){sub 2} and CuO phases were dissolved out selectively, leaving a crystalline CuTi{sub 2}(PO{sub 4}){sub 3} skeleton. The specific surface area and the average pore radius of the porous glass-ceramic obtained were approximately 45 m{sup 2}{center_dot}g{sup {minus}1} and 9 nm, respectively. The porous glass-ceramic showed catalytic activity in the conversion reaction of propene into acrolein.

  14. Exchange bias effect in Au-Fe3O4sub> dumbbell nanoparticles induced by the charge transfer from gold

    SciTech Connect

    Feygenson, Mikhail; Bauer, John C; Gai, Zheng; Marques, Carlos; Aronson, Meigan C.; Teng, Xiaowei; Su, Dong; Stanic, Vesna; Urban, Volker S; Kevin, Beyer; Dai, Sheng

    2015-08-10

    We have studied the origin of the exchange bias effect in the Au-Fe3O4sub> dumbbell nanoparticles in two samples with different sizes of the Au seed nanoparticles (4.1 and 2.7 nm) and same size of Fe3O4sub> nanoparticles (9.8 nm). The magnetization, small-angle neutron scattering, synchrotron x-ray diffraction and scanning transmission electron microscope measurements determined the antiferromagnetic FeO wüstite phase within Fe3O4sub> nanoparticles, originating at the interface with the Au nanoparticles. The interface between antiferromagnetic FeO and ferrimagnetic Fe3O4sub> is giving rise to the exchange bias effect. The strength of the exchange bias fields depends on the interfacial area and lattice mismatch between both phases. We propose that the charge transfer from the Au nanoparticles is responsible for a partial reduction of the Fe3O4sub> into FeO phase at the interface with Au nanoparticles. The Au-O bonds are formed across the interface to accommodate an excess of oxygen released during the reduction of magnetite.

  15. Structural features of AgCaCdMg{sub 2}(PO{sub 4}){sub 3} and AgCd{sub 2}Mg{sub 2}(PO{sub 4}){sub 3}, two new compounds with the alluaudite-type structure, and their catalytic activity in butan-2-ol conversion

    SciTech Connect

    Kacimi, Mohammed; Ziyad, Mahfoud; Hatert, Frederic . E-mail: fhatert@ulg.ac.be

    2005-04-20

    AgCaCdMg{sub 2}(PO{sub 4}){sub 3} and AgCd{sub 2}Mg{sub 2}(PO{sub 4}){sub 3}, two new compounds with the alluaudite-type structure, were synthesized by a solid state reaction in air at 750 deg. C. The X-ray powder diffraction pattern of AgCaCdMg{sub 2}(PO{sub 4}){sub 3} indicates the presence of small amounts of (Ca, Mg){sub 3}(PO{sub 4}){sub 2} with the whitlockite structure, as impurity, whereas AgCd{sub 2}Mg{sub 2}(PO{sub 4}){sub 3} is constituted by pure alluaudite. The Rietveld refinements of the X-ray powder diffraction patterns indicate an ordered cationic distribution for AgCd{sub 2}Mg{sub 2}(PO{sub 4}){sub 3}, with Ag on A(2)', Cd on A(1) and M(1), and Mg on M(2), whereas a disordered distribution of Cd and Ca between the A(1) and M(1) sites is observed for AgCaCdMg{sub 2}(PO{sub 4}){sub 3}. The catalytic properties of these compounds has been measured in reaction of butan-2-ol dehydrogenation. In the absence of oxygen, both samples exhibit poor dehydrogenation activity. All samples displayed no dehydration activity. Introduction of oxygen into the feed changed totally the catalytic behavior of the catalysts. The production of methyl ethyl ketone increases with time on stream and the reaction temperature. AgCaCdMg{sub 2}(PO{sub 4}){sub 3} is more efficient than AgCd{sub 2}Mg{sub 2}(PO{sub 4}){sub 3}.

  16. Intrinsic Quantum Anomalous Hall Effect in the Kagome Lattice Cs2 LiMn3 F12

    NASA Astrophysics Data System (ADS)

    Xu, Gang; Lian, Biao; Zhang, Shou-Cheng

    2015-10-01

    In a kagome lattice, the time reversal symmetry can be broken by a staggered magnetic flux emerging from ferromagnetic ordering and intrinsic spin-orbit coupling, leading to several well-separated nontrivial Chern bands and intrinsic quantum anomalous Hall effect. Based on this idea and ab initio calculations, we propose the realization of the intrinsic quantum anomalous Hall effect in the single layer Cs2Mn3F12 kagome lattice and on the (001) surface of a Cs2LiMn3F12 single crystal by modifying the carrier coverage on it, where the band gap is around 20 meV. Moreover, a simplified tight binding model based on the in-plane d d σ antibonding states is constructed to understand the topological band structures of the system.

  17. Intrinsic Quantum Anomalous Hall Effect in the Kagome Lattice Cs2 LiMn3 F12

    NASA Astrophysics Data System (ADS)

    Xu, Gang; Lian, Biao; Zhang, Shou-Cheng; Zhang's Group Team

    In a kagome lattice, the time reversal symmetry can be broken by a staggered magnetic flux emerging from the ferromagnetic ordering and intrinsic spin-orbit coupling, leading to several well-separated nontrivial Chern bands and intrinsic quantum anomalous Hall effect. Based on this idea and ab initio calculations, we propose the realization of the intrinsic quantum anomalous Hall effect in the single layer Cs2Mn3F12 kagome lattice and on the (001) surface of a Cs2LiMn3F12 single crystal by modifying the carrier coverage on it, where the band gap is around 20 meV. Moreover, a simplified tight binding model based on the inplane dd σ antibonding states is constructed to understand the topological band structures of the system.

  18. Intrinsic quantum anomalous Hall effect in the kagome lattice Cs2LiMn3F12

    DOE PAGES

    Xu, Gang; Lian, Biao; Zhang, Shou -Cheng

    2015-10-27

    In a kagome lattice, the time reversal symmetry can be broken by a staggered magnetic flux emerging from ferromagnetic ordering and intrinsic spin-orbit coupling, leading to several well-separated nontrivial Chern bands and intrinsic quantum anomalous Hall effect. Based on this idea and ab initio calculations, we propose the realization of the intrinsic quantum anomalous Hall effect in the single layer Cs2Mn3F12 kagome lattice and on the (001) surface of a Cs2LiMn3F12 single crystal by modifying the carrier coverage on it, where the band gap is around 20 meV. Furthermore, a simplified tight binding model based on the in-plane ddσ antibondingmore » states is constructed to understand the topological band structures of the system.« less

  19. Clinically effective monoclonal antibody 3F8 mediates nonoxidative lysis of human neuroectodermal tumor cells by polymorphonuclear leukocytes.

    PubMed

    Kushner, B H; Cheung, N K

    1991-09-15

    Most studies of antibody-dependent cellular cytotoxicity (ADCC) by polymorphonuclear leukocytes (PMN) have supported oxidative lytic processes. This may be because the studies used nonhuman or nonneoplastic cells that were highly sensitive to reactive oxygen species or were small enough to be phagocytosed by PMN. We therefore investigated whether oxygen radicals participate in PMN cytotoxicity toward human neuroectodermal solid tumor cells sensitized by 3F8, which is an anti-ganglioside GD2 murine IgG3 monoclonal antibody with documented anticancer activity in humans. A 4-h 51Cr release assay was used to assess tumor cell lysis by hydrogen peroxide, superoxide, and hypochlorite. Nine of 11 GD2(+) human melanoma and neuroblastoma cell lines had equal or greater resistance to these oxidants as compared to a GD2(-) human carcinoma line (SKBr1-III) found by others (and confirmed by us) to be significantly more resistant to oxidative lysis than a murine cell line (P388D1) representative of those commonly used in cytotoxicity assays. To facilitate detection of oxidant-mediated lysis, subsequent studies of 3F8-mediated ADCC used GD2(+) targets that were relatively sensitive and others that were relatively resistant to oxygen radicals. Normal PMN and PMN obtained from children with chronic granulomatous disease, which do not generate reactive oxygen species, were equally effective in ADCC. Granulocyte-macrophage colony-stimulating factor, which primes oxidative responses of normal but not of chronic granulomatous disease PMN, enhanced ADCC by both kinds of PMN. During ADCC of 3F8-sensitized targets, with or without granulocyte-macrophage colony-stimulating factor, GD2(-) "innocent bystander" tumor cells (including P388D1) were not lysed, a finding consistent with unimportant extracellular release of cytotoxic mediators. Finally, antioxidant and antimyeloperoxidase moieties did not block ADCC. We conclude that oxidants are not key factors in 3F8-mediated lysis by PMN of

  20. Whole-body clearance kinetics and external dosimetry of 131I-3F8 monoclonal antibody for radioimmunotherapy of neuroblastoma.

    PubMed

    Dauer, Lawrence T; St Germain, Jean; Williamson, Matthew J; Zanzonico, Pat; Modak, Shakeel; Cheung, Nai-Kong; Divgi, Chaitanya

    2007-01-01

    The purpose of this retrospective study was to evaluate the whole-body clearance kinetics of I-3F8 monoclonal antibody, an anti-ganglioside 2 antibody, used in the treatment of pediatric patients with late-stage neuroblastoma (NB). Serial whole-body dose rate measurements were obtained on pediatric patients participating in phase I dose escalation studies of therapeutic I-3F8. Whole-body retention fractions were derived and fit for each treatment to exponential curves to determine both the effective half-lives and corresponding clearance fractions. 27 patients were administered I-3F8 over the course of cyclical administrations with a median administered activity of 2.5 GBq (range, 1-8.14 GBq), typically every 2-4 d for up to 9 treatment cycles. Based on whole-body dose rate measurements, there was a large variability in the calculated mono-exponential clearance effective half-life time, with a mean of 26.4 h (range, 12.4-45.5 h). The data from a subset of 12 treatments were fit to a bi-exponential curve with a rapid clearance component mean effective half-time of 16.9 h (range, 4.3-26 h) and a slower clearance component mean effective half-time of 65.5 h (range, 16.9-136 h). The use of whole-body dose rate measurements, obtained for patient-release and other radiation safety considerations, can be useful in estimating whole-body clearance kinetics for photon emitting radionuclide labeled mAbs and other therapeutic radiopharmaceuticals. In the case of I-3F8 for pediatric NB therapy, the demonstrated variability in effective half-time suggests the need for patient-specific tracer dosimetry for both optimization of treatment and radiation safety precaution decision-making.

  1. A sensitive and specific histopathologic prognostic marker for H3F3A K27M mutant pediatric glioblastomas.

    PubMed

    Venneti, Sriram; Santi, Mariarita; Felicella, Michelle Madden; Yarilin, Dmitry; Phillips, Joanna J; Sullivan, Lisa M; Martinez, Daniel; Perry, Arie; Lewis, Peter W; Thompson, Craig B; Judkins, Alexander R

    2014-11-01

    Pediatric glioblastomas (GBM) are highly aggressive and lethal tumors. Recent sequencing studies have shown that ~30 % of pediatric GBM and ~80 % of diffuse intrinsic pontine gliomas show K27M mutations in the H3F3A gene, a variant encoding histone H3.3. H3F3A K27M mutations lead to global reduction in H3K27me3. Our goal was to develop biomarkers for the histopathologic detection of these tumors. Therefore, we evaluated the utility of measuring H3K27me3 global reduction as a histopathologic and prognostic biomarker and tested an antibody directed specifically against the H3.3 K27M mutation in 290 samples. The study cohort included 203 pediatric (including 38 pediatric high-grade astrocytomas) and 38 adult brain tumors of various subtypes and grades and 49 non-neoplastic reactive brain tissues. Detection of H3.3 K27M by immunohistochemistry showed 100 % sensitivity and specificity and was superior to global reduction in H3K27me3 as a biomarker in diagnosing H3F3A K27M mutations. Moreover, cases that stained positive for H3.3 K27M showed a significantly poor prognosis compared to corresponding negative tumors. These results suggest that immunohistochemical detection of H3.3 K27M is a sensitive and specific surrogate for the H3F3A K27M mutation and defines a prognostically poor subset of pediatric GBM. PMID:25200322

  2. Characterization of spectroscopic and laser properties of Pr3+ in Sr5(PO4)3F crystal

    NASA Astrophysics Data System (ADS)

    Sardar, Dhiraj K.; Castano, Francisco

    2002-02-01

    Spectroscopic and laser properties have been characterized for Pr3+ incorporated into Sr5(PO4)3F crystal belonging to the apatite structure family. The standard Judd-Ofelt analysis has been applied to the measured optical absorption intensities to determine the radiative decay rates, branching ratios, and emission cross sections of principal intermanifold transitions of Pr3+ from the 1D2 and 3P0 states to the lower-lying manifolds in the visible region. The measured room temperature fluorescence lifetimes of the 1D2→3H4 (594 nm) and 3P0→3F2 (625 nm) transition are 325 and 105 μs, respectively, while the Judd-Ofelt analysis predicts the radiative lifetimes for the 1D2 and 3P0 states to be 822 and 116 μs, respectively. The room temperature emission cross sections of the 1D2→3H4 and 3P0→3F2 intermanifold transitions have been also determined to be 0.54×10-20 and 4.15×10-20 cm2, respectively.

  3. Measurement of absolute CO number densities in CH3F/O2 plasmas by optical emission self-actinometry

    NASA Astrophysics Data System (ADS)

    Karakas, Erdinc; Kaler, Sanbir; Lou, Qiaowei; Donnelly, Vincent M.; Economou, Demetre J.

    2014-02-01

    CH3F/O2 inductively coupled plasmas at 10 mTorr were investigated using optical emission spectroscopy. A ‘self-actinometry’ method was developed to measure the absolute number density of CO that formed in reactions following dissociation of CH3F and O2 in the plasma. In this method, small amounts of CO were added to the plasma, leading to small increases in the CO emission intensity. By carefully accounting for small perturbations to the plasma electron density and/or electron energy distribution, and by showing that very little of the CO added to the plasma was decomposed by electron impact or other reactions, it was possible to derive absolute number densities for the CO content of the plasma. With equal fractions (0.50) of CH3F and O2 in the feed gas, the CO mole fraction as a function of plasma power saturated at a value of 0.20-0.25. As O2 in the feed gas was varied at a constant power of 100 W, the CO mole fraction went through a maximum of about 0.25 near an O2 feed gas fraction of 0.5. The relative CO number densities determined by ‘standard’ actinometry followed the same functional dependence as the absolute mole fractions determined by self-actinometry, aided by the fact that electron temperature did not change appreciably with power or feed gas composition.

  4. Study of the Ne((3)P2) + CH3F electron-transfer reaction below 1 K.

    PubMed

    Jankunas, Justin; Bertsche, Benjamin; Osterwalder, Andreas

    2014-06-01

    Relatively little is known about the dynamics of electron-transfer reactions at low collision energy. We present a study of Penning ionization of ground-state methyl fluoride molecules by electronically excited neon atoms in the 13 μeV–4.8 meV (150 mK–56 K) collision energy range, using a neutral–neutral merged beam setup. Relative cross sections have been measured for three Ne((3)P2) + CH3F reaction channels by counting the number of CH3F(+), CH2F(+), and CH3(+) product ions as a function of relative velocity between the neon and methyl fluoride molecular beams. Experimental cross sections markedly deviate from the Langevin capture model at collision energies above 20 K. The branching ratios are constant. In other words, the chemical shape of the CH3F molecule, as seen by the Ne((3)P2) atom, appears not to change as the collision energy is varied, in contrast to related Ne((3)PJ) + CH3X (X = Cl and Br) reactions at higher collision energies.

  5. Synthesis and crystal structure of Na{sub 3}NbO(AsO{sub 4}){sub 2}

    SciTech Connect

    Hizaoui, K.; Jouini, T.; Jouini, N.

    1999-04-01

    The compound Na{sub 3}NbO(AsO{sub 4}){sub 2} was prepared by a solid-state reaction. It crystallizes in the monoclinic system, space group P2{sub 1}/n, with a = 9.637(3) {angstrom}, b = 8.509(2) {angstrom}, c = 10.593(2) {angstrom}, {beta} = 108.67(2){degree}, M = 455.72, V = 822.9(4) {angstrom}{sup 3}, Z = 4, {rho} = 3.687 g cm{sup {minus}3}. The crystal structure was refined (137 variables) from 1440 independent reflections collected on a Nonius CAD4 automatic diffractometer with MoK{alpha} radiation. The final R index and weighted wR index are 0.022 and 0.045, respectively. The three-dimensional network is built up from NbO{sub 6} octahedra and AsO{sub 4} tetrahedra-sharing corners; each NbO{sub 6} octahedron is bonded to five AsO{sub 4} tetrahedra. This arrangement delimits three different tunnels running along [100], [010], and [001], respectively, at the intersection of which the sodium ions are located in a six-coordination model. This structure is compared with those of the A{sub 3}MX{sub 2}O{sub 9} (A = Na, K; M = Nb, Sb; X = P, As).

  6. Synthesis and molecular structure of (4 sub 5 )(1,2,3,4,5)ferrocenophane ((4)superferrocenophane)

    SciTech Connect

    Hisatome, Masao; Watanabe, Jun; Kawajiri, Yoshiki; Yamakawa, Koji ); Iitaka, Yoichi )

    1990-02-01

    (4{sub 5})(1,2,3,4,5)Ferrocenophane, which has been given the trivial name (4)superferrocenophane, was synthesized by the stepwise construction of a tetramethylene bridge via formation of a three-carbon bridge followed by bridge enlargement. The {sup 1}H NMR spectrum showed two broad signals for the methylene resonances ({delta} 1.97 and 2.54). No other signal was present. In the {sup 13}C NMR spectrum, only three signals were observed at {delta} 87.31, 28.66, and 25.12, which were assigned to the cyclopentadienyl rings and the {alpha}- and {beta}-methylene carbons, respectively. The absorption band of d-d transition in the visible region shifted to a considerably shorter wavelength (403 nm) as compared with that of ferrocene (443 nm). The crystal structure {alpha} was determined by X-ray diffraction. Compound crystallizes in the tetragonal system, space group I42d with unit cell parameters a = 15.453 (8), c = 18.968 (10) {angstrom}, and Z = 8. The whole shape of is nearly spherical. The thermal vibrations of the {beta}-methylene carbons on the bridges are large and remarkably anisotropic. The distances between the {beta}-carbon and the adjacent carbons are unusually short (1.286 (17)-1.420 (13) {angstrom}).

  7. Compact KGd(WO4sub>)2 picosecond pulse-train synchronously pumped broadband Raman laser.

    PubMed

    Gao, Xiao Qiang; Long, Ming Liang; Meng, Chen

    2016-08-20

    We demonstrate an efficient approach to realizing an extra-cavity, synchronously pumped, stimulated Raman cascaded process under low repetition frequency (1 kHz) pump conditions. We also construct a compact KGd(WO4sub>)2 (KGW) crystal picosecond Raman laser that has been configured as the developed method. A pulse-train green laser pumped the corresponding 70 mm long KGW crystal Raman cavity. The pulse train contains six pulses, about 800 ps separated, for every millisecond; thus, it can realize synchronous pumping between pump pulse and the pumped Raman cavity. The investigated system produced a collinear Raman laser output that includes six laser lines covering the 532 to 800 nm spectra. This is the first report on an all-solid-state, high-average-power picosecond collinear multi-wavelength (more than three laser components) laser to our knowledge. This method has never been reported on before in the synchronously pumped stimulated Raman scattering (SRS) realm. PMID:27556971

  8. Magnetic susceptibility, specific heat and magnetic structure of CuNi{sub 2}(PO{sub 4}){sub 2}

    SciTech Connect

    Escobal, Jaione; Pizarro, Jose L.; Mesa, Jose L. . E-mail: joseluis.mesa@ehu.es; Larranaga, Aitor; Fernandez, Jesus Rodriguez; Arriortua, Maria I.; Rojo, Teofilo

    2006-10-15

    CuNi{sub 2}(PO{sub 4}){sub 2} phosphate has been synthesized by the ceramic method at 800 deg. C in air. The crystal structure consists of a three-dimensional skeleton constructed from MO{sub 4} (M{sup II} =Cu and Ni) planar squares and M{sub 2}O{sub 8} dimers with square pyramidal geometry, which are interconnected by (PO{sub 4}){sup 3-} oxoanions with tetrahedral geometry. The magnetic behavior has been studied on powdered sample by using susceptibility, specific heat and neutron diffraction data. The bimetallic copper(II)-nickel(II) orthophosphate exhibits a three-dimensional magnetic ordering at, approximately, 29.8 K. However, its complex crystal structure hampers any parametrization of the J-exchange parameter. The specific heat measurements exhibit a three-dimensional magnetic ordering ({lambda}-type) peak at 29.5 K. The magnetic structure of this phosphate shows ferromagnetic interactions inside the Ni{sub 2}O{sub 8} dimers, whereas the sublattice of Cu(II) ions presents antiferromagnetic couplings along the y-axis. The change of the sign in the magnetic unit-cell, due to the [1/2, 0, 1/2] propagation vector determines a purely antiferromagnetic structure. - Graphical abstract: Magnetic structure of CuNi2(PO4)2.

  9. X-ray and Neutron Diffraction Studies of Rb{sub 4}LiH{sub 3}(XO{sub 4}){sub 4} (X = S, Se) Single Crystals

    SciTech Connect

    Troyanov, S.I.; Snigireva, E.M.; Ling, C.D.

    2004-11-01

    Rb{sub 4}LiH{sub 3}(SeO{sub 4}){sub 4} single crystals (1) are studied by the X-ray diffraction method at 180 K and Rb{sub 4}LiH{sub 3}(SO{sub 4}){sub 4} single crystals (2a-2c) are studied by the neutron diffraction method at 298 K (2a and 2b) and 480 K (2c). It is established that isostructural single crystals 1 and 2 (sp. gr. P4{sub 1}) have analogous systems of hydrogen bonds: chains of four XO{sub 4} tetrahedra linked by three H bonds with the central bond (2.49 A) being somewhat shorter than the terminal ones (2.52-2.54 A). In the high-temperature 2c phase, the amplitudes of atomic thermal vibrations and the degree of proton disorder in the central hydrogen bond have somewhat elevated values.

  10. Successful Multifold Dose Escalation of Anti-GD2 Monoclonal Antibody 3F8 in Patients With Neuroblastoma: A Phase I Study

    PubMed Central

    Kushner, Brian H.; Kramer, Kim; Modak, Shakeel; Cheung, Nai-Kong V.

    2011-01-01

    Purpose Pain can hinder immunotherapy with anti-GD2 monoclonal antibodies (MoAbs) like 3F8. Heat-modified 3F8 (HM3F8) lacks effector functions and could mask GD2 or cross-reactive epitopes on nerves, thereby preventing a subsequent dose of unmodified 3F8 from activating pain fibers. We hypothesized that 3F8 dose escalation is possible without increased analgesic requirements in patients pretreated with HM3F8. Patients and Methods Thirty patients with resistant neuroblastoma (NB) received one to two cycles of 3F8 plus granulocyte-macrophage colony-stimulating factor. 3F8 dosing began at 20 mg/m2/d and increased by 20 mg/m2/d in the absence of dose-limiting toxicity (DLT). Premedication included analgesics, antihistamines, and 5-minute infusions of HM3F8. On the basis of experience with 3F8 10 mg/m2/d in prior protocols, the DLT of pain was defined as more than seven doses of opioids administered within 2 hours. Opioid use was compared with a contemporary control group treated with 3F8 20 mg/m2/d but no HM3F8. Disease response was assessed. Results Treatment was administered in the outpatient setting. Dose escalation stopped at 160 mg/m2/d because of drug supply limitations; even through this dosage level, analgesic requirements were similar to historical controls, and there were no DLTs. Analgesic requirements at 3F8 dosage levels through 80 mg/m2/d were significantly less compared with controls. Anti-NB activity occurred at all dosages. Conclusion Multifold dose escalation of 3F8 is feasible. The findings can be interpreted as compatible with the possibility that HM3F8 can modify toxicity without blunting anti-NB activity. This pain control strategy may help achieve dose escalation with other anti-GD2 MoAbs. PMID:21343563

  11. Controllable synthesis and down-conversion properties of flower-like NaY(MoO{sub 4}){sub 2} microcrystals via polyvinylpyrrolidone-mediated

    SciTech Connect

    Lin, Han; Yan, Xiaohong; Wang, Xiangfu

    2013-08-15

    Double alkaline rare-earth molybdates NaY(MoO{sub 4}){sub 2} with multilayered flower-like architectures have been successfully synthesized via hydrothermal method in polyvinylpyrrolidone (PVP)-modified processes. The crystal structure and morphology of the obtained products were characterized by X-ray diffraction, scanning electron microscopy (SEM) and transmission electron microscopy (TEM). It was found that reaction time and the amount of PVP have crucial influences on the morphology of the resulting novel microstructures. Under 450 nm excitation, Ho{sup 3+}/Yb{sup 3+} co-doped NaY(MoO{sub 4}){sub 2} samples exhibit 539 nm green emission and 960–1200 nm broadband near-infrared emission, corresponding to the characteristic lines of Ho{sup 3+} and Yb{sup 3+}, respectively. Moreover, increasing Yb{sup 3+} doping enhances the energy transfer efficiency from Ho{sup 3+} to Yb{sup 3+}. - Graphical abstract: Low and high-magnification SEM images demonstrate the perfect flower-like NaY(MoO{sub 4}){sub 2} prepared in the presence of PVP; Detailed TEM and HRTEM images further manifest the single-crystalline feature. Highlights: • NaY(MoO{sub 4}){sub 2} flower-like microstructures were synthesized by hydrothermal method using polyvinylpyrrolidone. • Polyvinylpyrrolidone induces the growth of the NaY(MoO{sub 4}){sub 2} to form multilayered architectures. • Flowerlike NaY(MoO{sub 4}){sub 2}: Ho{sup 3+}, Yb{sup 3+} phosphors were investigated as a downconversion layer candidate.

  12. Oxygen trapped by rare earth tetrahedral clusters in Nd4sub>FeOS6: Crystal structure, electronic structure, and magnetic properties

    SciTech Connect

    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 Nd4sub>FeOS6 were grown from an Fe-S eutectic solution. Single crystal X-ray diffraction analysis revealed a Nd4sub>MnOSe6-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 [Nd4sub>OS3]4+ cubane-like clusters. Oxygen atoms were found to be trapped by Nd4 clusters in the [Nd4OS3]4+ chains. Structural differences among Nd4sub>MnOSe6-type Nd4sub>FeOS6 and the related La3CuSiS7- and Pr8CoGa3-type structures have been described. Magnetic susceptibility measurements on Nd4sub>FeOS6 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.

  13. Calculation of enthalpies of formation of compounds of the type M/sub 5/R(EO/sub 4/)/sub 4/

    SciTech Connect

    Kaganyuk, D.S.; Perepelitsa, A.P.

    1985-12-01

    Enthalpies of formation were determined for compounds of the M/sub 5/R(EO/sub 4/)/sub 4/ type, where M = Li, Na, K, Rb, Cs, Fr, Tl, Ag, Cu; R = the rare earth elements, y, Bi; and E = Mo, W. Values of ..delta..Hf/sup 0/, either experimentally determined or estimated by any quantum-chemical methods, are absent in the literature for these compounds. The obtained values of lambdaHf/sup 0/ for M/sub 5/R(EO/sub 4/)/sub 4/ are presented.

  14. High power, diffraction limited picosecond oscillator based on Nd:GdVO4sub> bulk crystal with σ polarized in-band pumping.

    PubMed

    Lin, Hua; Guo, Jie; Gao, Peng; Yu, Hai; Liang, Xiaoyan

    2016-06-27

    We report on a high power passively mode-locked picosecond oscillator based on Nd:GdVO4sub> crystal with σ polarized in-band pumping. Thermal gradient and thermal aberration was greatly decreased with proposed configuration. Maximum output power of 37 W at 81 MHz repetition rate with 19.3 ps pulse duration was achieved directly from Nd:GdVO4sub> oscillator, corresponding to 51% optical efficiency. The oscillator maintained diffraction limited beam quality of M2 < 1.05 at different output coupling with pulse duration between 11.2 ps to 19.3 ps.

  15. Electrorheological properties and structure of (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2})

    SciTech Connect

    Hou Jiaxiang; Shi Lei . E-mail: shil@ustc.edu.cn; Zhu Qingren

    2006-06-15

    The core-shell structural (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2}) samples of giant electrorheological (ER) activity have been synthesized by a sol-gel method and studied by TEM, X-ray diffraction and IR spectroscopy. From the analysis of the X-ray diffraction, it is found that the component of samples is (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2}) with a different content of urea. The observations of the TEM morphology show that (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2}) particles are spheral with a size of around 80 nm and a surface coating with 5-10 nm thickness consisting of urea. The samples show an increasing tend of ER effect as the addition of urea increasing. Moreover, by IR spectroscopy study, it is revealed that some peaks of C=O band and C-O band vibrations of BaTiO(C{sub 2}O{sub 4}){sub 2} are split into two peaks after urea added. The extent of the splits increase with the increase of urea content, which is resulted by the interaction between the chemical bonds of urea and oxalate of BaTiO(C{sub 2}O{sub 4}){sub 2}. It is evident that the giant ER activity of the sample has a close relationship with the interfacial polarization between the core and the shell of (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2}). - Graphical abstract: TEM images of (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2}) particles show the thickness of shell increasing as the urea addition increasing. The enhancement of giant ER activity relate with the increasing interfacial polarization of the core-shell structural (BaTiO(C{sub 2}O{sub 4}){sub 2}/NH{sub 2}CONH{sub 2})

  16. Photoluminescence and thermoluminescence properties of Tb{sup 3+} doped K{sub 3}Gd(PO{sub 4}){sub 2} nanophosphor

    SciTech Connect

    Gupta, Palvi; Bedyal, A.K.; Kumar, Vinay; Khajuria, Y.; Lochab, S.P.; Pitale, S.S.; Ntwaeaborwa, O.M.; Swart, H.C.

    2014-12-15

    Energy level diagram of Tb{sup 3+} ion in the K{sub 3}Gd(PO{sub 4}){sub 2} host lattice. - Highlights: • First time, a detailed TL and PL study on undoped and Tb{sup 3+} doped K{sub 3}Gd(PO{sub 4}){sub 2} nanophosphor. • Combustion method was employed to synthesize the Tb{sup 3+} doped K{sub 3}Gd(PO{sub 4}){sub 2} nanophosphor. • Mechanism of excitation and emission in undoped and Tb{sup 3+} doped K{sub 3}Gd(PO{sub 4}){sub 2} nanophosphor was given. - Abstract: Tb{sup 3+} doped nanoparticulate K{sub 3}Gd(PO{sub 4}){sub 2} phosphor was prepared by combustion method using urea as a fuel. The structure, optical and luminescent properties of the phosphor were studied by X-ray diffraction (XRD), scanning electron microscopy (SEM), diffuse reflectance spectroscopy (DRS), photoluminescence spectroscopy (PL), and thermoluminescence (TL) spectroscopy. In undoped K{sub 3}Gd(PO{sub 4}){sub 2}, the excitation and emission peaks at 273 nm and 323 nm belongs to the {sup 8}S{sub 7/2} → {sup 6}I{sub J(J=7/2)} and {sup 6}P{sub J(J=7/2)} → {sup 8} S{sub 7/2} transitions of Gd{sup 3+} while green emission was observed in the Tb{sup 3+} doped K{sub 3}Gd(PO{sub 4}){sub 2}. TL study was carried out after exposing the samples to γ-radiations (0.1–5 kGy) in the K{sub 3}Gd(PO{sub 4}){sub 2}:Tb{sup 3+} (1.5 mol%). The calculated kinetic parameters were compared with different methods. The band gap of the phosphor was estimated as 5.80 eV. The green shade of the Tb{sup 3+} ion with the CIE coordinates (x, y) as (0.29, 0.54) was in good agreement with the well known green phosphors.

  17. Synthesis, crystal structure and spectroscopy properties of Na{sub 3} AZr(PO{sub 4}){sub 3} (A=Mg, Ni) and Li{sub 2.6}Na{sub 0.4}NiZr(PO{sub 4}){sub 3} phosphates

    SciTech Connect

    Chakir, M. . E-mail: fachakir@yahoo.fr; El Jazouli, A.; Waal, D. de

    2006-06-15

    Na{sub 3} AZr(PO{sub 4}){sub 3} (A=Mg, Ni) phosphates were prepared at 750 deg. C by coprecipitation route. Their crystal structures have been refined at room temperature from X-ray powder diffraction data using Rietveld method. Li{sub 2.6}Na{sub 0.4}NiZr(PO{sub 4}){sub 3} was synthesized through ion exchange from the sodium analog. These materials belong to the Nasicon-type structure. Raman spectra of Na{sub 3} AZr(PO{sub 4}){sub 3} (A=Mg, Ni) phosphates present broad peaks in favor of the statistical distribution in the sites around PO{sub 4} tetrahedra. Diffuse reflectance spectra indicate the presence of octahedrally coordinated Ni{sup 2+} ions. - Graphical abstract: Structure of Na{sub 3} AZr(PO{sub 4}){sub 3} (A=Mg, Ni) phosphates. Display Omitted.

  18. Magnetic structures of R5Ni2In4sub> and R11Ni4sub>In9 ( R = Tb and Ho): Strong hierarchy in the temperature dependence of the magnetic ordering in the multiple rare-earth sublattices

    SciTech Connect

    Ritter, C.; Provino, A.; Manfrinetti, P.; Pecharsky, V. K.; Gschneidner, Jr., K. A.; Dhar, S. K.

    2015-11-09

    In this study, the magnetic properties and magnetic structures of the R5Ni2In4sub> and the microfibrous R 11Ni4sub>In9 compounds with R = Tb and Ho have been examined using magnetization, heat capacity, and neutron diffraction data. Rare earth atoms occupy three and five symmetrically inequivalent rare earth sites in R5Ni2In4sub> and R 11Ni4sub>In9 compounds, respectively. As a result of the intra- and inter-magnetic sublattice interactions, the magnetic exchange interactions are different for various rare earth sites; this leads to a cascade of magnetic transitions with a strong hierarchy in the temperature dependence of the magnetic orderings.

  19. CARCINOGENICITY OF BROMODICHLOROMETHANE ADMINISTERED IN DRINKING WATER TO THE MALE F344/N RAT AND B6C3F, MOUSE

    EPA Science Inventory

    CARCINOGENICITY OF BROMODICHLOROMETHANE ADMINISTERED IN DRINKING WATER TO THE MALE F344/N RAT AND B6C3F1 MOUSE.

    Bromodichloromethane (BDCM) has been shown to produce kidney and large bowel tumors in both male and female F344/N rats, kidney tumors in male B6C3F 1 mice and ...

  20. Phase transition and multicolor luminescence of Eu{sup 2+}/Mn{sup 2+}-activated Ca{sub 3}(PO{sub 4}){sub 2} phosphors

    SciTech Connect

    Li, Kai; Chen, Daqin; Xu, Ju; Zhang, Rui; Yu, Yunlong; Wang, Yuansheng

    2014-01-01

    Graphical abstract: We have synthesized Eu{sup 2+} doped and Eu{sup 2+}/Mn{sup 2+} co-doped Ca{sub 3}(PO{sub 4}){sub 2} phosphors. The emitting color varies from blue to green with increasing of Eu{sup 2+} content for the Eu{sup 2+}-doped phosphor, and the quantum yield of the 0.05Eu{sup 2+}: Ca{sub 2.95}(PO{sub 4}){sub 2} sample reaches 56.7%. Interestingly, Mn{sup 2+} co-doping into Eu{sup 2+}: Ca{sub 3}(PO{sub 4}){sub 2} leads to its phase transition from orthorhombic to rhombohedral, and subsequently generates tunable multi-color luminescence from green to red via Eu{sup 2+} → Mn{sup 2+} energy transfer. - Highlights: • A series of novel Eu{sup 2+}: Ca{sub 3}(PO{sub 4}){sub 2} phosphors were successfully synthesized. • Phase transition of Ca{sub 3}(PO{sub 4}){sub 2} from orthorhombic to rhombohedral occurred when Mn{sup 2+} ions were doped. • The phosphors exhibited tunable multi-color luminescence. • The quantum yield of 0.05Eu{sup 2+}: Ca{sub 2.95}(PO{sub 4}){sub 2} phosphor can reach 56.7%. • The analyses of phosphors were carried out by many measurements. - Abstract: Intense blue-green-emitting Eu{sup 2+}: Ca{sub 3}(PO{sub 4}){sub 2} and tunable multicolor-emitting Eu{sup 2+}/Mn{sup 2+}: Ca{sub 3}(PO{sub 4}){sub 2} phosphors are prepared via a solid-state reaction route. Eu{sup 2+}-doped orthorhombic Ca{sub 3}(PO{sub 4}){sub 2} phosphor exhibits a broad emission band in the wavelength range of 400–700 nm with a maximum quantum yield of 56.7%, and the emission peak red-shifts gradually from 479 to 520 nm with increase of Eu{sup 2+} doping content. Broad excitation spectrum (250–420 nm) of Eu{sup 2+}: Ca{sub 3}(PO{sub 4}){sub 2} matches well with the near-ultraviolet LED chip, indicating its potential applications as tri-color phosphors in white LEDs. Interestingly, Mn{sup 2+} co-doping into Eu{sup 2+}: Ca{sub 3}(PO{sub 4}){sub 2} leads to its phase transition from orthorhombic to rhombohedral, and subsequently generates tunable multi

  1. The Tumor Suppressive Role of eIF3f and Its Function in Translation Inhibition and rRNA Degradation

    PubMed Central

    Wen, Fushi; Zhou, Renyuan; Shen, Alex; Choi, Andrew; Uribe, Diana; Shi, Jiaqi

    2012-01-01

    Deregulated translation plays an important role in human cancer. We previously reported decreased eukaryotic initiation factor 3 subunit f (eIF3f) expression in pancreatic cancer. Whether decreased eIF3f expression can transform normal epithelial cells is not known. In our current study, we found evidence that stable knockdown of eIF3f in normal human pancreatic ductal epithelial cells increased cell size, nuclear pleomorphism, cytokinesis defects, cell proliferation, clonogenicity, apoptotic resistance, migration, and formation of 3-dimensional irregular masses. Our findings support the tumor suppressive role of eIF3f in pancreatic cancer. Mechanistically, we found that eIF3f inhibited both cap-dependent and cap-independent translation. An increase in the ribosomal RNA (rRNA) level was suggested to promote the generation of cancer. The regulatory mechanism of rRNA degradation in mammals is not well understood. We demonstrated here that eIF3f promotes rRNA degradation through direct interaction with heterogeneous nuclear ribonucleoprotein (hnRNP) K. We showed that hnRNP K is required for maintaining rRNA stability: under stress conditions, eIF3f dissociates hnRNP K from rRNA, thereby preventing it from protecting rRNA from degradation. We also demonstrated that rRNA degradation occurred in non-P body, non-stress granule cytoplasmic foci that contain eIF3f. Our findings established a new mechanism of rRNA decay regulation mediated by hnRNP K/eIF3f and suggest that the tumor suppressive function of eIF3f may link to impaired rRNA degradation and translation. PMID:22457825

  2. Humanizing murine IgG3 anti-GD2 antibody m3F8 substantially improves antibody-dependent cell-mediated cytotoxicity while retaining targeting in vivo

    PubMed Central

    Cheung, Nai-Kong V.; Guo, Hongfen; Hu, Jian; Tassev, Dimiter V.; Cheung, Irene Y.

    2012-01-01

    Murine IgG3 anti-GD2 antibody m3F8 has shown anti-neuroblastoma activity in Phase I/II studies, where antibody-dependent cell-mediated cytotoxicity (ADCC) played a key role. Humanization of m3F8 should circumvent human anti-mouse antibody (HAMA) response and enhance its ADCC properties to reduce dosing and pain side effect. Chimeric 3F8 (ch3F8) and humanized 3F8 (hu3F8-IgG1 and hu3F8-IgG4) were produced and purified by protein A affinity chromatography. In vitro comparison was made with m3F8 and other anti-GD2 antibodies in binding, cytotoxicity, and cross-reactivity assays. In GD2 binding studies by SPR, ch3F8 and hu3F8 maintained KD comparable to m3F8. Unlike other anti-GD2 antibodies, m3F8, ch3F8 and hu3F8 had substantially slower koff.. Similar to m3F8, both ch3F8 and hu3F8 inhibited tumor cell growth in vitro, while cross-reactivity with other gangliosides was comparable to that of m3F8. Both peripheral blood mononuclear cell (PBMC)-ADCC and polymorphonuclear leukocytes (PMN)-ADCC of ch3F8 and hu3F8-IgG1 were more potent than m3F8. This superiority was consistently observed in ADCC assays, irrespective of donors or NK-92MI-transfected human CD16 or CD32, whereas complement mediated cytotoxicity (CMC) was reduced. As expected, hu3F8-IgG4 had near absent PBMC-ADCC and CMC. Hu3F8 and m3F8 had similar tumor-to-non tumor ratios in biodistribution studies. Anti-tumor effect against neuroblastoma xenografts was better with hu3F8-IgG1 than m3F8. In conclusion, humanizing m3F8 produced next generation anti-GD2 antibodies with substantially more potent ADCC in vitro and anti-tumor activity in vivo. By leveraging ADCC over CMC, they may be clinically more effective, while minimizing pain and HAMA side effects. A Phase I trial using hu3F8-IgG1 is ongoing. PMID:22754766

  3. Solvothermal synthesis of monodispersed CoZr{sub 4}(PO{sub 4}){sub 6} microspheres and their application as microwave absorber

    SciTech Connect

    Chen, Tingting; Sun, Genban; Ma, Shulan; Yang, Xiaojing; Hu, Changwen

    2012-03-15

    Graphical abstract: Monodispersed CoZr{sub 4}(PO{sub 4}){sub 6} porous microspheres with shell structure were synthesized via a combined solvothermal method and calcination route. The radar-wave absorbability of the purple sample calcined at 900 Degree-Sign C was strongest at the frequency of about 8.5 GHz. Highlights: Black-Right-Pointing-Pointer In this study we synthesized monodispersed CoZr{sub 4}(PO{sub 4}){sub 6} porous microspheres as microwave absorber. Black-Right-Pointing-Pointer The relationship between microstructures and the electromagnetic properties was indicated. Black-Right-Pointing-Pointer The radar-wave absorbability of the sample was included. -- Abstract: Monodispersed CoZr{sub 4}(PO{sub 4}){sub 6} microspheres with a diameter of 40 {mu}m were achieved via a combining solvothermal and calcination route. The crystallinity of the calcined microspheres with shell structure was improved, while the monodisperse property and morphologies remained. The possible formation mechanism of the porous CoZr{sub 4}(PO{sub 4}){sub 6} microspheres with nanoshell was proposed. The samples were characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM), Fourier transform infrared spectra (FT-IR) technologies, thermal analysis (TG and DSC), nitrogen adsorption-desorption isotherms and network analyzer. The sample calcined at 900 Degree-Sign C shows a strongest absorbability in the radar-wave absorbability test.

  4. Diagrammatic Separation of Different Crystal Structures of A2BX4sub> Compounds Without Energy Minimization. A Pseudopotential Orbital Radii Approach

    SciTech Connect

    Zhang, Xiuwen; Zunger, Alex

    2010-05-18

    The A2BX4sub> family of compounds manifest a wide range of physical properties, including transparent conductivity, ferromagnetism, and superconductivity. A 98% successful diagrammatic separation of the 44 different crystal structures of 688 oxide A2BX4sub> compounds (96% for 266 oxide-only) is described by plotting the total radius of the A atom RA versus the radius of the B atom RB for many A2BX4sub> compounds of known structure types and seeking heuristically simple, straight boundaries in the RA versus RB plane that best separate the domains of different structure types. The radii are sums RA = Rs(A) + Rp(A) of the quantum-mechanically calculated “orbital radii” Rs(Rp), rather than empirical radii or phenomenological electronegativity scales. These success rates using first-principles orbital radii uniformly exceed the success rates using classic radii. Such maps afford a quick guess of the crystal structure of a yet unmade A2BX4sub> compound by placing its atomic orbital radii on such maps and reading off its structure type.

  5. Low Temperature Propane Oxidation over Co3O4sub> based Nano-array Catalysts. Ni Dopant Effect, Reaction Mechanism and Structural Stability

    SciTech Connect

    Ren, Zheng; Wu, Zili; Gao, Puxian; Song, Wenqiao; Xiao, Wen; Guo, Yanbing; Ding, Jun; Suib, Steven L.; Gao, Pu-Xian

    2015-06-09

    Low temperature propane oxidation has been achieved by Co3O4sub>-based nano-array catalysts featuring low catalytic materials loading. The Ni doping into the Co3O4sub> lattice has led to enhanced reaction kinetics at low temperature by promoting the surface lattice oxygen activity. In situ DRIFTS investigation in tandem with isotopic oxygen exchange reveals that the propane oxidation proceeds via Mars-van Krevelen mechanism where surface lattice oxygen acts as the active site whereas O2 in the reaction feed does not directly participate in CO2 formation. The Ni doping promotes the formation of less stable carbonates on the surface to facilitate the CO2 desorption. The thermal stability of Ni doped Co3O4sub> decreases with increased Ni concentration while catalytic activity increases. A balance between enhanced activity and compromised thermal stability shall be considered in the Ni doped Co3O4sub> nano-array catalysts for low temperature hydrocarbon oxidation. This study provides useful and timely guidance for rational catalyst design toward low temperature catalytic oxidation.

  6. Highly Selective Colorimetric and Luminescence Response of a Square-Planar Platinum(II) Terpyridyl Complex to Aqueous TcO4sub>-

    SciTech Connect

    Chatterjee, Sayandev; Norton, Amie E.; Edwards, Matthew K.; Peterson, James M.; Taylor, Stephen D.; Bryan, Samuel A.; Andersen, Amity; Govind, Niranjan; Albrecht-Schmitt, Thomas E.; Connick, William; Levitskaia, Tatiana G.

    2015-10-08

    In an effort to address the need for a rapid, selective and economical detection technique for aqueous pertechnetate (TcO4sub>-) anion based on recognition at the molecular level, simple salts of transition metal complexes that undergo a distinct spectroscopic change upon exposure to aqueous anions were explored. The Pt(II) complex [Pt(tpy)Br]SbF6 (tpy=2,2';6',2"-terpyridine) undergoes a dramatic color change and intense luminescence response upon TcO4sub>- uptake due to concomitant enhancement of Pt•••Pt interactions. The spectroscopic response was highly selective and quantitative for aqueous TcO4sub>- among other competing anions. Complimentary Raman spectroscopy and microscopy techniques, structural determination and theoretical methods were employed to achieve molecular-level understanding of the mechanism of the response to aqueous TcO4sub>-.

  7. Single phase melt processed powellite (Ba,Ca)MoO4sub> for the immobilization of Mo-rich nuclear waste

    SciTech Connect

    Brinkman, Kyle; Fox, Kevin M.; Marra, James C.; Reppert, Jason; Crum, Jarrod V.; Tang, Ming

    2012-10-02

    Crystalline and glass composite materials are currently being investigated for the immobilization of combined High Level Waste (HLW) streams resulting from potential commercial fuel reprocessing scenarios. Several of these potential waste streams contain elevated levels of transition metal elements such as molybdenum (Mo). Molybdenum has limited solubility in typical silicate glasses used for nuclear waste immobilization. Under certain chemical and controlled cooling conditions, a powellite (Ba,Ca)MoO4sub> crystalline structure can be formed by reaction with alkaline earth elements. In this study, single phase BaMoO4sub> and CaMoO4sub> were formed from carbonate and oxide precursors demonstrating the viability of Mo incorporation into glass, crystalline or glass composite materials by a melt and crystallization process. X-ray diffraction, photoluminescence, and Raman spectroscopy indicated a long range ordered crystalline structure. In situ electron irradiation studies indicated that both CaMoO4 and BaMoO4sub> powellite phases exhibit radiation stability up to 1000 years at anticipated doses with a crystalline to amorphous transition observed after 1 x 1013 Gy. Aqueous durability determined from product consistency tests (PCT) showed low normalized release rates for Ba, Ca, and Mo (<0.05 g/m2).

  8. APOBEC3D and APOBEC3F potently promote HIV-1 diversification and evolution in humanized mouse model.

    PubMed

    Sato, Kei; Takeuchi, Junko S; Misawa, Naoko; Izumi, Taisuke; Kobayashi, Tomoko; Kimura, Yuichi; Iwami, Shingo; Takaori-Kondo, Akifumi; Hu, Wei-Shau; Aihara, Kazuyuki; Ito, Mamoru; An, Dong Sung; Pathak, Vinay K; Koyanagi, Yoshio

    2014-10-01

    Several APOBEC3 proteins, particularly APOBEC3D, APOBEC3F, and APOBEC3G, induce G-to-A hypermutations in HIV-1 genome, and abrogate viral replication in experimental systems, but their relative contributions to controlling viral replication and viral genetic variation in vivo have not been elucidated. On the other hand, an HIV-1-encoded protein, Vif, can degrade these APOBEC3 proteins via a ubiquitin/proteasome pathway. Although APOBEC3 proteins have been widely considered as potent restriction factors against HIV-1, it remains unclear which endogenous APOBEC3 protein(s) affect HIV-1 propagation in vivo. Here we use a humanized mouse model and HIV-1 with mutations in Vif motifs that are responsible for specific APOBEC3 interactions, DRMR/AAAA (4A) or YRHHY/AAAAA (5A), and demonstrate that endogenous APOBEC3D/F and APOBEC3G exert strong anti-HIV-1 activity in vivo. We also show that the growth kinetics of 4A HIV-1 negatively correlated with the expression level of APOBEC3F. Moreover, single genome sequencing analyses of viral RNA in plasma of infected mice reveal that 4A HIV-1 is specifically and significantly diversified. Furthermore, a mutated virus that is capable of using both CCR5 and CXCR4 as entry coreceptor is specifically detected in 4A HIV-1-infected mice. Taken together, our results demonstrate that APOBEC3D/F and APOBEC3G fundamentally work as restriction factors against HIV-1 in vivo, but at the same time, that APOBEC3D and APOBEC3F are capable of promoting viral diversification and evolution in vivo.

  9. Topological amplitudes in D decays to two pseudoscalars: A global analysis with linear S U (3 )F breaking

    NASA Astrophysics Data System (ADS)

    Müller, Sarah; Nierste, Ulrich; Schacht, Stefan

    2015-07-01

    We study decays of D0, D+, and Ds+ mesons into two pseudoscalar mesons by expressing the decay amplitudes in terms of topological amplitudes. Including consistently S U (3 )F breaking to linear order, we show how the topological-amplitude decomposition can be mapped onto the standard expansion using reduced amplitudes characterized by S U (3 ) representations. The tree and annihilation amplitudes can be calculated in factorization up to corrections which are quadratic in the color-counting parameter 1 /Nc. We find new sum rules connecting D+→KSK+ , Ds+→KSπ+, and D+→K+π0, which test the quality of the 1 /Nc expansion. Subsequently, we determine the topological amplitudes in a global fit to the data, taking the statistical correlations among the various measurements into account. We carry out likelihood ratio tests in order to quantify the role of specific topological contributions. While the S U (3 )F limit is excluded with a significance of more than 5 standard deviations, a good fit (with Δ χ2<1 ) can be obtained with less than 28% of S U (3 )F breaking in the decay amplitudes. The magnitude of the penguin amplitude Pbreak, which probes the Glashow-Iliopoulos-Maiani mechanism, is consistent with zero; the hypothesis Pbreak=0 is rejected with a significance of just 0.7 σ . We obtain the Standard-Model correlation between B (D0→KLπ0) and B (D0→KSπ0), which probes doubly Cabibbo-suppressed amplitudes, and find that B (D0→KLπ0)

  10. APOBEC3D and APOBEC3F Potently Promote HIV-1 Diversification and Evolution in Humanized Mouse Model

    PubMed Central

    Misawa, Naoko; Izumi, Taisuke; Kobayashi, Tomoko; Kimura, Yuichi; Iwami, Shingo; Takaori-Kondo, Akifumi; Hu, Wei-Shau; Aihara, Kazuyuki; Ito, Mamoru; An, Dong Sung; Pathak, Vinay K.; Koyanagi, Yoshio

    2014-01-01

    Several APOBEC3 proteins, particularly APOBEC3D, APOBEC3F, and APOBEC3G, induce G-to-A hypermutations in HIV-1 genome, and abrogate viral replication in experimental systems, but their relative contributions to controlling viral replication and viral genetic variation in vivo have not been elucidated. On the other hand, an HIV-1-encoded protein, Vif, can degrade these APOBEC3 proteins via a ubiquitin/proteasome pathway. Although APOBEC3 proteins have been widely considered as potent restriction factors against HIV-1, it remains unclear which endogenous APOBEC3 protein(s) affect HIV-1 propagation in vivo. Here we use a humanized mouse model and HIV-1 with mutations in Vif motifs that are responsible for specific APOBEC3 interactions, DRMR/AAAA (4A) or YRHHY/AAAAA (5A), and demonstrate that endogenous APOBEC3D/F and APOBEC3G exert strong anti-HIV-1 activity in vivo. We also show that the growth kinetics of 4A HIV-1 negatively correlated with the expression level of APOBEC3F. Moreover, single genome sequencing analyses of viral RNA in plasma of infected mice reveal that 4A HIV-1 is specifically and significantly diversified. Furthermore, a mutated virus that is capable of using both CCR5 and CXCR4 as entry coreceptor is specifically detected in 4A HIV-1-infected mice. Taken together, our results demonstrate that APOBEC3D/F and APOBEC3G fundamentally work as restriction factors against HIV-1 in vivo, but at the same time, that APOBEC3D and APOBEC3F are capable of promoting viral diversification and evolution in vivo. PMID:25330146

  11. Ion exchange and electrochemical evaluation of the microporous phosphate Li{sub 9}Fe{sub 7}(PO{sub 4}){sub 10}

    SciTech Connect

    Becht, Gregory A.; Vaughey, John T.; Britt, Robin L.; Eagle, Cassandra T.; Hwu, Shiou-Jyh

    2008-12-01

    A new lithium iron(III) phosphate, Li{sub 9}Fe{sub 7}(PO{sub 4}){sub 10}, has been synthesized and is currently under electrochemical evaluation as an anode material for rechargeable lithium-ion battery applications. The sample was prepared via the ion exchange reaction of Cs{sub 5}K{sub 4}Fe{sub 7}(PO{sub 4}){sub 10}1 in the 1 M LiNO{sub 3} solution under hydrothermal conditions at 200 deg. C. The fully Li{sup +}-exchanged sample Li{sub 9}Fe{sub 7}(PO{sub 4}){sub 10}2 cannot yet be synthesized by conventional high-temperature, solid-state methods. The parent compound 1 is a member of the Cs{sub 9-x}K{sub x}Fe{sub 7}(PO{sub 4}){sub 10} series that was previously isolated from a high-temperature (750 deg. C) reaction employing the eutectic CsCl/KCl molten salt. The polycrystalline solid 1 was first prepared in a stoichiometric reaction via conventional solid-state method then followed by ion exchange giving rise to 2. Both compounds adopt three-dimensional structures that consist of orthogonally interconnected channels where electropositive ions reside. It has been demonstrated that the Cs{sub 9-x}K{sub x}Fe{sub 7}(PO{sub 4}){sub 10} series possesses versatile ion exchange capabilities with all the monovalent alkali metal and silver cations due to its facile pathways for ion transport. 1 and 2 were subject to electrochemical analysis and preliminary results suggest that the latter can be considered as an anode material. Electrochemical results indicate that Li{sub 9}Fe{sub 7}(PO{sub 4}){sub 10} is reduced below 1 V (vs. Li) to most likely form a Fe(0)/Li{sub 3}PO{sub 4} composite material, which can subsequently be cycled reversibly at relatively low potential. An initial capacity of 250 mAh/g was measured, which is equivalent to the insertion of thirteen Li atoms per Li{sub 9+x}Fe{sub 7}(PO{sub 4}){sub 10} (x = 13) during the charge/discharge process (Fe{sup 2+} + 2e {yields} Fe{sup 0}). Furthermore, 2 shows a lower reduction potential (0.9 V), by approximately 200

  12. Pressure induced phase transformations in NaZr{sub 2}(PO{sub 4}){sub 3} studied by X-ray diffraction and Raman spectroscopy

    SciTech Connect

    Kamali, K.; Ravindran, T.R.; Chandra Shekar, N.V.; Pandey, K.K.; Sharma, S.M.

    2015-01-15

    Raman spectroscopic and x-ray diffraction measurements on NaZr{sub 2}(PO{sub 4}){sub 3} were carried out up to 30 GPa at close intervals of pressure, revealing two structural phase transformations around 5 and 6.6 GPa. The second phase at 5.4 GPa is indexed to R3 space group similar to that of RbTi{sub 2}(PO{sub 4}){sub 3}. Bulk modulus decreases abruptly from 53 GPa (B′=4) to 36 GPa (B′=4) in the second phase above 5 GPa. The structure of the phase III at 8.2 GPa is indexed as orthorhombic similar to the case of high temperature phase of monoclinic LiZr{sub 2}(PO{sub 4}){sub 3}. Bulk modulus of this phase III is found to be 65 GPa (B′=4), which is higher than that of the ambient phase. In high pressure Raman studies, modes corresponding to 72 and 112 cm{sup −1} soften in the ambient phase whereas around 5 GPa, the ones at 60, 105, 125 and 190 cm{sup −1} soften with pressure contributing negatively to overall thermal expansion. - Graphical abstract: High pressure study of NaZr{sub 2}(PO{sub 4}){sub 3} shows a reversible phase transition from R-3c to R3 structure at 5 GPa accompanied by an increase in compressibility signaling a polyhedral tilt transition. - Highlights: • NaZr{sub 2}(PO{sub 4}){sub 3} undergoes two reversible phase transitions at 5 and 6.7 GPa. • The transition at 5 is from rhombohedral R-3c to R3 structure. • Bulk modulus of NaZr{sub 2}(PO{sub 4}){sub 3} is lower than that for the isostructural RbTi{sub 2}(PO{sub 4}){sub 3.} • Compressibility increases with substitution of a smaller cation (Na). • Zr-translational and PO{sub 4} librational modes contribute to phase transition.

  13. Yb{sup 3+}:BaCaBO{sub 3}F: A potential new self-frequency-doubling laser material

    SciTech Connect

    Schaffers, K.I.; DeLoach, L.D.; Ebbers, C.A.; Payne, S.A.

    1995-03-09

    Yb:BaCaBO{sub 3}F (Yb:BCBF) has been investigated as a new laser crystal with potential for self-frequency-doubling. An YB:BCBF laser has been pumped at 912 mm, and a measured slope efficiency of 38% has been obtained for the fundamental laser output at 1034 nm. Single crystal powders of BCBF have been compared with K*P for a relative measure of the second harmonic generating potential, yielding d{sub eff}[BCBF]= (0-66)d{sub eff}[K*P]. The growth, spectroscopy, laser performance, and linear and nonlinear optical properties of YB:BCBF are reported here.

  14. Laser demonstration of diode-laser-pumped Nd:Sr5(VO4)3F crystal

    NASA Astrophysics Data System (ADS)

    Zhao, Shengzhi; Wang, Qingpu; Zhang, Xingyu; Sun, Lianke; Zhang, Shaojun

    1996-03-01

    The absorption spectrum of a new crystal Nd:Sr6(VO4)3F, known as Nd:S-VAP, is measured and its strong absorption peak at 809 nm shows that it can be suitably pumped by laser-diode. By using a laser-diode pump operating at 809 nm, Nd:S-VAP crystal has been successfully lased at 1.065 micrometer. A highest slope efficiency of 43.5% and a lowest laser threshold of only 11 mW have been measured. The theoretical formulas for threshold power and slope efficiency were written, and the theoretical prediction is in agreement with the experimental result.

  15. Development of doxorubicin-induced chronic cardiotoxicity in the B6C3F{sub 1} mouse model

    SciTech Connect

    Desai, Varsha G.; Herman, Eugene H.; Moland, Carrie L.; Branham, William S.; Lewis, Sherry M.; Davis, Kelly J.; George, Nysia I.; Lee, Taewon; Kerr, Susan; Fuscoe, James C.

    2013-01-01

    Serum levels of cardiac troponins serve as biomarkers of myocardial injury. However, troponins are released into the serum only after damage to cardiac tissue has occurred. Here, we report development of a mouse model of doxorubicin (DOX)-induced chronic cardiotoxicity to aid in the identification of predictive biomarkers of early events of cardiac tissue injury. Male B6C3F{sub 1} mice were administered intravenous DOX at 3 mg/kg body weight, or an equivalent volume of saline, once a week for 4, 6, 8, 10, 12, and 14 weeks, resulting in cumulative DOX doses of 12, 18, 24, 30, 36, and 42 mg/kg, respectively. Mice were sacrificed a week following the last dose. A significant reduction in body weight gain was observed in mice following exposure to a weekly DOX dose for 1 week and longer compared to saline-treated controls. DOX treatment also resulted in declines in red blood cell count, hemoglobin level, and hematocrit compared to saline-treated controls after the 2nd weekly dose until the 8th and 9th doses, followed by a modest recovery. All DOX-treated mice had significant elevations in cardiac troponin T concentrations in plasma compared to saline-treated controls, indicating cardiac tissue injury. Also, a dose-related increase in the severity of cardiac lesions was seen in mice exposed to 24 mg/kg DOX and higher cumulative doses. Mice treated with cumulative DOX doses of 30 mg/kg and higher showed a significant decline in heart rate, suggesting drug-induced cardiac dysfunction. Altogether, these findings demonstrate the development of DOX-induced chronic cardiotoxicity in B6C3F{sub 1} mice. -- Highlights: ► 24 mg/kg was a cumulative cardiotoxic dose of doxorubicin in male B6C3F{sub 1} mice. ► Doxorubicin-induced hematological toxicity was in association with splenomegaly. ► Doxorubicin induced severe testicular toxicity in B6C3F{sub 1} male mice.

  16. Absolute Line Intensities in the ν 3Band of 12CH 3F by Diode-Laser Spectroscopy

    NASA Astrophysics Data System (ADS)

    Lepère, Muriel; Blanquet, Ghislain; Walrand, Jacques

    1996-06-01

    Infrared absolute line intensities of the ν 3band of 12CH 3F have been measured around 9.5 μm using a diode-laser spectrometer. These line strengths were obtained from the equivalent width method and, for a few lines, by fitting a Rautian profile to the measured shape of the lines. From these results, we have deduced the vibrational bandstrength ( Sv0= 379.2 ± 5.9 cm -2·atm -1at 296 K) and the first Herman-Wallis factor (α = 0.35 × 10 -3± 0.10 × 10 -3).

  17. Different mutagenic potential of HIV-1 restriction factors APOBEC3G and APOBEC3F is determined by distinct single-stranded DNA scanning mechanisms.

    PubMed

    Ara, Anjuman; Love, Robin P; Chelico, Linda

    2014-03-01

    The APOBEC3 deoxycytidine deaminase family functions as host restriction factors that can block replication of Vif (virus infectivity factor) deficient HIV-1 virions to differing degrees by deaminating cytosines to uracils in single-stranded (-)HIV-1 DNA. Upon replication of the (-)DNA to (+)DNA, the HIV-1 reverse transcriptase incorporates adenines opposite the uracils, thereby inducing C/G→T/A mutations that can functionally inactivate HIV-1. Although both APOBEC3F and APOBEC3G are expressed in cell types HIV-1 infects and are suppressed by Vif, there has been no prior biochemical analysis of APOBEC3F, in contrast to APOBEC3G. Using synthetic DNA substrates, we characterized APOBEC3F and found that similar to APOBEC3G; it is a processive enzyme and can deaminate at least two cytosines in a single enzyme-substrate encounter. However, APOBEC3F scanning movement is distinct from APOBEC3G, and relies on jumping rather than both jumping and sliding. APOBEC3F jumping movements were also different from APOBEC3G. The lack of sliding movement from APOBEC3F is due to an ¹⁹⁰NPM¹⁹² motif, since insertion of this motif into APOBEC3G decreases its sliding movements. The APOBEC3G NPM mutant induced significantly less mutations in comparison to wild-type APOBEC3G in an in vitro model HIV-1 replication assay and single-cycle infectivity assay, indicating that differences in DNA scanning were relevant to restriction of HIV-1. Conversely, mutation of the APOBEC3F ¹⁹¹Pro to ¹⁹¹Gly enables APOBEC3F sliding movements to occur. Although APOBEC3F ¹⁹⁰NGM¹⁹² could slide, the enzyme did not induce more mutagenesis than wild-type APOBEC3F, demonstrating that the unique jumping mechanism of APOBEC3F abrogates the influence of sliding on mutagenesis. Overall, we demonstrate key differences in the impact of APOBEC3F- and APOBEC3G-induced mutagenesis on HIV-1 that supports a model in which both the processive DNA scanning mechanism and preferred deamination motif

  18. Different Mutagenic Potential of HIV-1 Restriction Factors APOBEC3G and APOBEC3F Is Determined by Distinct Single-Stranded DNA Scanning Mechanisms

    PubMed Central

    Ara, Anjuman; Love, Robin P.; Chelico, Linda

    2014-01-01

    The APOBEC3 deoxycytidine deaminase family functions as host restriction factors that can block replication of Vif (virus infectivity factor) deficient HIV-1 virions to differing degrees by deaminating cytosines to uracils in single-stranded (−)HIV-1 DNA. Upon replication of the (−)DNA to (+)DNA, the HIV-1 reverse transcriptase incorporates adenines opposite the uracils, thereby inducing C/G→T/A mutations that can functionally inactivate HIV-1. Although both APOBEC3F and APOBEC3G are expressed in cell types HIV-1 infects and are suppressed by Vif, there has been no prior biochemical analysis of APOBEC3F, in contrast to APOBEC3G. Using synthetic DNA substrates, we characterized APOBEC3F and found that similar to APOBEC3G; it is a processive enzyme and can deaminate at least two cytosines in a single enzyme-substrate encounter. However, APOBEC3F scanning movement is distinct from APOBEC3G, and relies on jumping rather than both jumping and sliding. APOBEC3F jumping movements were also different from APOBEC3G. The lack of sliding movement from APOBEC3F is due to an 190NPM192 motif, since insertion of this motif into APOBEC3G decreases its sliding movements. The APOBEC3G NPM mutant induced significantly less mutations in comparison to wild-type APOBEC3G in an in vitro model HIV-1 replication assay and single-cycle infectivity assay, indicating that differences in DNA scanning were relevant to restriction of HIV-1. Conversely, mutation of the APOBEC3F 191Pro to 191Gly enables APOBEC3F sliding movements to occur. Although APOBEC3F 190NGM192 could slide, the enzyme did not induce more mutagenesis than wild-type APOBEC3F, demonstrating that the unique jumping mechanism of APOBEC3F abrogates the influence of sliding on mutagenesis. Overall, we demonstrate key differences in the impact of APOBEC3F- and APOBEC3G-induced mutagenesis on HIV-1 that supports a model in which both the processive DNA scanning mechanism and preferred deamination motif (APOBEC3F, 5

  19. A novel red long lasting phosphorescent (LLP) material {beta}-Zn{sub 3}(PO{sub 4}){sub 2}:Mn{sup 2+}, Sm{sup 3+}

    SciTech Connect

    Wang Jing; Su Qiang . E-mail: cessuq@zsu.edu.cn; Wang Shubin

    2005-04-20

    A novel red long lasting phosphorescent materials {beta}-Zn{sub 3}(PO{sub 4}){sub 2}:Mn{sup 2+},Sm{sup 3+} is firstly synthesized by high-temperature solid-state reaction. The influence of Sm{sup 3+} ions on luminescence and long lasting phosphorescence properties of Mn{sup 2+} in phosphor {beta}-Zn{sub 3}(PO{sub 4}){sub 2}:Mn{sup 2+},Sm{sup 3+} are systematically investigated. It is found that the red phosphorescence ({lambda} = 616 nm) performance of Mn{sup 2+} ion such as brightness and duration is largely improved when Sm{sup 3+} ion is co-doped into the matrix in which Mn{sup 2+} ion acts as luminescent center and Sm{sup 3+} ion plays an important role of electron trap. Thermoluminescence spectrums show that there exists one peak in {beta}-Zn{sub 3}(PO{sub 4}){sub 2}:Mn{sup 2+},Sm{sup 3+}, the depth of which is 0.33 eV, and that there are three peaks in {beta}-Zn{sub 3}(PO{sub 4}){sub 2}:Mn{sup 2+}, among which the depth of the lowest temperature peak in {beta}-Zn{sub 3}(PO{sub 4}){sub 2}:Mn{sup 2+} is 0.37 eV. Such differences in the trap depth result in the improvement of red long lasting phosphorescence of Mn{sup 2+} in present matrix.

  20. Syntheses, crystal structures and optical spectroscopy of Ln{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O (Ln=Ho, Tm) and Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O

    SciTech Connect

    Kazmierczak, Karolina; Hoeppe, Henning A.

    2011-05-15

    The lanthanide sulphate octahydrates Ln{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O (Ln=Ho, Tm) and the respective tetrahydrate Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O were obtained by evaporation of aqueous reaction mixtures of trivalent rare earth oxides and sulphuric acid at 300 K. Ln{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O (Ln=Ho, Tm) crystallise in space group C2/c (Z=4, a{sub Ho}=13.4421(4) A, b{sub Ho}=6.6745(2) A, c{sub Ho}=18.1642(5) A, {beta}{sub Ho}=102.006(1) A{sup 3} and a{sub Tm}=13.4118(14) A, b{sub Tm}=6.6402(6) A, c{sub Tm}=18.1040(16) A, {beta}{sub Tm}=101.980(8) A{sup 3}), Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O adopts space group P2{sub 1}/n (a=13.051(3) A, b=7.2047(14) A, c=13.316(3) A, {beta}=92.55(3) A{sup 3}). The vibrational and optical spectra of Ho{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O and Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O are also reported. -- Graphical abstract: In the lanthanide sulphate octahydrates the cations form slightly undulated layers. Between the layers are voids in which sulphate tetrahedra and water molecules are located. The holmium compound exhibits an Alexandrite effect. Display Omitted Highlights: {yields} Determination of the optimum conditions for the growth of single-crystals of Ln{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O (Ln=Ho, Tm) and Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O. {yields} Single-crystal structure elucidation of Ln{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O (Ln=Ho, Tm) including hydrogen bonds. {yields} Single-crystal structure determination of Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O including hydrogen bonds. {yields} UV-vis spectra of Ho{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O and Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O recorded and interpreted: Assignation of bands and clarification of the Alexandrite effect of the Ho compound. {yields} IR and Raman spectra of Ln{sub 2}(SO{sub 4}){sub 3}.8H{sub 2}O (Ln=Ho, Tm) and Pr{sub 2}(SO{sub 4}){sub 3}.4H{sub 2}O recorded and interpreted.

  1. Structural study and physical properties of a new phosphate KCuFe(PO{sub 4}){sub 2}

    SciTech Connect

    Badri, Abdessalem; Hidouri, Mourad; Lopez, Maria Luisa; Pico, Carlos; Wattiaux, Alain; Ben Amara, Mongi

    2011-04-15

    Single crystals of a new phosphate KCuFe(PO{sub 4}){sub 2} have been prepared by the flux method and its structural and physical properties have been investigated. This compound crystallizes in the monoclinic system with the space group P2{sub 1}/n and its parameters are: a=7.958(3) A, b=9.931(2) A, c=9.039(2) A, {beta}=115.59(3){sup o} and Z=4. Its structure consists of FeO{sub 6} octahedra sharing corners with Cu{sub 2}O{sub 8} units of edge-sharing CuO{sub 5} polyhedra to form undulating chains extending infinitely along the b-axis. These chains are connected by the phosphate tetrahedra giving rise to a 3D framework with six-sided tunnels parallel to the [101] direction, where the K{sup +} ions are located. The Moessbauer spectroscopy results confirm the exclusive presence of octahedral Fe{sup 3+} ions. The magnetic measurements show the compound to be antiferromagnetic with C{sub m}=5.71 emu K/mol and {theta}=-156.5 K. The derived experimental effective moment {mu}{sub ex}=6.76{mu}{sub B} is somewhat higher than the theoretical one of {mu}{sub th}=6.16{mu}{sub B}, calculated taking only into account the spin contribution for Fe{sup 3+} and Cu{sup 2+} cations. Electrical measurements allow us to obtain the activation energy (1.22 eV) and the conductivity measurements suggest that the charge carriers through the structure are the potassium cations. -- Graphical abstract: A projection along the [101] direction of the structure showing the six-edged tunnels, occupied by the K{sup +} ions. Display Omitted Highlights: {yields} The reported structure is of a new type. {yields} The structural model is supported by a Moessbauer spectroscopy study. {yields} The magnetic susceptibility results are reported. {yields} The electrical properties are discussed.

  2. Immunomodulatory activity of orphan drug Elmiron® in female B6C3F1/N mice

    PubMed Central

    Thakur, Sheetal A.; Nyska, Abraham; White, Kimber L.; Smith, Matthew J.; Auttachoat, Wimolnut; Germolec, Dori R.

    2014-01-01

    Interstitial cystitis (IC) is a chronic disorder characterized by bladder discomfort and urinary urgency in the absence of identifiable infection. Despite the expanding use in treatment of IC and other chronic conditions, the effects of Elmiron® treatment on immune system remain unknown. Therefore, female B6C3F1/N mice were orally administered Elmiron® daily for 28-days at doses of 63, 125, 250, 500 or 1000 mg/kg to evaluate its immunomodulatory effects. Mice treated with Elmiron® had a significant increase in absolute numbers of splenic macrophages (63, 500 and 1000 mg/kg) and natural killer (NK) cells (250 and 1000 mg/kg). Elmiron® treatment did not affect the humoral immune response or T cell proliferative response. However, innate immune responses such as phagocytosis by liver macrophages (1000 mg/kg) and NK cell activity were enhanced (500 and 1000 mg/kg). Further analysis using a disease resistance model showed that Elmiron® -treated mice demonstrated significantly increased anti-tumor activity against B16F10 melanoma cells at the 500 and 1000 mg/kg doses. Collectively, we conclude that Elmiron® administration stimulates the immune system, increasing numbers of specific cell populations and enhancing macrophage phagocytosis and NK cell activity in female B6C3F1/N mice. This augmentation may have largely contributed to the reduced number of B16F10 melanoma tumors. PMID:24657363

  3. A time-resolved study of rotational energy transfer into A and E symmetry species of 13CH3F

    NASA Astrophysics Data System (ADS)

    Everitt, Henry O.; De Lucia, Frank C.

    1989-04-01

    Rotational energy transfer processes into the A and E symmetry species of the symmetric top molecule 13CH3F have been studied. In this time-resolved double resonance experiment a tunable millimeter/submillimeter wave spectrometer was used to monitor the change in strength of rotational transitions in the ν3 vibrational state after a Q-switched CO2 laser pumped the K=3, J=5 level in ν3. A simple numerical simulation of rotational energy transfer allowed the 13CH3F system to be modeled and collisional energy transfer rates to be obtained from the data. Two important processes were studied. The first, a process that obeys the spin statistic selection rule ΔK=3n has a rate of 29±6 ms-1 mTorr-1. The second, a vibrational quantum number swapping collision that effectively transfers population between the A and E symmetry species and thereby transcends the spin statistic selection rule, has a rate of 6.6±0.7 ms-1 mTorr-1, about 1.4 gas kinetic collisions. The numerical simulations and these rates, along with previous measurements of the ΔJ=±1 rate and vibrational decay rates, provide an accurate characterization for a large body of varied experimental data.

  4. Elevated oxidative stress in skin of B6C3F1 mice affects dermal exposure to metal working fluid.

    PubMed

    Shvedova, A A; Kisin, E; Kisin, J; Castranova, V; Kommineni, C

    2000-09-01

    Metal working fluids (MWFs) are widely used in industry for metal cutting, drilling, shaping, lubricating, and milling. Potential for dermal exposure to MWFs exists for a large number of men and women via aerosols and splashing during the machining operations. It has been reported earlier that occupational exposure to MWFs causes allergic and irritant contact dermatitis. Previously, we showed that dermal exposure of female and male B6C3F1 mice to 5% MWFs for 3 months resulted in accumulation of mast cells and elevation of histamine in the skin. Topical exposure to MWF also resulted in elevated oxidative stress in the liver of both sexes and the testes in males. The goal of this study was to evaluate the interaction between oxidative stress in the skin and topical application of MWF. Oxidative stress in skin ofB6C3F1 mice of both sexes was generated by intradermal injection ofthe hydrogen peroxide (H2O2) -producing enzyme, glucose oxidase with polyethylene glycol (GOD+PEG). In mice given GOD+PEG, topical treatment with MWF (200 microl, 30%, for 1, 3, or 7 days) resulted in a mixed inflammatory cell response, accumulation of peroxidative products, and reduction of GSH content in the skin. Such changes were not observed with MWF treatment alone. These data indicate that oxidative stress can enhance dermal inflammation caused by occupational exposure to MWF.

  5. The sex-linked fidget mutation abolishes Brn4/Pou3f4 gene expression in the embryonic inner ear.

    PubMed

    Phippard, D; Boyd, Y; Reed, V; Fisher, G; Masson, W K; Evans, E P; Saunders, J C; Crenshaw, E B

    2000-01-01

    We have demonstrated that the phenotype of the mouse mutant sex-linked fidget ( slf ) is caused by developmental malformations of the inner ear that result in hearing loss and vestibular dysfunction. Recently, pilot mapping experiments suggested that the mouse Brn4 / Pou3f4 gene co-segregated with the slf locus on the mouse X chromosome. These mapping data, in conjunction with the observation that the vertical head-shaking phenotype of slf mutants is identical to that observed in mice with a targeted deletion of the Brn4 gene, suggested that slf is a mutant allele of the Brn4 gene. In this paper, we have identified the nature of the slf mutation, and demonstrated that it is an X chromosomal inversion with one breakpoint close to Brn4. This inversion selectively eliminates the expression of the Brn4 gene in the developing inner ear, but not the neural tube. Finally, these results demonstrate that the slf mutation is a good mouse model for the most prevalent form of X-linked congenital deafness in man, which is associated with mutations in the human Brn4 ortholog, POU3F4.

  6. Neuropilin-2/Semaphorin-3F-mediated repulsion promotes inner hair cell innervation by spiral ganglion neurons

    PubMed Central

    Coate, Thomas M; Spita, Nathalie A; Zhang, Kaidi D; Isgrig, Kevin T; Kelley, Matthew W

    2015-01-01

    Auditory function is dependent on the formation of specific innervation patterns between mechanosensory hair cells (HCs) and afferent spiral ganglion neurons (SGNs). In particular, type I SGNs must precisely connect with inner HCs (IHCs) while avoiding connections with nearby outer HCs (OHCs). The factors that mediate these patterning events are largely unknown. Using sparse-labeling and time-lapse imaging, we visualized for the first time the behaviors of developing SGNs including active retraction of processes from OHCs, suggesting that some type I SGNs contact OHCs before forming synapses with IHCs. In addition, we demonstrate that expression of Semaphorin-3F in the OHC region inhibits type I SGN process extension by activating Neuropilin-2 receptors expressed on SGNs. These results suggest a model in which cochlear innervation patterns by type I SGNs are determined, at least in part, through a Semaphorin-3F-mediated inhibitory signal that impedes processes from extending beyond the IHC region. DOI: http://dx.doi.org/10.7554/eLife.07830.001 PMID:26302206

  7. Combustion synthesized nanocrystalline Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C cathode for lithium-ion batteries

    SciTech Connect

    Nathiya, K.; Bhuvaneswari, D.; Gangulibabu; Kalaiselvi, N.

    2012-12-15

    Graphical abstract: Nanocrystalline Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C compound has been synthesized using a novel corn assisted combustion (CAC) method, wherein the composite prepared at 850 °C is found to exhibit superior physical and electrochemical properties than the one synthesized at 800 °C (Fig. 1). Despite the charge disproportionation of V{sup 4+} and a possible solid solution behavior of Li{sub 3}V{sub 2}(PO{sub 4}){sub 3} cathode upon insertion and de-insertion of Li{sup +} ions, the structural stability of the same is appreciable, even with the extraction of third lithium at 4.6 V (Fig. 2). An appreciable specific capacity of 174 mAh g{sup −1} with an excellent columbic efficiency (99%) and better capacity retention upon high rate applications have been exhibited by Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C cathode, thus demonstrating the feasibility of CAC method in preparing the title compound to best suit with the needs of lithium battery applications. Display Omitted Highlights: ► Novel corn assisted combustion method has been used to synthesize Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C. ► Corn is a cheap and eco benign combustible fuel to facilitate CAC synthesis. ► Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C exhibits an appreciable specific capacity of 174 mAh g{sup −1} (C/10 rate). ► Currently observed columbic efficiency of 99% is better than the reported behavior. ► Suitability of Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C cathode up to 10C rate is demonstrated. -- Abstract: Nanocrystalline Li{sub 3}V{sub 2}(PO{sub 4}){sub 3}/C composite synthesized using a novel corn assisted combustion method at 850 °C exhibits superior physical and electrochemical properties than the one synthesized at 800 °C. Despite the charge disproportionation of V{sup 4+} and a possible solid solution behavior of Li{sub 3}V{sub 2}(PO{sub 4}){sub 3} cathode upon insertion and extraction of Li{sup +} ions, the structural stability of the same is appreciable, even with

  8. Structural, energetic and thermodynamic analyses of Ca(BH{sub 4}){sub 2}{center_dot}2NH{sub 3} from first principles calculations

    SciTech Connect

    Yuan Pengfei; Wang Fei; Sun Qiang; Jia Yu; Guo Zhengxiao

    2012-01-15

    Ca(BH{sub 4}){sub 2}{center_dot}2NH{sub 3} is a relatively new compound with potential application in hydrogen storage. Here the fundamental properties of the compound, such as electronic structure, energetic and thermodynamic properties, were comprehensively studied using first-principles calculations. Results from electronic density of states (DOS) and electron localization function (ELF) indicate the covalent bond nature of the N-H bond and the B-H bond. Charge density analyses show weak ionic interactions between the Ca atom and the NH{sub 3} complexes or the (BH{sub 4}){sup -} complexes. The calculated vibration frequencies of B-H and N-H are in good agreement with other theoretical and experimental results. Furthermore, we calculated the reaction enthalpy and reaction Gibbs free energy at a range of temperature 0-700 K. Our results are in good agreement with experimental results in literature. Possible reaction mechanism of the decomposition reaction is proposed. - Graphical Abstract: The crystal structure of this compound and the calculated decomposition reaction free energy for two different reactions: Reac(2):Ca(BH{sub 4}){sub 2} Dot-Operator 2NH{sub 3} Long-Rightwards-Arrow {sup 162 Degree-Sign C}Ca(BH{sub 4}){sub 2} Dot-Operator NH{sub 3}+NH{sub 3} Long-Rightwards-Arrow {sup 230 Degree-Sign C}Ca(BH{sub 4}){sub 2}+2NH{sub 3} Reac(3):Ca(BH{sub 4}){sub 2} Dot-Operator 2NH{sub 3} Long-Rightwards-Arrow {sup 190 Degree-Sign C}1/4Ca(BH{sub 4}){sub 2}+1/4Ca{sub 3}(BN{sub 2}){sub 2}+BN+6H{sub 2}. Highlights: Black-Right-Pointing-Pointer Crystal structure of this compound was studied in detail. Black-Right-Pointing-Pointer Electronic properties were calculated for the first time. Black-Right-Pointing-Pointer Phonon density of states and reaction free energy at different temperatures were first calculated. Black-Right-Pointing-Pointer Possible decomposition mechanism was presented.

  9. Ultrafast bulk diffusion of AlHx in high-entropy dehydrogenation intermediates of NaAlH4sub> [Highly mobile AlHx species and the dehydogenation kinetics of NaAlH4sub>

    SciTech Connect

    Zhang, Feng; Wood, Brandon C.; Wang, Yan; Wang, Cai -Zhuang; Ho, Kai -Ming; Chou, Mei -Yin

    2014-07-21

    Using first-principles molecular dynamics (FPMD) and total-energy calculations, we demonstrate low-barrier bulk diffusion of Al-bearing species in γ-NaAlH4sub>, a recently proposed high-entropy polymorph of NaAlH4sub>. For charged AlH4sub>– and neutral AlH3 vacancies, the computed barriers for diffusion are <0.1 eV, and we directly observe the predicted diffusive pathways in FPMD simulations at picosecond time scales. In contrast, such diffusion in the α phase is inaccessible to FPMD, consistent with much higher barriers. The transport behavior of γ-NaAlH4sub>, in addition to key dynamical and structural signatures, is consistent with experimental observations of high-mobility species, strongly supporting the idea that an intermediate transition from the α phase to a high-entropy polymorph facilitates the hydrogen-releasing decomposition of NaAlH4. Lastly, our results provide an answer to longstanding questions regarding the responsible agent for the experimentally observed efficient Al transport during dehydrogenation and suggest that mass transport and phase transformation kinetics are coupled. Implications for understanding the (de)hydrogenation of undoped and catalyzed NaAlH4sub> are discussed.

  10. Multiple-site carcinogenicity of benzene in Fischer 344 rats and B6C3F1 mice.

    PubMed Central

    Huff, J E; Haseman, J K; DeMarini, D M; Eustis, S; Maronpot, R R; Peters, A C; Persing, R L; Chrisp, C E; Jacobs, A C

    1989-01-01

    Toxicology and carcinogenesis studies of benzene (CAS No. 71-43-2; greater than 99.7% pure) were conducted in groups of 60 F344/N rats and 60 B6C3F1 mice of each sex for each of three exposure doses and vehicle controls. These composite studies on benzene were designed and conducted because of large production volume and widespread human exposure, because of the epidemiologic association with leukemia, and because previous experiments were considered inadequate or inconclusive for determining carcinogenicity in laboratory animals. Using the results from 17-week studies, doses for the 2-year studies were selected based on clinical observations (tremors in higher dosed mice), on clinical pathologic findings (lymphoid depletion in rats and leukopenia in mice), and on body weight effects. Doses of 0, 50, 100, or 200 mg/kg body weight benzene in corn oil were administered by gavage to male rats, 5 days per week, for 103 weeks. Doses of 0, 25, 50, or 100 mg/kg benzene in corn oil were administered by gavage to female rats and to male and female mice for 103 weeks. Ten animals in each of the 16 groups were killed at 12 months, and necropsies were performed. Hematologic profiles were performed at 3-month intervals. For the 2-year studies, mean body weights of the top dose groups of male rats and of both sexes of mice were lower than those of the controls. Survivals of the top dose group of rats and mice of each sex were reduced; however, at week 92 for rats and week 91 for mice, survival was greater than 60% in all groups; most of the dosed animals that died before week 103 had neoplasia. Compound-related nonneoplastic or neoplastic effects on the hematopoietic system, Zymbal gland, forestomach, and adrenal gland were found both for rats and mice. Further, the oral cavity was affected in rats, and the lung, liver, Harderian gland, preputial gland, ovary, and mammary gland were affected in mice. Under the conditions of these 2-year gavage studies, there was clear evidence

  11. Genistein modulation of streptozotocin diabetes in male B6C3F1 mice can be induced by diet

    SciTech Connect

    Guo, Tai L.; Wang, Yunbiao; Xiong, Tao; Ling, Xiao; Zheng, Jianfeng

    2014-11-01

    Diet and phytoestrogens affect the development and progression of diabetes. The objective of the present study was to determine if oral exposure to phytoestrogen genistein (GE) by gavage changed blood glucose levels (BGL) through immunomodulation in streptozotocin (STZ)-induced diabetic male B6C3F1 mice fed with three different diets. These three diets were: NTP-2000 diet (NTP), soy- and alfalfa-free 5K96 diet (SOF) and high fat diet (HFD) with 60% of kcal from fat, primarily rendered fat of swine. The dosing regimen for STZ consisted of three 100 mg/kg doses (i.p.): the first dose was administered at approximately 2 weeks following the initiation of daily GE (20 mg/kg) gavage, and the second dose was on day 19 following the first dose, and the third dose was on day 57 following the first dose. In mice on the NTP diet, GE treatment decreased BGL with statistical significances observed on days 33 and 82 following the first STZ injection. In mice fed the HFD diet, GE treatment produced a significant decrease and a significant increase in BGL on days 15 and 89 following the first STZ injection, respectively. In mice fed the SOF diet, GE treatment had no significant effects on BGL. Although GE treatment affected phenotypic distributions of both splenocytes (T cells, B cells, natural killer cells and neutrophils) and thymocytes (CD4/CD8 and CD44/CD25), and their mitochondrial transmembrane potential and generation of reactive oxygen species, indicators of cell death (possibly apoptosis), GE modulation of neutrophils was more consistent with its diabetogenic or anti-diabetic potentials. The differential effects of GE on BGL in male B6C3F1 mice fed with three different diets with varied phytoestrogen contents suggest that the estrogenic properties of this compound may contribute to its modulation of diabetes. - Highlights: • Diets affected streptozotocin-induced diabetes in male B6C3F1 mice. • Genistein modulation of streptozotocin diabetes can be induced by diet.

  12. Neutron scattering studies of the H2a-H2b and (H3-H4)/sub 2/ histone complexes

    SciTech Connect

    Carlson, R.D.

    1982-01-01

    Neutron scattering experiments have shown that both the (H3-H4)/sub 2/ and H2a-H2b histone complexes are quite asymmetric in solution. The (H3-H4)/sub 2/ tetramer is an oblate or flattened structure, with a radius of gyration almost as large as that of the core octamer. If the tetramer is primarily globular, it must have an axial ratio of about 1:5. It is more likely, however, that this asymmetry results in part from N-terminal arms that extend outward approximately within the major plane of the particle. If this is the case, less asymmetric models for the globular part of the tetramer, including a dislocated disk, can be made consistent with the scattering data. The H2a-H2b dimer, on the other hand, is an elongated structure. 48 references, 12 figures, 1 table.

  13. Theoretical Assessment on the Phase Transformation Kinetic Pathways of Multi-component Ti Alloys: Application to Ti-6Al-4sub>V

    SciTech Connect

    Ji, Yanzhou; Heo, Tae Wook; Zhang, Fan; Chen, Long-Qing

    2015-12-21

    Here we present our theoretical assessment of the kinetic pathways during phase transformations of multi-component Ti alloys. Employing the graphical thermodynamic approach and an integrated free energy function based on the realistic thermodynamic database and assuming that a displacive structural transformation occurs much faster than long-range diffusional processes, we analyze the phase stabilities of Ti-6Al-4sub>V (Ti-6wt.%Al-4sub>wt.%V). Our systematic analyses predict a variety of possible kinetic pathways for β to (α + β) transformations leading to different types of microstructures under various heat treatment conditions. In addition, the possibility of unconventional kinetic pathways is discussed. Lastly, we also briefly discuss the application of our approach to general multicomponent/multiphase alloy systems.

  14. Structurally induced magnetization in a La2/3Sr4/3MnO4sub> superlattice

    SciTech Connect

    Shah, Amish B.; Nelson-Cheeseman, Brittany B.; Subramanian, Ganesh; Bhattacharya, Anand; Spence, John C.H.

    2012-03-16

    A structural transition has been observed in a digital superlattice of La2/3Sr4/3MnO4sub>, which is correlated to a magnetization enhancement upon cooling the sample. The artificial superlattices were grown layer-by-layer using ozone-assisted molecular beam epitaxy (MBE). Electron diffraction experiments show a phase transition below 150K in nanopatches of the superlattice, which coincides with an enhanced magnetization starting below 110K. Furthermore, atomic scale electron energy loss spectroscopy (EELS) shows changes in the Mn L2,3 and O K edges, which are related to valence, strain, and the atomic coordination within nanopatches. Atomic resolution image and EELS showing variations of oxygen and lanthanum signature edges in a La2/3Sr4/3MnO4sub> supperlattice.

  15. Magnetic properties of (FeIn{sub 2}S{sub 4}){sub 1-x}(In{sub 2}S{sub 3}){sub x} alloy single crystals

    SciTech Connect

    Bodnar, I. V. Novikova, M. A.; Trukhanov, S. V.

    2013-05-15

    (FeIn{sub 2}S{sub 4}){sub 1-x}(In{sub 2}S{sub 3}){sub x} alloy single crystals are grown by oriented crystallization in the entire range of component concentrations. For the single crystals, studies of the magnetic properties are carried out in the temperature range 4-300 K and the magnetic-field range 0-14 T. It is established that almost all of the alloys are paramagnetic materials at temperatures down to the lowest achievable temperatures ({approx}4 K). It is shown that the ground magnetic phase state of the alloys is the spin-glass state with the freezing temperature steadily increasing with increasing Fe{sup 2+} cation content. The most probable causes and mechanism of formation of the magnetic state of the (FeIn{sub 2}S{sub 4}){sub 1-x}(In{sub 2}S{sub 3}){sub x} crystals are discussed.

  16. Structure symmetry determination and magnetic evolution in Sr2Ir1–xRhxO4sub>

    SciTech Connect

    Ye, Feng; Wang, Xiaoping; Hoffmann, Christina; Wang, Jinchen; Chi, Songxue; Matsuda, Masaaki; Chakoumakos, Bryan C.; Fernandez-Baca, Jaime A.; Cao, Gang

    2015-11-23

    We use single-crystal neutron diffraction to determine the crystal structure symmetry and to study the magnetic evolution in the rhodium doped iridates Sr2Ir1–xRhxO4sub> (0 ≤ x ≤ 0.16). Throughout this doping range, the crystal structure retains a tetragonal symmetry (space group I4<sub>1/a) with two distinct magnetic Ir sites in the unit cell forming staggered IrO6 rotation. Upon Rh doping, the magnetic order is suppressed and the magnetic moment of Ir4+ is reduced from 0.21 μB/Ir for x = 0 to 0.18 μB/Ir for x = 0.12. As a result, the magnetic structure at x = 0.12 is different from that of the parent compound while the moments remain in the basal plane.

  17. Stabilization of heterogeneous silicon lasers using Pound-Drever-Hall locking to Si3N4sub> ring resonators.

    PubMed

    Spencer, Daryl T; Davenport, Michael L; Komljenovic, Tin; Srinivasan, Sudharsanan; Bowers, John E

    2016-06-13

    Recent results on heterogeneous Si/III-V lasers and ultra-high Q Si3N4sub> resonators are implemented in a Pound-Drever-Hall frequency stabilization system to yield narrow linewidth characteristics for a stable on-chip laser reference. The high frequency filtering is performed with Si resonant mirrors in the laser cavity. To suppress close in noise and frequency walk off, the laser is locked to an ultra-high Q Si3N4sub> resonator with a 30 million quality factor. The laser shows high frequency noise levels of 60 × 103 Hz2/Hz corresponding to 160 kHz linewidth, and the low frequency noise is suppressed 33 dB to 103 Hz2/Hz with the PDH system. PMID:27410367

  18. Detecting the H3F3A mutant allele found in high-grade pediatric glioma by real-time PCR.

    PubMed

    Zhang, Ray; Han, Jing; Daniels, David; Huang, Haojie; Zhang, Zhiguo

    2016-01-01

    Diffuse intrinsic pontine glioma (DIPG) is an aggressive pediatric brain tumor with a median survival of 1 year after diagnosis. It has been reported recently that about 80% of DIPG cases and 70% of midline glioblastomas contain a mutation at one allele of the H3F3A gene (encoding histone H3 variant H3.3), replacing the lysine 27 with methionine (K27M). In order to facilitate diagnosis of DIPG patients, a quick and reliable method to identify the H3F3A K27M mutation is needed. Here, we describe a real-time PCR-based procedure involving a mutant-specific primer, a blocker oligonucleotide, and a reverse primer that can differentiate samples with H3F3A K27M mutation from those that do not. We first tested four different mutant-specific primers for their ability to selectively amplify H3F3A K27M-mutant allele and found that one primer amplified the mutant allele more efficiently than the rest. We then determined the optimal concentration of blocker oligo that significantly improved amplification of the H3F3A K27M-mutant allele. Using this optimized real-time PCR assay, we analyzed eleven samples, two of which containing H3F3A K27M mutation, and found that these two samples were differentially amplified from the nine others. In addition, we were able to discern the H3F3A K27M mutation in a newly obtained pediatric brainstem glioblastoma sample whose H3.3 status was not known previously, and in three other DIPG samples as well as paraffin embedded samples. These results demonstrate that we have developed a new reliable procedure for detecting the H3F3A K27M mutation in pediatric glioblastoma patient samples. PMID:26376656

  19. Unexpected metal ion-assisted transformations leading to unexplored bridging ligands in Ni(II) coordination chemistry: the case of PO3F(2-) group.

    PubMed

    Dermitzaki, Despina; Raptopoulou, Catherine P; Psycharis, Vassilis; Escuer, Albert; Perlepes, Spyros P; Stamatatos, Theocharis C

    2014-10-21

    The initial 'accidental', metal ion-assisted hydrolysis of PF6(-) to PO3F(2-) has been evolved in a systematic investigation of the bridging affinity of the latter group in Ni(II)/oximate chemistry; mono-, di- and trinuclear complexes have been prepared and confirmed both the rich reactivity of PO3F(2-) and its potential for further use as bridging ligand in high-nuclearity 3d-metal cluster chemistry.

  20. Disposition of cocaine and norcocaine in blood and tissues of B6C3F1 mice.

    PubMed

    Kump, D F; Matulka, R A; Edinboro, L E; Poklis, A; Holsapple, M P

    1994-10-01

    The biodisposition of cocaine and norcocaine in blood and tissues of immunological importance in B6C3F1 mice following exposure to cocaine or cocaine plus an organophosphate esterase inhibitor, diazinon, is presented. Analysis of specimens was by gas chromatography-mass spectrometry. Results from these studies indicate that pretreatment with diazinon significantly increases cocaine and norcocaine concentrations in the blood, spleen, thymus, and liver. Following acute exposure to cocaine-diazinon, cocaine was found in the spleen and thymus up to 1 hour after exposure. Norcocaine was not detected at this time. Following 7-day exposure to cocaine-diazinon, both cocaine and norcocaine were found in liver, blood, and spleen up to 1 hour after the last exposure; however, only cocaine was detected in the thymus at 1 hour. Cocaine and norcocaine were not detected in any tissues 24 hours after the last exposure.

  1. Yb(3+):BaCaBO3F: A potential new self-frequency-doubling laser material

    NASA Astrophysics Data System (ADS)

    Schaffers, K. I.; Deloach, L. D.; Ebbers, C. A.; Payne, S. A.

    1995-03-01

    Yb:BaCaBO3F (Yb:BCBF) has been investigated as a new laser crystal with potential for self-frequency-doubling. A Yb:BCBF laser has been pumped at 912 mm, and a measured slope efficiency of 38% has been obtained for the fundamental laser output at 1034 nm. Single crystal powders of BCBF have been compared with KD*P (KD2PO4) for a relative measure of the second harmonic generating potential, yielding d(sub eff)(BCBF) = (0.66)d(sub eff)(KD*P). The growth, spectroscopy, laser performance, and linear and nonlinear optical properties of Yb:BCBF are reported here.

  2. Anomalous Hall hysteresis in T m3F e5O12/Pt with strain-induced perpendicular magnetic anisotropy

    NASA Astrophysics Data System (ADS)

    Tang, Chi; Sellappan, Pathikumar; Liu, Yawen; Xu, Yadong; Garay, Javier E.; Shi, Jing

    2016-10-01

    We demonstrate robust interface strain-induced perpendicular magnetic anisotropy in atomically flat ferrimagnetic insulator T m3F e5O12 (TIG) films grown with pulsed laser deposition on a substituted G d3G a5O12 substrate which maximizes the tensile strain at the interface. In bilayers consisting of Pt and TIG, we observe large squared Hall hysteresis loops over a wide range of thicknesses of Pt at room temperature. When a thin Cu layer is inserted between Pt and TIG, the Hall hysteresis magnitude decays but stays finite as the thickness of Cu increases up to 5 nm. However, if the Cu layer is placed atop Pt instead, the Hall hysteresis magnitude is consistently larger than when the Cu layer with the same thickness is inserted in between for all Cu thicknesses. These results suggest that both the proximity-induced ferromagnetism and spin current contribute to the anomalous Hall effect.

  3. The vacuum UV photoabsorption spectroscopy of vinyl fluoride (C 2H 3F): The vibrational fine structure and its analysis

    NASA Astrophysics Data System (ADS)

    Locht, R.; Leyh, B.; Dehareng, D.; Jochims, H. W.; Baumgärtel, H.

    2009-08-01

    The vacuum UV photoabsorption spectrum of C 2H 3F has been examined in detail between 6 eV and 25 eV photon energy by using synchrotron radiation. The analysis of the data is supported by ab initio quantum mechanical calculations applied to valence and Rydberg excited states of C 2H 3F. At 7.6 eV the π → π ∗ and the 2a″ → 3s transitions are observed. An analysis is proposed and applied to the mixed fine structure belonging to these transitions. For the π → π ∗ transition one single long vibrational progression is observed with hcω e = 95 ± 7 meV (766 ± 56 cm -1) and its adiabatic excitation energy is 6.892 eV (55 588 cm -1). The 2a″ → 3s transition is characterized by a single short progression with hcω e = 167 ± 10 meV (1350 ± 80 cm -1) starting at 6.974 eV (56 249 cm -1). From the present ab initio calculations these two wavenumbers best correspond to the vibrational modes v9 (CH 2 rock in-plane, FCC-bend) and v6 (CH 2 rock in-plane, CF stretch) calculated at 615 cm -1 in the π ∗ state and 1315 cm -1 in the ( 2A″)3s Rydberg state respectively. The C dbnd C stretching could not be excluded. The dense structured spectrum observed between 8.0 eV and 10.5 eV has been analyzed in terms of vibronic transitions to Rydberg states all converging to the CHF(X˜A) ionic ground state. An analysis of the associated complex fine structure of the individual Rydberg states has been attempted providing average values of the wavenumbers, e.g., for the ( 2A″)3p Rydberg state hcω9 = 60 ± 1 meV (or 484 ± 8 cm -1), hcω7 = 151 ± 7 meV (or 1218 ± 60 cm -1), hcω4 = 191 ± 3 meV (or 1540 ± 24 cm -1). The assignment of hcω = 105 ± 5 meV (or 823 ± 40 cm -1) is discussed. These experimental values are in good agreement with the theoretical predictions for C 2H 3F + [R. Locht, B. Leyh, D. Dehareng, K. Hottmann, H. Baumgärtel, Chem. Phys. (in press)]. Above 10.5 eV and up to 25 eV several broad and strong bands are tentatively assigned to

  4. Multi-wavelength Yb:YAG/Nd3+:YVO4sub> continuous-wave microchip Raman laser.

    PubMed

    Wang, Xiao-Lei; Dong, Jun; Wang, Xiao-Jie; Xu, Jie; Ueda, Ken-Ichi; Kaminskii, Alexander A

    2016-08-01

    Multi-wavelength continuous-wave (CW) Raman lasers in a laser diode pumped Yb:YAG/Nd3+:YVO4sub> microchip Raman laser have been demonstrated for the first time to our best knowledge. The multi-wavelength laser of the first Stokes radiation around 1.08 μm has been achieved with a Raman shift of 261  cm-1 for a-cut Nd:YVO4sub> crystal corresponding to the fundamental wavelength at 1.05 μm. Multi-wavelength laser operation simultaneously around 1.05 and 1.08 μm has been achieved under the incident pump power between 1.5 and 1.7 W. Multi-wavelength Raman laser with frequency separation of 1 THz around 1.08 μm has been obtained when the incident pump power is higher than 1.7 W. The maximum Raman laser output power of 260 mW at 1.08 μm is obtained and the corresponding optical-to-optical conversion efficiency is 4.2%. Elliptically polarized fundamental laser and linearly polarized Raman laser were observed in an Yb:YAG/Nd:YVO4sub> CW microchip Raman laser. The experimental results of linearly polarized, multi-wavelength Yb:YAG/Nd:YVO4sub> CW microchip Raman laser with adjustable frequency separation provide a novel approach for developing potential compact laser sources for Terahertz generation. PMID:27472618

  5. Lasing properties of sodium-gadolinium tungstate NaGd(WO{sub 4}){sub 2} crystals doped with Tm{sup 3+} ions

    SciTech Connect

    Zharikov, Evgeny V; Lis, Denis A; Popov, A V; Subbotin, Kirill A; Ushakov, S N; Shestakov, A V; Razdobreev, I M

    2006-06-30

    Lasing is obtained in Tm{sup 3+}-doped sodium-gadolinium tungstate NaGd(WO{sub 4}){sub 2} crystals longitudinally pumped by pulses from a laser diode bar. The slope lasing efficiency is 16%. Lasing was observed at wavelengths of 1957, 1944, 1936, and 1901 nm for the transmission coefficients of the output mirror T{sub out} = 0.3%, 1.4%, 3.3%, and 8.5%, respectively. (lasers)

  6. Electric-field-induced linear birefringence in TmAl3(BO3)4sub>.

    PubMed

    Pashchenko, M I; Bedarev, V A; Merenkov, D N; Gnatchenko, S L; Bezmaternykh, L N; Sukhachev, A L; Temerov, V L

    2016-04-20

    The linear birefringence induced by the electric field was first detected in a TmAl3(BO3)4sub> single crystal. The electric field dependence of the birefringence was investigated. The estimation of the electro-optical coefficient of the material gives ≈1.5×10-10  cm/V for a wavelength 632.8 nm. PMID:27140114

  7. Chronic toxicity and tumorigenicity study of aluminum potassium sulfate in B6C3F1 mice.

    PubMed

    Oneda, S; Takasaki, T; Kuriwaki, K; Ohi, Y; Umekita, Y; Hatanaka, S; Fujiyoshi, T; Yoshida, A; Yoshida, H

    1994-01-01

    The tumorigenic potential of aluminum potassium sulfate [A1K (SO4)2 12H2O, APS], a compound which exists widely in the environment, was investigated in B6C3F1 mice. APS was administered in the diet for 20 months at dose levels of 1.0, 2.5, 5.0 and 10.0% (w/w). One group receiving the basal diet served as the control. Body weight gain in both sexes was decreased in the 10.0% APS treated group, and increased in the 1.0 and 2.5% APS treated groups. The survival rates at the end of the dosing period were 73.3% (male) and 78.3% (female) in the control group, and 86.7-95.0% (male) and 86.7-91.7% (female) in the APS treated groups. The survival rate showed a tendency to increase in both sexes in all the APS treated groups. In the tumor pathology, the incidence of hepatocellular carcinoma was significantly decreased in the males in the 10% APS treated group. The incidence of hepatocellular carcinoma was significantly decreased in females in all groups including the control group. As regards the nontumorous pathology, the incidence of myocardial eosinophilic cytoplasm showed a significant dose-dependent decrease in males in the APS treated groups. A comparison between the sexes revealed a significant decrease in the incidence of hepatocytic anisonucleosis, myocardial eosinophilic cytoplasm and acinar cell vacuolation of the submandibular gland in the females; and lymphocyte infiltration in renal cortex and pelvis, and vacuolation of cerebellar white matter were noted in the males. The results of the present study indicate that long-term administration of APS does not exert tumorigenic or any other toxic actions in B6C3F1 mice.

  8. Optical emission spectroscopy and Langmuir probe diagnostics of CH{sub 3}F/O{sub 2} inductively coupled plasmas

    SciTech Connect

    Karakas, Erdinc; Donnelly, Vincent M.; Economou, Demetre J.

    2013-06-07

    A CH{sub 3}F:O{sub 2} (50%:50%) inductively coupled discharge, sustained in a compact plasma reactor, was investigated as a function of power (20-400 W) and pressure (9-30 mTorr), using optical emission spectroscopy and Langmuir probe measurements. The electron density increased linearly with power but only weakly with pressure. The effective electron temperature was nearly independent of power and pressure. The gas temperature, obtained from the rotational structure of N{sub 2} (C {yields} B) optical emission, increased from 400 to 900 K as a function of inductive mode power between 75 and 400 W at 10 mTorr. For constant feed gas flow, the absolute H, F, and O atom densities, estimated by optical emission rare gas actinometry, increased linearly with power. The absolute number density ratios H/Ar, F/Ar, and O/Ar, increased, decreased, and remained constant, respectively, with pressure. The H-atom density was estimated to be 5.4 Multiplication-Sign 10{sup 13} cm{sup -3} at 400 W and 10 mTorr (gas temperature = 900 K), implying a high degree of dissociation of the CH{sub 3}F feedstock gas. The F and O atom number densities were much lower (8.3 Multiplication-Sign 10{sup 12} cm{sup -3} and 5.9 Multiplication-Sign 10{sup 12} cm{sup -3}, respectively) for the same conditions, suggesting that most of the fluorine and oxygen is contained in reaction products HF, CO, CO{sub 2}, H{sub 2}O, and OH. The relative number densities of HF, CO, and CO{sub 2} were observed to first rapidly increase with power, and then reach a plateau or decay slightly at higher power. Reaction mechanisms were proposed to explain the observed behavior of the number density of F and HF vs. power and pressure.

  9. Genistein modulation of streptozotocin diabetes in male B6C3F1 mice can be induced by diet.

    PubMed

    Guo, Tai L; Wang, Yunbiao; Xiong, Tao; Ling, Xiao; Zheng, Jianfeng

    2014-11-01

    Diet and phytoestrogens affect the development and progression of diabetes. The objective of the present study was to determine if oral exposure to phytoestrogen genistein (GE) by gavage changed blood glucose levels (BGL) through immunomodulation in streptozotocin (STZ)-induced diabetic male B6C3F1 mice fed with three different diets. These three diets were: NTP-2000 diet (NTP), soy- and alfalfa-free 5K96 diet (SOF) and high fat diet (HFD) with 60% of kcal from fat, primarily rendered fat of swine. The dosing regimen for STZ consisted of three 100mg/kg doses (i.p.): the first dose was administered at approximately 2weeks following the initiation of daily GE (20mg/kg) gavage, and the second dose was on day 19 following the first dose, and the third dose was on day 57 following the first dose. In mice on the NTP diet, GE treatment decreased BGL with statistical significances observed on days 33 and 82 following the first STZ injection. In mice fed the HFD diet, GE treatment produced a significant decrease and a significant increase in BGL on days 15 and 89 following the first STZ injection, respectively. In mice fed the SOF diet, GE treatment had no significant effects on BGL. Although GE treatment affected phenotypic distributions of both splenocytes (T cells, B cells, natural killer cells and neutrophils) and thymocytes (CD4/CD8 and CD44/CD25), and their mitochondrial transmembrane potential and generation of reactive oxygen species, indicators of cell death (possibly apoptosis), GE modulation of neutrophils was more consistent with its diabetogenic or anti-diabetic potentials. The differential effects of GE on BGL in male B6C3F1 mice fed with three different diets with varied phytoestrogen contents suggest that the estrogenic properties of this compound may contribute to its modulation of diabetes. PMID:25178718

  10. Optical emission spectroscopy and Langmuir probe diagnostics of CH3F/O2 inductively coupled plasmas

    NASA Astrophysics Data System (ADS)

    Karakas, Erdinc; Donnelly, Vincent M.; Economou, Demetre J.

    2013-06-01

    A CH3F:O2 (50%:50%) inductively coupled discharge, sustained in a compact plasma reactor, was investigated as a function of power (20-400 W) and pressure (9-30 mTorr), using optical emission spectroscopy and Langmuir probe measurements. The electron density increased linearly with power but only weakly with pressure. The effective electron temperature was nearly independent of power and pressure. The gas temperature, obtained from the rotational structure of N2 (C → B) optical emission, increased from 400 to 900 K as a function of inductive mode power between 75 and 400 W at 10 mTorr. For constant feed gas flow, the absolute H, F, and O atom densities, estimated by optical emission rare gas actinometry, increased linearly with power. The absolute number density ratios H/Ar, F/Ar, and O/Ar, increased, decreased, and remained constant, respectively, with pressure. The H-atom density was estimated to be 5.4 × 1013 cm-3 at 400 W and 10 mTorr (gas temperature = 900 K), implying a high degree of dissociation of the CH3F feedstock gas. The F and O atom number densities were much lower (8.3 × 1012 cm-3 and 5.9 × 1012 cm-3, respectively) for the same conditions, suggesting that most of the fluorine and oxygen is contained in reaction products HF, CO, CO2, H2O, and OH. The relative number densities of HF, CO, and CO2 were observed to first rapidly increase with power, and then reach a plateau or decay slightly at higher power. Reaction mechanisms were proposed to explain the observed behavior of the number density of F and HF vs. power and pressure.

  11. Correlation of anisotropy and directional conduction in β-Li3PS4sub> fast Li+ conductor

    SciTech Connect

    Chen, Yan; Cai, Lu; Liu, Zengcai; dela Cruz, Clarina R.; Liang, Chengdu; An, Ke

    2015-07-06

    Our letter reports the correlation of anisotropy and directional conduction in the fast Li+ conductor β-Li3PS4sub>, one of the low-symmetry crystalline electrolyte candidates. The material has both high conductivity and good stability that serves well for the large-scale energy storage applications of all-solid-state lithium ion batteries. The anisotropic physical properties, demonstrated here by the thermal expansion coefficients, are crucial for compatibility in the solid-state system and battery performance. Neutron and X-ray powder diffraction measurements were done to determine the crystal structure and thermal stability. Moreover, the crystallographic b-axis was revealed as a fast expansion direction, while negligible thermal expansion was observed along the a-axis around the battery operating temperatures. The anisotropic behavior has its structural origin from the Li+ conduction channels with incomplete Li occupancy and a flexible connection of LiS4sub> and PS4sub> tetrahedra within the framework. This indicates a strong correlation in the direction of the ionic transport in the low-symmetry Li+ conductor.

  12. Organogold oligomers: Exploiting iClick and aurophilic cluster formation to prepare solution stable Au4sub> repeating units

    SciTech Connect

    Yang, Xi; Wang, Shanshan; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.

    2015-05-19

    A novel synthetic method to create gold based metallo–oligomers/polymers via the combination of inorganic click (iClick) with intermolecular aurophilic interactions is demonstrated. Complexes [PEt3Au]4sub>(μ-N3C2C6H5) (1) and [PPhMe2Au]4sub (μ-N3C2C6H5) (2) and {[PEt3Au]4sub>[(μ-N3C2)2-9,9-dihexyl-9H-fluorene]}n (8) have been synthesized via iClick. The tetranuclear structures of 1 and 2, induced by aurophilic bonding, are confirmed in the solid state through single crystal X-ray diffraction experiments and in solution via variable temperature NMR spectroscopy. The extended 1D structure of 8 is constructed by aurophilic induced self-assembly. 1H DOSY NMR analysis reveals that the aurophilic bonds in 1, 2, and 8 are retained in the solution phase. The degree of polymerization within complex 8 is temperature and concentration dependent, as determined by 1H DOSY NMR. The complex 8 is a rare example of a solution stable higher ordered structure linked by aurophilic interactions.

  13. Synthesis, crystal growth, structural and magnetic characterization of NH4sub>MCl2(HCOO), M=(Fe, Co, Ni)

    SciTech Connect

    Greenfield, Joshua T.; Ovidiu Garlea, V.; Kamali, Saeed; Chen, Michael; Kovnir, Kirill

    2015-09-24

    In this paper, an ambient-pressure solution route and an improved solvothermal synthetic method have been developed to produce polycrystalline powders and large single crystals of NH4sub>MCl2(HCOO) (M=Fe, Co, Ni). The magnetic structure of the 1D linear chain compound NH4sub>FeCl2(HCOO) has been determined by low-temperature neutron powder diffraction, revealing ferromagnetic intra-chain interactions and antiferromagnetic inter-chain interactions. Finally, the newly-reported Co and Ni analogs are isostructural with NH4sub>FeCl2(HCOO), but there are significant differences in the magnetic properties of each compound; the Ni analog behaves similarly to the Fe compound but with stronger magnetic coupling, exhibiting antiferromagnetic ordering (TN=8.5 K) and a broad metamagnetic transition between 2 and 5 T, while the Co analog does not order magnetically above 2 K, despite strong antiferromagnetic nearest-neighbor interactions.

  14. New insulating antiferromagnetic quaternary iridates MLa10Ir4sub>O24 (M=Sr, Ba)

    SciTech Connect

    Zhao, Qingbiao; Han, Fei; Stoumpos, Constantinos C.; Han, Tian -Heng; Li, Hao; Mitchell, J. F.

    2015-07-01

    Recently, oxides of Ir4+ have received renewed attention in the condensed matter physics community, as it has been reported that certain iridates have a strongly spin-orbital coupled (SOC) electronic state, Jeff = ½, that defines the electronic and magnetic properties. The canonical example is the Ruddlesden-Popper compound Sr2IrO4sub>, which has been suggested as a potential route to a new class of high temperature superconductor due to the formal analogy between Jeff = ½ and the S = ½ state of the cuprate superconductors. The quest for other iridium oxides that present tests of the underlying SOC physics is underway. In this spirit, here we report the synthesis and physical properties of two new quaternary tetravalent iridates, MLa10Ir4sub>O24 (M = Sr, Ba). The crystal structure of both compounds features isolated IrO6 octahedra in which the electronic configuration of Ir is d5. As a result, both compounds order antiferromagnetically despite the lack of obvious superexchange pathways, and resistivity measurement shows that SrLa10Ir4sub>O24 is an insulator.

  15. Color tunable and thermally stable luminescence of Tb{sup 3+} doped Li{sub 4}SrCa(SiO{sub 4}){sub 2} phosphors

    SciTech Connect

    Zhang, Xinmin; Seo, Hyo Jin

    2012-08-15

    Highlights: ► Lowest spin-allowed and spin-forbidden f–d transitions locate at 250 and 280 nm. ► Cross relaxation shortens lifetime of {sup 5}D{sub 3} level, while that of {sup 5}D{sub 4} are unaffected. ► Cross-relaxation can explain concentration quenching of the {sup 5}D{sub 3} emission. ► Dipole–quadrupole interaction is responsible for the non-radiative relaxation. ► Li{sub 4}SrCa(SiO{sub 4}){sub 2}:Tb{sup 3+} is thermally stable and color tunable phosphor. -- Abstract: Tb{sup 3+} ions activated Li{sub 4}SrCa(SiO{sub 4}){sub 2} phosphors were synthesized using a solid state reaction method. The phase impurity was checked by XRD. The photoluminescence (PL) excitation spectrum, emission spectra at room and high temperature, decay curves of samples with different Tb{sup 3+} ions concentration were studied in detail. Cross-relaxation and the Inokuti–Hirayama model were used to analyze the experimental results. Li{sub 4}SrCa(SiO{sub 4}){sub 2}:xTb{sup 3+} are thermally stable and color tunable phosphors.

  16. Magnetic excitations in the spin-1/2 triangular-lattice antiferromagnet Cs2CuBr4sub>

    SciTech Connect

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

    2015-11-27

    We present on high- field electron spin resonance (ESR) studies of magnetic excitations in the spin- 1/2 triangular-lattice antiferromagnet Cs2CuBr4sub>. Frequency- field diagrams of ESR excitations are measured for different orientations of magnetic fields up to 25 T. We show that the substantial zero- field energy gap, Δ ≈ 9.5 K, observed in the low-temperature excitation spectrum of Cs2CuBr4sub> [Zvyagin et al:, Phys. Rev. Lett. 112, 077206 (2014)], is present well above TN. Noticeably, the transition into the long-range magnetically ordered phase does not significantly affect the size of the gap, suggesting that even below TN the high-energy spin dynamics in Cs2CuBr4sub> is determined by short-range-order spin correlations. The experimental data are compared with results of model spin-wave-theory calculations for spin-1/2 triangle-lattice antiferromagnet.

  17. Graphene oxide wrapped Ag{sub 3}PO{sub 4} sub-microparticles with highly enhanced photocatalytic activity and stability under visible light irradiation

    SciTech Connect

    Xiu, Zhiliang; Wu, Yongzhong; Hao, Xiaopeng; Lu, Qifang; Liu, Suwen

    2014-11-15

    Highlights: • Graphene oxide wrapped Ag{sub 3}PO{sub 4} sub-microparticles were prepared. • The photocatalytic activity of Ag{sub 3}PO{sub 4} is increased by 6 times by GO wrapping. • The hybrid photocatalysts exhibited excellent stability. - Abstract: Graphene oxide (GO) wrapped Ag{sub 3}PO{sub 4} sub-microparticles were prepared by in situ deposition–precipitation method. By hybridization of Ag{sub 3}PO{sub 4} with GO nanosheets, a 6-fold enhancement in the photodegradation rate toward orange methyl (MO) under visible light irradiation (λ ≥ 420 nm) was observed compared with the pure Ag{sub 3}PO{sub 4} sub-microsparticles. The hybrid photocatalysts also exhibited excellent stability in the successive MO degradation experiments. The highly enhanced photocatalytic activity and stability were mainly attributed to the quick transfer of the photogenerated electrons from Ag{sub 3}PO{sub 4} to GO nanosheets, which could effectively suppress the electron–hole pairs recombination and thus inhibit the photocorrosion of Ag{sub 3}PO{sub 4}. These high-efficient and stable hybrid photocatalysts were expected to show considerable potential applications in wastewater treatment and water splitting.

  18. Phase formation in the Li{sub 2}MoO{sub 4}–Rb{sub 2}MoO{sub 4}–Fe{sub 2}(MoO{sub 4}){sub 3} system and crystal structure of a novel triple molybdate LiRb{sub 2}Fe(MoO{sub 4}){sub 3}

    SciTech Connect

    Khal'baeva, Klara M.; Solodovnikov, Sergey F.; Khaikina, Elena G.; Kadyrova, Yuliya M.; Solodovnikova, Zoya A.; Basovich, Olga M.

    2013-07-15

    X-ray investigation of solid state interaction of the components in the Li{sub 2}MoO{sub 4}–Rb{sub 2}MoO{sub 4}–Fe{sub 2}(MoO{sub 4}){sub 3} system was carried out, and a subsolidus phase diagram of the said system was constructed. The subsystem Rb{sub 2}MoO{sub 4}–LiRbMoO{sub 4}–RbFe(MoO{sub 4}){sub 2} was shown to be non-quasiternary. Formation of a novel triple molybdate LiRb{sub 2}Fe(MoO{sub 4}){sub 3} was established, conditions of solid state synthesis and crystallization of the compound were found. Its crystal structure (orthorhombic, space group Pnma, Z=4, a=24.3956(6), b=5.8306(1), c=8.4368(2) Å) represents a new structure type and includes infinite two-row ribbons ([Fe(MoO{sub 4}){sub 3}]{sup 3−}){sub ∞} parallel to the b axis and composed of FeO{sub 6} octahedra, terminal Mo(3)O{sub 4} tetrahedra, and bridge Mo(1)O{sub 4} and Mo(2)O{sub 4} tetrahedra connecting two or three FeO{sub 6} octahedra. The ribbons are connected to form 3D framework via corner-sharing LiO{sub 4} tetrahedra. Rubidium cations are 11- and 13-coordinated and located in cavities of this heterogeneous polyhedral framework. - Graphical abstract: Exploring the Li{sub 2}MoO{sub 4}–Rb{sub 2}MoO{sub 4}–Fe{sub 2}(MoO{sub 4}){sub 3} system showed its partial non-quasiternarity and revealed a new compound LiRb{sub 2}Fe(MoO{sub 4}){sub 3} which was structurally studied. - Highlights: • The Li{sub 2}MoO{sub 4}–Rb{sub 2}MoO{sub 4}–Fe{sub 2}(MoO{sub 4}){sub 3} system study revealed a new compound LiRb{sub 2}Fe(MoO{sub 4}){sub 3}. • Its structure of a new type includes ribbons of FeO{sub 6} octahedra and MoO{sub 4} tetrahedra. • The ribbons are connected into a 3D framework via corner-sharing LiO{sub 4} tetrahedra.

  19. Saltpotentin Version3.f

    2008-06-25

    The program inverts gravity and/or gravity gradient, and/or magnetic field (magnitude, in direction of Earth's magnetic field), at a number of points, for the position of bottom of a layer, in a structure with one or multiple layers of a uniform material (e.g., salt) in a host of known (and possibly varying) background density an/or susceptibility, is specified over a 3-D collection of rectangular blocks. For marine applications, water density (and/or susceptibility) and bathmetry ismore » also specified. The interface found is the smoothest found for its level of data misfit, with the desired level of data misfie set as an input parameter. The densities and susceptibilites used for a block depend on its position relative to the interfaces. The first interface give the sea floor position. Blocks above the sea floor are treated as having the wate density and susceptibility given by the background density and susceptibility specified over the 3-D grid of blocks. For 1 even, blocks between the 1'th and 1+1'h interfaces are treated as having a uniform density and susceptibility specified as an input parameter.« less

  20. On the role of the VO(H{sub 2}PO{sub 4}){sub 2} precursor for n-butane oxidation into maleic anhydride

    SciTech Connect

    Sananes, M.T. |; Hutchings, G.J.; Volta, J.C.

    1995-07-01

    The catalytic role of VO(H{sub 2}PO{sub 4}){sub 2}, the precursor of the VO(PO{sub 3}){sub 2} phase, has been studied for N-butane oxidation to maleic anhydride. By comparison with the activated VPO catalyst, derived from the VOHPO{sub 4} {center_dot} 0.5H{sub 2}O precursor phase, VO(H{sub 2}PO{sub 4}){sub 2} gives a highly selective final catalyst. The total oxidation products CO and CO{sub 2} are not observed under any of the conditions examined, a result confirmed by extensive catalyst testing and carbon mass balances. The final catalyst derived from VO(H{sub 2}PO{sub 4}){sub 2} has a low surface area, ca. 1 m{sup 2}/g, and consequently demonstrates low specific activity on the basis of n-butane conversion per unit mass. However, the intrinsic activity (activity per unit surface area) is found to be higher than that for catalysts derived from VOHPO{sub 4}{center_dot}0.5H{sub 2}O. Since some VO(H{sub 2}PO{sub 4}){sub 2} is present in VOHPO{sub 4}{center_dot}0.5H{sub 2}O, which is the precursor of the industrial catalyst, the results of this study complicate the simple model in which the (VO){sub 2}O{sub 7} phase derived from VOHPO{sub 4} {center_dot}0.5H{sub 2}O is responsible for the selective oxidation of n-butane. The observation that the precursor VO(H{sub 2}PO{sub 4}){sub 2} can generate catalysts of high specific activity and of total selectivity to partial oxidation products might provide a useful insight into the design of a new series of high activity and high selectivity partial oxidation catalysts. 36 refs., 12 figs., 2 tabs.

  1. A comparative study of Ir(III) complexes with pyrazino[2,3-f][1,10]phenanthroline and pyrazino[2,3-f][4,7]phenanthroline ligands in light-emitting electrochemical cells (LECs).

    PubMed

    González, Iván; Dreyse, Paulina; Cortés-Arriagada, Diego; Sundararajan, Mahesh; Morgado, Claudio; Brito, Iván; Roldán-Carmona, Cristina; Bolink, Henk J; Loeb, Bárbara

    2015-09-01

    We report the comparative study of the electrochemical and photoluminescent properties of two Ir(iii) complexes described as [Ir(F2ppy)2(N^N)][PF6], where the F2ppy ligand is 2-(2,4-difluorophenyl)pyridine and the N^N ligands are pyrazino[2,3-f][1,10]phenanthroline (ppl) and pyrazino[2,3-f][4,7]phenanthroline (ppz). The complexes were used for the fabrication of light-emitting electrochemical cells (LECs). The structures of the complexes have been corroborated by X-ray crystallography. Theoretical calculations were performed to understand the photophysical behavior of the complexes. Both in solution and solid state, the photoluminescence spectra shows that emission is significantly red-shifted in the [Ir(F2ppy)2(ppz)][PF6] complex compared with the [Ir(F2ppy)2(ppl)][PF6] complex. Besides, the [Ir(F2ppy)2(ppl)][PF6] complex exhibits a higher quantum yield and a longer excited state lifetime than the [Ir(F2ppy)2(ppz)][PF6] complex; therefore, in the last case non-radiative decay is predominant due to the stabilization of LUMO orbital (energy gap law). In the fabrication of LEC devices with the [Ir(F2ppy)2(ppl)][PF6] complex, light emission was obtained with a maximum value of luminance equal to 177 cd m(-2), while in the case of the [Ir(F2ppy)2(ppz)][PF6] complex, no luminance was observed. According to the photophysical data, the performance in LEC devices could be explained by the different position of the nitrogens in the ppl and ppz structural isomers, electronically affecting the complex, and therefore its properties. In addition, from the crystallographic analysis it is possible to note that the [Ir(F2ppy)2(ppz)][PF6] complex shows enhanced intermolecular and intramolecular interactions compared with [Ir(F2ppy)2(ppl)][PF6], and consequently a higher ordering of the molecules in the complex with ppz ligand can be expected. This higher order could favour the quenching processes, and consequently enhance the non-radiative deactivation. PMID:26219438

  2. Structural, electronic and optical properties of novel carbonate fluorides ABCO{sub 3}F (A=K, Rb, Cs; B=Ca, Sr)

    SciTech Connect

    Narsimha Rao, E.; Appalakondaiah, S.; Yedukondalu, N.; Vaitheeswaran, G.

    2014-04-01

    In the present study, we performed first principles calculations on the electronic and optical properties of layered alkali–alkaline earth carbonate fluorides which attract attention in the domain of nonlinear optics. The calculated lattice parameters and volumes with and without inclusion of van der Waals (vdW) correction methods to standard density functional methods were compared with experiments. We observed that vdW interactions are predominant in RbCaCO{sub 3}F and CsCaCO{sub 3}F as compared with other computed compounds. The calculated bulk modulus from single crystal elastic constants reveals that these materials are all relatively harder than the KH{sub 2}PO{sub 4} (KDP) crystal. We also found that these materials are wide band gap insulators as obtained from Tran–Blaha modified Becke–Johnson potential. The linear optical properties such as dielectric function, refractive indices, birefringence and absorption spectra are presented. Finally, the calculated birefringence values indicate that these crystals could be promising for producing phase matching in the deep ultra-violet region. - Graphical abstract: The co- and anti-parallel alignment of CO{sub 3} groups leads to larger and smaller SHG coefficients in (a) KCaCO{sub 3}F, (b) KSrCO{sub 3}F, (c) RbSrCO{sub 3}F, (d) RbCaCO{sub 3}F, and (e) CsCaCO{sub 3}F. - Highlights: • Effect of van der Waals interactions on structural properties. • Single-crystalline elastic constants and mechanical stability. • Electronic properties. • Linear optical properties. • Comparison of present computed compounds with other well known materials in non-linear optical materials.

  3. Structural, electronic and thermodynamic properties of britholites Ca{sub 10−x}La{sub x}(PO{sub 4}){sub 6−x}(SiO{sub 4}){sub x}F{sub 2} (0 ≤ x ≤ 6): Experiment and theory

    SciTech Connect

    Njema, H.; Debbichi, M.; Boughzala, K.; Said, M.; Bouzouita, K.

    2014-03-01

    Highlights: • The structural and electronic properties of apatites with the general formula Ca{sub 10−x}La{sub x}(PO{sub 4}){sub 6−x}(SiO{sub 4}){sub x}F{sub 2} (0 ≤ x ≤ 6) have been investigated by means of the density functional theory. • The calculated enthalpy of formation of the compounds increased with the substitution degree. • The decrease in stability is probably due to the disorder induced in the Ca/LaO{sub 6}F polyhedron, following the substitution. - Abstract: The apatite-type compounds Ca{sub 10−x}La{sub x}(PO{sub 4}){sub 6−x}(SiO{sub 4}){sub x}F{sub 2} with 0 ≤ x ≤ 6 were prepared using a high temperature solid state reaction and were characterized by X-ray diffraction. The crystal structure, chemical bonding, electronic structure and formation energy of all relaxed structures were analyzed by density functional theory (DFT). The calculated results show that the predicted geometry can well reproduce the structural parameters. The incorporation of La{sup 3+} into the fluorapatite (FA) structure induced especially at the level of the S(2) sites a certain disorder which is responsible for the weakening in the stability with x. Excellent agreement were obtained between the calculated and experimental results. Moreover, the band structure indicates that despite the reduction of the band gap with x content all materials remain insulating.

  4. Crystal structures of alkali-metal indium (III) phosphates of [M{sub 3}In(PO{sub 4}){sub 2}]{sub n} (M=K, n=10; M=Rb, n=2) compounds, and band structures and chemical bond properties of [Rb{sub 3}In(PO{sub 4}){sub 2}]{sub 2} crystal

    SciTech Connect

    Zhang Yongchun; Cheng Wendan . E-mail: cwd@ms.fjirsm.ac.cn; Wu Dongsheng

    2006-01-15

    Ternary indium (III) phosphates with three-dimensional frameworks, [M{sub 3}In(PO{sub 4}){sub 2}]{sub n} (M=K, n=10; M=Rb, n=2), are found and firstly reported in this paper. These compounds have been obtained by high temperature solid-state reactions and their crystal structures have been determined by single crystal X-ray diffraction analysis. The title compounds, which crystallize in monoclinic system, possess the same [In(PO{sub 4}){sub 2}]{sub n}{sup 3n-} anionic frameworks built up from interconnected InO{sub 6} octahedra and PO{sub 4} tetrahedra and have an interesting tunnel structure where M{sup +} cations are located. Optical and bonding properties of [Rb{sub 3}In(PO{sub 4}){sub 2}]{sub 2} are investigated in terms of measured absorption and emission spectra, and calculated band structures and density of states. The crystal band structures obtained by the DFT method show that the solid compound of [Rb{sub 3}In(PO{sub 4}){sub 2}]{sub 2} is an insulator with direct band gap, and the P-O covalent bond characters are larger than the In-O ones in this compound.

  5. Synthesis, crystal structure and optical properties of the new lead fluoride borate-Pb{sub 2}BO{sub 3}F

    SciTech Connect

    Zhao Wenwu; Pan Shilie; Han Jian; Yao Jiyong; Yang Yun; Li Junjie; Zhang Min; Zhang Lianhan; Hang Yin

    2011-11-15

    A new compound, Pb{sub 2}BO{sub 3}F, has been grown by high temperature solution method from the PbO-PbF{sub 2}-B{sub 2}O{sub 3} system for the first time. The crystal structure of this compound has been identified by single crystal X-ray diffraction analysis. It crystallizes in the hexagonal system, space group P6{sub 3}/m (No. 176) with unit-cell parameters a=7.2460(3) A, c=14.5521(17) A, Z=6, V=661.69(9) A{sup 3}. Its structure was solved by the direct methods and refined to R{sub 1}=0.0163 and wR{sub 2}=0.0367. The structure of Pb{sub 2}BO{sub 3}F consists of the distorted PbO{sub 3}F{sub 2} groups and BO{sub 3} triangles, which are all symmetric with each other in the gestalt structure to the extent that the Pb{sub 2}BO{sub 3}F compound crystallizes in the symmetric space group. The powder X-ray diffraction pattern of the Pb{sub 2}BO{sub 3}F has been measured. The BO{sub 3} functional groups presented in the sample were identified by FTIR spectrum. The DTA curve of Pb{sub 2}BO{sub 3}F suggests that Pb{sub 2}BO{sub 3}F melts congruently at 448 deg. C. - Graphical Abstract: The Pb atoms are in the five coordination environments bonded to three O atoms and two F atoms to make up the distortional PbO{sub 3}F{sub 2} polyhedra. Every six PbO{sub 3}F{sub 2} polyhedra are connected by one F(1) atom to form the symmetrical structure, and then the distortion of the PbO{sub 3}F{sub 2} polyhedra is offset. Highlights: > A new compound, Pb{sub 2}BO{sub 3}F, has been grown by high temperature solution method from the PbO-PbF{sub 2}-B{sub 2}O{sub 3} system for the first time. > It crystallizes in the hexagonal system, space group P6{sub 3}/m (No. 176) with unit-cell parameters a=7.2460(3) A, c=14.5521(17) A, Z=6, V=661.69(9) A{sup 3}. > UV-vis-NIR Diffuse-Reflectance spectrum shows that its ultraviolet cutoff edge is about 288 nm. > DTA curve of Pb{sub 2}BO{sub 3}F suggests that Pb{sub 2}BO{sub 3}F melts congruently at 448 deg. C.

  6. Preparation, biodistribution and dosimetry of copper-64-labeled anti-colorectal carcinoma monoclonal antibody fragments 1A3-F(ab{prime}){sub 2}

    SciTech Connect

    Anderson, C.J.; Schwarz, S.W.; Connett, J.M. ||

    1995-05-01

    Antibody fragments labeled with a radiometal using bifunctional chelates generally undergo renal clearance followed by trapping of the metabolites, leading to high radiation doses to the kidneys. Copper-64-labeled BAT-2IT-1A3-F(ab{prime}){sub 2} was recently reported to accumulate in colorectal tumors in an animal model, however, kidney uptake was also high. In this study, the preparation of {sup 64}Cu-BAT-2IT-1A3-F(ab{prime}){sub 2} was optimized to reduce the renal uptake. The bifunctional chelate 6-bromoacetamidobenzyl-1,4,8,11-tetraazacyclotetradecane-N,N{prime},N{double_prime},N{prime}{double_prime}-tetraacetic acid (BAT) was conjugated to 1A3-F(ab{prime}){sub 2} using the linking agent 2-iminothiolane (2IT). The conjugation reaction produced 20% of a lower molecular weight impurity found to be TETA-1A3-Fab{prime}. The conjugation procedure was optimized to include FPLC purification of the BAT-2IT-1A3-F(ab{prime}){sub 2} from TETA-1A3-Fab{prime} after conjugation prior to labeling with {sup 64}Cu. The biodistribution of {sup 64}Cu-labeled FPLC-purified and unpurified conjugates was determined in normal Sprague-Dawley rats and tumor-bearing Golden Syrian hamsters. Human absorbed doses were calculated from rat biodistribution data and PET imaging of a baboon. Upon FPLC purification of the BAT-2IT-1A3-F(ab{prime}){sub 2}, the immunoreactivity of {sup 64}Cu-labeled 1A3-F(ab{prime}){sub 2} was significantly improved over that of non-FPLC-purified {sup 64}Cu-BAT-2IT-1A3-F(ab{prime}){sub 2}, and the kidney uptake was decreased in normal rats. The biodistribution in hamsters showed some improvement in both tumor uptake and kidney clearance with FPLC-purified {sup 64}Cu-BAT-2IT-1A3-F(ab{prime}){sub 2}.The improved dosimetry of {sub 64}Cu-labeled FPLC purified BAT-2IT-1A3-F(ab{prime}){sub 2} should more readily allow this agent to be investigated clinically to image colorectal cancer using PET. 33 refs., 7 figs., 3 tabs.

  7. Superconductivity in the presence of disorder in skutterudite-related La3Co4sub>Sn13 and La3Ru4sub>Sn13 compounds: Electrical transport and magnetic studies

    SciTech Connect

    Slebarski, A.; Maska, M. M.; Fijalkowski, M.; McElroy, C. A.; Maple, M. B.

    2015-06-25

    La3Co4sub>Sn13 and La3Ru4sub>Sn13 were categorized as BCS superconductors. In a plot of the critical field Hc2 vs T, La3Ru4sub>Sn13 displays a second superconducting phase at the higher critical temperature Tc*, characteristic of inhomogeneous superconductors, while La3Co4sub>Sn13 shows bulk superconductivity below Tc. We observe a decrease in critical temperatures with external pressure and magnetic field for both compounds. Additionally, for La3Ru4sub>Sn13 we find that Tc*/dP>dTc/dP. The pressure dependences of Tc are interpreted according to the McMillan theory and understood to be a consequence of lattice stiffening. The investigation of the superconducting state of La3CoxRu4–xSn13 shows a Tc* that is larger then Tc for x < 4. Furthermore, this unique and unexpected observation is discussed as a result of the local disorder and/or the effect of chemical pressure when Ru atoms are partially replaced by smaller Co atoms.

  8. The transcription factor Pou3f1 promotes neural fate commitment via activation of neural lineage genes and inhibition of external signaling pathways.

    PubMed

    Zhu, Qingqing; Song, Lu; Peng, Guangdun; Sun, Na; Chen, Jun; Zhang, Ting; Sheng, Nengyin; Tang, Wei; Qian, Cheng; Qiao, Yunbo; Tang, Ke; Han, Jing-Dong Jackie; Li, Jinsong; Jing, Naihe

    2014-01-01

    The neural fate commitment of pluripotent stem cells requires the repression of extrinsic inhibitory signals and the activation of intrinsic positive transcription factors. However, how these two events are integrated to ensure appropriate neural conversion remains unclear. In this study, we showed that Pou3f1 is essential for the neural differentiation of mouse embryonic stem cells (ESCs), specifically during the transition from epiblast stem cells (EpiSCs) to neural progenitor cells (NPCs). Chimeric analysis showed that Pou3f1 knockdown leads to a markedly decreased incorporation of ESCs in the neuroectoderm. By contrast, Pou3f1-overexpressing ESC derivatives preferentially contribute to the neuroectoderm. Genome-wide ChIP-seq and RNA-seq analyses indicated that Pou3f1 is an upstream activator of neural lineage genes, and also is a repressor of BMP and Wnt signaling. Our results established that Pou3f1 promotes the neural fate commitment of pluripotent stem cells through a dual role, activating internal neural induction programs and antagonizing extrinsic neural inhibitory signals.

  9. Synthesis and evaluation of new antitumor 3-aminomethyl-4,11-dihydroxynaphtho[2,3-f]indole-5,10-diones.

    PubMed

    Shchekotikhin, Andrey E; Glazunova, Valeria A; Dezhenkova, Lyubov G; Luzikov, Yuri N; Buyanov, Vladimir N; Treshalina, Helena M; Lesnaya, Nina A; Romanenko, Vladimir I; Kaluzhny, Dmitry N; Balzarini, Jan; Agama, Keli; Pommier, Yves; Shtil, Alexander A; Preobrazhenskaya, Maria N

    2014-10-30

    A series of new 3-aminomethyl-4,11-dihydroxynaphtho[2,3-f]indole-5,10-diones 6-13 bearing the cyclic diamine in the position 3 of the indole ring was synthesized. The majority of new compounds demonstrated a superior cytotoxicity than doxorubicin against a panel of mammalian tumor cells with determinants of altered drug response, that is, Pgp expression or p53 inactivation. For naphtho[2,3-f]indole-5,10-diones 6-9 bearing 3-aminopyrrolidine in the side chains, the ability to bind double-stranded DNA and inhibit topoisomerases 1 and 2 mediated relaxation of supercoiled DNA were demonstrated. Only one isomer, (R)-4,11-dihydroxy-3-((pyrrolidin-3-ylamino)methyl)-1H-naphtho[2,3-f]indole-5,10-dione (7) induced the formation of specific DNA cleavage products similar to the known topoisomerase 1 inhibitors camptothecin and indenoisoquinoline MJ-III-65, suggesting a role of the structure of the side chain of 3-aminomethylnaphtho[2,3-f]indole-5,10-diones in interaction with the target. Compound 7 demonstrated an antitumor activity in mice with P388 leukemia transplants whereas its enantiomer 6 was inactive. Thus, 3-aminomethyl derivatives of 4,11-dihydroxynaphtho[2,3-f]indole-5,10-dione emerge as a new prospective chemotype for the search of antitumor agents.

  10. 3-Aminomethyl derivatives of 4,11-dihydroxynaphtho[2,3-f]indole-5,10-dione for circumvention of anticancer drug resistance.

    PubMed

    Shchekotikhin, Andrey E; Shtil, Alexander A; Luzikov, Yuri N; Bobrysheva, Tatyana V; Buyanov, Vladimir N; Preobrazhenskaya, Maria N

    2005-03-15

    A series of 3-aminomethyl derivatives of 4,11-dihydroxynaphtho[2,3-f]indole-5,10-dione was synthesized by Mannich reaction or by the transamination of 3-dimethylaminomethyl 4,11-dihydroxy- or 4,11-dimethoxynaphtho[2,3-f]indole-5,10-dione. The potency of novel derivatives was tested on a National Cancer Institute panel of 60 human tumor cell lines as well as in cells with genetically defined determinants of cytotoxic drug resistance, P-glycoprotein (Pgp) expression, and p53 inactivation. Mannich derivatives of 4,11-dihydroxynaphtho[2,3-f]indole-5,10-dione with an additional amino function in their side chain, demonstrated equal cytotoxicity against the parental K562 leukemia cells and their Pgp-positive subline, whereas the latter showed approximately 7-fold resistance to adriamycin, a Pgp transported drug. 3-(1-Piperazinyl)methyl and 3-(quinuclidin-3-yl)aminomethyl derivatives of 4,11-dihydroxynaphtho[2,3-f]indole-5,10-dione killed HCT116 colon carcinoma cells (carrying wild type p53) and their p53-null variant within the similar range of concentrations. We conclude that Mannich modification of 4,11-dihydroxynaphtho[2,3-f]indole-5,10-dione, especially when cyclic diamine (e.g., piperazine, quinuclidine) is used, confers an important feature to the resulting compounds, namely, the potency for tumor cells otherwise resistant to a variety of anticancer drugs.

  11. Synthesis and structure of a new layered oxyfluoride Sr{sub 2}ScO{sub 3}F with photocatalytic property

    SciTech Connect

    Wang, Yongkun; Tang, Kaibin Zhu, Baichuan; Wang, Dake; Hao, Qiaoyan; Wang, Yan

    2015-05-15

    Highlights: • A new oxyfluoride compound Sr{sub 2}ScO{sub 3}F was prepared by a solid state route. • The structure of this compound was determined by GSAS program based on XRD data. • The photocatalytic property was investigated under UV irradiation. - Abstract: A new Ruddlesden–Popper type scandium oxyfluoride, Sr{sub 2}ScO{sub 3}F, was synthesized by a conventional solid state reaction route. The detailed structure of Sr{sub 2}ScO{sub 3}F was investigated using X-ray diffraction (XRD) and selected area electron diffraction (SAED). The disorder distribution pattern of fluorine anions was determined by the {sup 19}F nuclear magnetic resonance (NMR) spectrum. The compound crystallizes in a K{sub 2}NiF{sub 4}-type tetragonal structure (space group I4/mmm) with O/F anions disordered over the apical sites of the perovskite-type Sc(O,F){sub 6} octahedron layers interleaved with strontium cations. Ultraviolet–visible (UV–vis) diffuse reflection spectrum of the prepared Sr{sub 2}ScO{sub 3}F indicates that it has an absorption in the UV–vis region. The photocatalytic activity of Sr{sub 2}ScO{sub 3}F was further investigated, showing an effective photodegradation of Rhodamine-B (RB) within 2 h under UV light irradiation.

  12. Luminescence and energy transfer in Eu2+, Mn2+ co-doped Ca2SrNaLa(PO4)3F

    NASA Astrophysics Data System (ADS)

    Shanshan, Hu; Wanjun, Tang

    2013-12-01

    A new compound Ca2SrNaLa(PO4)3F, isotypic with hexagonal Ca(Sr,Na,Ca)(Ca,Sr,Ce)3(PO4)3F, is reported. Its cell parameters have been determined from X-ray powder diffraction data. Crystallization occurs in the hexagonal space group P63 (No. 173) with a = 9.515(1) Å, c = 7.028(1) Å, and Z = 2. Eu2+ and Mn2+ activated Ca2SrNaLa(PO4)3F phosphors have been prepared. The energy transfer of Eu2+ → Mn2+ has been investigated. The resonant type energy transfer from Eu2+ to Mn2+ has been demonstrated, and the energy transfer efficiency has also been calculated according to their PL decay curves. A color-tunable emission in Ca2SrNaLa(PO4)3F phosphors can be realized by Eu2+ → Mn2+ energy transfer. White light can be achieved in a single-phased Ca2SrNaLa(PO4)3F host by co-doping Eu2+ and Mn2+ with CIE (0.32, 0.31). Our results demonstrate that the potential application of these phosphors in solid-state lighting and (or) other areas.

  13. Study of phase relationships in the Sr{sub 3}(PO{sub 4}){sub 2}–CePO{sub 4} system. Phase diagram and thermal characteristics of phases

    SciTech Connect

    Matraszek, Aleksandra

    2013-07-15

    A diagram representing phase relationships in the Sr{sub 3}(PO{sub 4}){sub 2}–CePO{sub 4} phosphate system has been developed on the basis of results obtained by thermal analysis (DTA/DSC/TGA) and X-ray diffraction (XRD) methods. One intermediate compound with the formula Sr{sub 3}Ce(PO{sub 4}){sub 3} occurs in the Sr{sub 3}(PO{sub 4}){sub 2}–CePO{sub 4} system at temperatures exceeding 1045 °C. The compound has a eulytite structure with the following structural parameters: a=b=c=10.1655(8) Å, α=β=γ=90.00°, V=1050.46(6) Å{sup 3}. It's melting point exceeds 1950 °C. A limited solid solution exists in the system, which possesses the structure of a low-temperature form of Sr{sub 3}(PO{sub 4}){sub 2}. At 1000 °C the maximal concentration of CePO{sub 4} in the solid solution is below 20 mol%. The solid solution phase field narrows with increased temperature. There is a eutectic point in the (Sr{sub 3}(PO{sub 4}){sub 2}+Sr{sub 3}Ce(PO{sub 4}){sub 3}) phase field at 1765 °C and 15 mol% of CePO{sub 4}. The melting temperature of Sr{sub 3}(PO{sub 4}){sub 2} is 1882±15 °C. - Graphical abstract: The phase diagram of Sr{sub 3}(PO{sub 4}){sub 2}–CePO{sub 4} system showing the stability ranges of limited solid solution and Sr{sub 3}Ce(PO{sub 4}){sub 3} phases. - Highlights: • Sr{sub 3}(PO{sub 4}){sub 2} melts at 1882 °C. • Phase diagram of Sr{sub 3}(PO{sub 4}){sub 2}–CePO{sub 4} system has been proposed. • Limited solid solution of CePO{sub 4} in Sr{sub 3}(PO{sub 4}){sub 2} forms in the system. • The Sr{sub 3}Ce(PO{sub 4}){sub 2} phosphate is stable at temperatures above 1045 °C.

  14. Crystal structures of lazulite-type oxidephosphates Ti{sup III}Ti{sup IV}{sub 3}O{sub 3}(PO{sub 4}){sub 3} and M{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4}){sub 24} (M{sup III}=Ti, Cr, Fe)

    SciTech Connect

    Schoeneborn, M.; Glaum, R. Reinauer, F.

    2008-06-15

    Single crystals of the oxidephosphates Ti{sup III}Ti{sup IV}{sub 3}O{sub 3}(PO{sub 4}){sub 3} (black), Cr{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4}){sub 24} (red-brown, transparent), and Fe{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4}){sub 24} (brown) with edge-lengths up to 0.3 mm were grown by chemical vapour transport. The crystal structures of these orthorhombic members (space group F2dd ) of the lazulite/lipscombite structure family were refined from single-crystal data [Ti{sup III}Ti{sup IV}{sub 3}O{sub 3}(PO{sub 4}){sub 3}: Z=24, a=7.3261(9) A, b=22.166(5) A, c=39.239(8) A, R{sub 1}=0.029, wR{sub 2}=0.084, 6055 independent reflections, 301 variables; Cr{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4}){sub 24}: Z=1, a=7.419(3) A, b=21.640(5) A, c=13.057(4) A, R{sub 1}=0.037, wR{sub 2}=0.097, 1524 independent reflections, 111 variables; Fe{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4}){sub 24}: Z=1, a=7.4001(9) A, b=21.7503(2) A, c=12.775(3) A, R{sub 1}=0.049, wR{sub 2}=0.140, 1240 independent reflections, 112 variables). For Ti{sup III}Ti{sup IV}O{sub 3}(PO{sub 4}){sub 3} a well-ordered structure built from dimers [Ti{sup III,IV}{sub 2}O{sub 9}] and [Ti{sup IV,IV}{sub 2}O{sub 9}] and phosphate tetrahedra is found. The metal sites in the crystal structures of Cr{sub 4}Ti{sub 27}O{sub 24}(PO{sub 4}){sub 24} and Fe{sub 4}Ti{sub 27}O{sub 24}(PO{sub 4}){sub 24}, consisting of dimers [M{sup III}Ti{sup IV}O{sub 9}] and [Ti{sup IV,IV}{sub 2}O{sub 9}], monomeric [Ti{sup IV}O{sub 6}] octahedra, and phosphate tetrahedra, are heavily disordered. Site disorder, leading to partial occupancy of all octahedral voids of the parent lipscombite/lazulite structure, as well as splitting of the metal positions is observed. According to Guinier photographs Ti{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4}){sub 24} (a=7.418(2) A, b=21.933(6) A, c=12.948(7) A) is isotypic to the oxidephosphates M{sup III}{sub 4}Ti{sup IV}{sub 27}O{sub 24}(PO{sub 4

  15. Two-hour methyl isocyanate inhalation and 90-day recovery study in B6C3F1 mice

    SciTech Connect

    Boorman, G.A.; Uraih, L.C.; Gupta, B.N.; Bucher, J.R.

    1987-06-01

    B6C3F1 mice were exposed by inhalation to 0, 3, 10, and 30 ppm methyl isocyanate for 2 hr followed by a 90-day recovery period. Sixteen of eight (20%) male mice in the 30 ppm group died following exposure. There were no other unscheduled deaths in the mice. Five mice/sex/group were examined at 2 hr or at 1, 3, 7, 14, 28, 49, or 91 days following exposure. Chemical-related changes were restricted to the respiratory system. At 30 ppm there were extensive necrosis and erosion of the respiratory and olfactory epithelium in the nasal cavity. Severe necrosis and epithelial erosion were also found in the trachea and main bronchi. Regeneration of the mucosal epithelium occurred rapidly in the nasal cavity and airways. In the turbinates, mild incomplete olfactory epithelial regeneration persisted to day 91 in the male mice. Intraluminal fibrotic projections covered by respiratory epithelium and bronchial fibrosis were found in the major airways of the 30 ppm male and female mice by day 7. The intraluminal fibrosis persisted to day 91. In males with severe bronchial fibrosis, chronic alveolitis and atelectasis were found. In mice exposed to 3 or 10 ppm, persistent pulmonary changes were not found. These studies indicate that methyl isocyanate inhalation at or near lethal concentrations can cause persistent fibrosis of the major bronchi in mice.

  16. Crystal growth, frequency doubling, and infrared laser performance of Yb{sup 3+}:BaCaBO{sub 3}F

    SciTech Connect

    Schaffers, K.I.; DeLoach, L.D.; Payne, S.A.

    1996-05-01

    Yb:BaCaBO{sub 3}F (Yb:BCBF) has been investigated as a new laser crystal with potential for self-frequency doubling. Yb{sup 3+} in BCBF exhibits a minimum absorption cross section at 912 nm of 1.1 {times} 10{sup {minus}20} cm{sup 2} with a bandwidth (FWHM) of 19 nm. The maximum emission cross section at 1034 nm is 1.3 {times} 10{sup {minus}20} cm{sup 2} with a transition bandwidth of 24 nm. The measured emission lifetime of Yb{sup 3+} is 1.17 ms. An Yb:BCBF laser has been demonstrated with a Ti:sapphire pump source, and a measured slope efficiency of 38% has been obtained for the fundamental laser output. Single crystal powders of BCBF have been compared with KD*P for a relative measure of the second-harmonic generating potential, yielding d{sub eff} (BCBF) {approximately}0.26 pm/V. The phasematching angle has been estimated from the refractive index data for type 1 second-harmonic generation of 0.517 {micro}m light; the predicted angle is 37{degree} from the c-axis. The growth, spectroscopy, laser performance, and linear and nonlinear optical properties of Yb:BCBF are reported.

  17. PLEURAL EFFECTS OF INDIUM PHOSPHIDE IN B6C3F1 MICE: NONFIBROUS PARTICULATE INDUCED PLEURAL FIBROSIS

    PubMed Central

    Kirby, Patrick J.; Shines, Cassandra J.; Taylor, Genie J.; Bousquet, Ronald W.; Price, Herman C.; Everitt, Jeffrey I.; Morgan, Daniel L.

    2010-01-01

    The mechanism(s) by which chronic inhalation of indium phosphide (InP) particles causes pleural fibrosis is not known. Few studies of InP pleural toxicity have been conducted because of the challenges in conducting particulate inhalation exposures, and because the pleural lesions developed slowly over the 2-year inhalation study. The authors investigated whether InP (1 mg/kg) administered by a single oropharyngeal aspiration would cause pleural fibrosis in male B6C3F1 mice. By 28 days after treatment, protein and lactate dehydrogenase (LDH) were significantly increased in bronchoalveolar lavage fluid (BALF), but were unchanged in pleural lavage fluid (PLF). A pronounced pleural effusion characterized by significant increases in cytokines and a 3.7-fold increase in cell number was detected 28 days after InP treatment. Aspiration of soluble InCl3 caused a similar delayed pleural effusion; however, other soluble metals, insoluble particles, and fibers did not. The effusion caused by InP was accompanied by areas of pleural thickening and inflammation at day 28, and by pleural fibrosis at day 98. Aspiration of InP produced pleural fibrosis that was histologically similar to lesions caused by chronic inhalation exposure, and in a shorter time period. This oropharyngeal aspiration model was used to provide an initial characterization of the progression of pleural lesions caused by InP. PMID:19995279

  18. Thickness dependence of spin Hall angle of Au grown on Y3F e5O12 epitaxial films

    NASA Astrophysics Data System (ADS)

    Brangham, Jack T.; Meng, Keng-Yuan; Yang, Angela S.; Gallagher, James C.; Esser, Bryan D.; White, Shane P.; Yu, Sisheng; McComb, David W.; Hammel, P. Chris; Yang, Fengyuan

    2016-08-01

    We measure the spin Hall angle in Au layers of 5-100 nm thicknesses by spin pumping from Y3F e5O12 epitaxial films grown by ultrahigh vacuum, off-axis sputtering. We observe a striking increase in the spin Hall angle for Au layers thinner than the measured spin diffusion length of 12.6 nm. In particular, the 5 nm Au layer shows a large spin Hall angle of 0.087, compared to those of 0.016 and 0.017 for the 50 and 100 nm Au layers, respectively, suggesting that the top surface plays a dominant role in spin Hall physics when the spin current is able to reach it. Other spin pumping related parameters, including Gilbert damping enhancement, interfacial spin mixing conductance, and spin current are also determined for Au layers of various thicknesses. Given the pervasive role of ultrathin films in electrical and spin transport applications, this result emphasizes the importance of considering the impact of the top surface and reveals the possibility of tuning critical spin parameters by film thickness.

  19. Selective immunosuppression resulting from exposure to the carcinogenic congener of benzopyrene in B6C3F1 mice.

    PubMed Central

    Dean, J H; Luster, M I; Boorman, G A; Lauer, L D; Leubke, R W; Lawson, L

    1983-01-01

    B6C3F1 mice were exposed to two congeners of benzopyrene, either the carcinogen benzo(a)pyrene (B(a)P) or the non-carcinogen benzo(e)pyrene (B(e)P. Exposure of mice to B(a)P resulted in a reduced number of IgM and IgG antibody plaque forming cells (PFC) to the T-dependent (TD) antigen SRBC and IgM PFC's to the T-independent (TI) antigen LPS. The IgM response to hapten conjugated TI antigens was examined using TNP-LPS for reactivity of less mature B cells (B1) and TNP-Ficoll for more mature B cells (B2). Exposure to B(a)P severely depressed the TNP-Ficoll PFC response by up to 77% without altering the TNP-LPS response. These data indicated that exposure to B(a)P alters differentiation and antibody production in mature B cells to both TD and B2 TI antigens. No change in PFC was observed following exposure to B(e)P. Mishell-Dutton co-cultures confirmed that B cells were affected and that T helper cells or suppressor Mphi were not involved. Parameters of cell-mediated immunocompetence including delayed cutaneous hypersensitivity to KLH, allograft or tumour cell rejection and susceptibility to Listeria monocytogens were unaltered in B(a)P treated mice. PMID:6305542

  20. Laser characteristics of low-threshold high-efficiency Nd:Sr5(VO4)3F crystal

    NASA Astrophysics Data System (ADS)

    Wang, Qingpu; Zhao, Shengzhi; Zhang, Xingyu

    1995-06-01

    The absorption spectrum of a new crystal, Nd: Sr 5( VO4) 3F (Nd:S-VAP), was measured, which showed that Nd:S-VAP can be suitably pumped at 583.0 and 809.0 nm as well as with a xenon flash lamp. With a tunable dye laser (570-600 nm) and a xenon flash lamp as pump sources, respectively, the free-running and Q -switched outputs with BDN dye film were realized at 1.065 mu m . For the tunable dye-laser pump source the threshold energy is 2 mJ and the slope efficiency is 50%, while for the xenon flash-lamp pump source the lowest threshold energy is 130 mJ and the highest slope efficiency is 1.3%. The laser characteristics, such as the emission spectrum, the polarization, the output energy, and the pulse width, were measured. In addition, the prospect of a Nd:S-VAP crystal for low-threshold, high-efficiency miniature lasers is discussed.

  1. Wear Mechanism Maps for Magnesium Alloy AM60 and Composite AM60-9% (Al2O3)f

    NASA Astrophysics Data System (ADS)

    Ullah Khan, Muhammad Zafar

    The purpose of this work was to study the tribological behaviour of squeeze cast Mg alloy AM60 and its composite AM60-9% (Al2O3) f. Dry sliding wear tests were performed on specimens of these materials using a block-on-ring tribometer which was equipped with a COF and temperature measurement system. Wear, COF and temperature maps were constructed to illustrate the effect of temperature and COF on the wear behaviour of the Mg alloy and it's composite. Four wear regimes namely low, mild, transient and severe wear were identified. The transition from mild to severe wear regime was found to be dependent on the bulk temperature of the specimen. Oxidational wear prevailed in low and mild wear whereas plastic deformation induced wear and melt wear controlled the wear rates in transient and severe wear regimes, respectively. This study shows that the incorporation of Al2O3 fibres in AM60 alloy improved the wear resistance of the resulting composite by delaying the transition from mild to severe wear.

  2. Competitive Reduction of Pertechnetate (99TcO4sub>- ) by Dissimilatory Metal Reducing Bacteria and Biogenic Fe(II)

    SciTech Connect

    Plymale, Andrew E.; Fredrickson, James K.; Zachara, John M.; Dohnalkova, Alice C.; Heald, Steve M.; Moore, Dean A.; Kennedy, David W.; Marshall, Matthew J.; Wang, Chongmin; Resch, Charles T.; Nachimuthu, Ponnusamy

    2011-01-06

    The fate of pertechnetate (99Tc(VII)O4sub>-) during bioreduction was investigated in the presence of 2-line ferrihydrite (Fh) and various dissimilatory metal reducing bacteria (DMRB) (Geobacter, Anaeromyxobacter, Shewanella) in comparison with TcO4sub>- bioreduction in the absence of Fh. In the presence of Fh, Tc was present primarily as a fine-grained Tc(IV)/Fe precipitate that was distinct from the Tc(IV)O2·nH2O solids produced by direct biological Tc(VII) reduction. Aqueous Tc concentrations (<0.2 μm) in the bioreduced Fh suspensions (1.7 to 3.2 × 10-9 mol L-1) were over 1 order of magnitude lower than when TcO4sub>- was biologically reduced in the absence of Fh (4.0 × 10-8 to 1.0 × 10-7 mol L-1). EXAFS analyses of the bioreduced Fh-Tc products were consistent with variable chain length Tc-O octahedra bonded to Fe-O octahedra associated with the surface of the residual or secondary Fe(III) oxide. In contrast, biogenic TcO2·nH2O had significantly more Tc-Tc second neighbors and a distinct long-range order consistent with small particle polymers of TcO2. In Fe-rich subsurface sediments, the reduction of Tc(VII) by Fe(II) may predominate over direct microbial pathways, potentially leading to lower concentrations of aqueous 99Tc(IV).

  3. Writing of nonlinear optical Sm{sub 2}(MoO{sub 4}){sub 3} crystal lines at the surface of glass by samarium atom heat processing

    SciTech Connect

    Abe, M.; Benino, Y.; Fujiwara, T.; Komatsu, T.; Sato, R.

    2005-06-15

    Some glasses such as 21.25Sm{sub 2}O{sub 3}.63.75MoO{sub 3}.15B{sub 2}O{sub 3} (mol %) giving the formation of nonlinear optical Sm{sub 2}(MoO{sub 4}){sub 3} crystals through conventional crystallization in an electric furnace and through continuous-wave Nd: yttrium aluminum garnet (YAG) laser (wavelength: 1064 nm) irradiation (samarium atom heat processing) have been developed. It is proposed from x-ray diffraction analyses, micro-Raman-scattering spectra, and second-harmonic generation measurements that the crystal structure of Sm{sub 2}(MoO{sub 4}){sub 3} formed by the crystallization is the {beta}{sup '}-phase structure with an orthorhombic (noncentrosymmetric) symmetry. The lines consisting of nonlinear optical {beta}{sup '}-Sm{sub 2}(MoO{sub 4}){sub 3} crystals are written at the surface of glasses by YAG laser irradiation (laser power: P=0.4 W, laser scanning speed: S=1-10 {mu}m/s), and, in particular, homogeneous crystal lines are formed at the laser scanning speed of 1 {mu}m/s. Refractive index changes (not crystallization) are also induced by YAG laser irradiation of P=0.4 W and a high laser scanning speed of S=25 {mu}m/s. The crystallization mechanism in the laser-irradiated region has been proposed. The present study demonstrates that the samarium atom heat processing is a technique for the writing of rare earth containing optical nonlinear/ferroelectric crystal lines in glass.

  4. High efficiency passively mode-locked Nd:YVO4sub> laser with direct in-band pumping at 914 nm.

    PubMed

    Waritanant, Tanant; Major, Arkady

    2016-06-13

    We report on the performance of a semiconductor saturable absorber mirror passively mode-locked Nd:YVO4sub> laser with in-band pumping at 914 nm and with the highest slope efficiency to date among the mode-locked Nd-lasers. The laser produced 6.7 W of output power with repetition rate of 87 MHz and pulse duration of 16 ps. The slope efficiency of 77.1% and the optical-to-optical efficiency of 60.7% were achieved. PMID:27410304

  5. Widely tunable in the mid-IR BaGa4sub>Se7 optical parametric oscillator pumped at 1064  nm.

    PubMed

    Kostyukova, Nadezhda Y; Boyko, Andrey A; Badikov, Valeriy; Badikov, Dmitrii; Shevyrdyaeva, Galina; Panyutin, Vladimir; Marchev, Georgi M; Kolker, Dmitry B; Petrov, Valentin

    2016-08-01

    A BaGa4sub>Se7 nanosecond optical parametric oscillator (OPO) shows extremely wide idler tunability in the mid-IR (2.7-17 μm) under 1.064 μm pumping. The ∼10  ns pulses at ∼7.2  μm have an energy of 3.7 mJ at 10 Hz. The pump-to-idler conversion efficiency for this wavelength reaches 5.9% with a slope of 6.5% corresponding to a quantum conversion efficiency or pump depletion of 40%.

  6. Unique edge-sharing sulfate-transition metal coordination in Na{sub 2}M(SO{sub 4}){sub 2} (M=Ni and Co)

    SciTech Connect

    Fry, Allyson M.; Sweeney, Owen T.; Adam Phelan, W.; Drichko, Natalia; Siegler, Maxime A.; McQueen, Tyrel M.

    2015-02-15

    Two compounds, Na{sub 2}Ni(SO{sub 4}){sub 2} and Na{sub 2}Co(SO{sub 4}){sub 2}, were synthesized and their structure and properties were characterized. They adopt a structure that contains a bidentate coordination of sulfate to the transition metal center, which was determined via single crystal X-ray diffraction combined with model refinements to both laboratory X-ray and time-of-flight neutron powder diffraction data. The compounds were both found to crystallize in the C2/c space group with Z=24 and a unit cell of a=23.3461(3) Å, b=10.3004(1) Å, c=17.4115(2) Å, β=98.8659(9)°, and V=4136.99(8) Å{sup 3} for the cobalt analog and a=23.2253(1) Å, b=10.26155(6) Å, c=17.3353(1) Å, β=99.0376(5)°, and V=4080.20(5) Å{sup 3} for the nickel analog. Magnetization measurements show that the transition metal centers have negligible interactions with neighboring sites. Infrared and Raman spectroscopies were used to further probe the unique sulfate-transition metal coordination, and confirm the bidentate binding motif. The resulting pseudo-trigonal bipyramidal coordination produces vivid violet, Na{sub 2}Co(SO{sub 4}){sub 2}, and yellow, Na{sub 2}Ni(SO{sub 4}){sub 2}, colors that were probed by diffuse reflectance. - Graphical abstract: Two blue distorted transition metal octahedra (oxygen in red) bridged by two sulfate tetrahedra are shown here. Each bridging sulfate tetrahedra shares an edge with one octahedron and a corner with the other. All of the remaining corners of the octahedra are corner sharing with four tetrahedra forming a polyhedral network. - Highlights: • Structure of Na2Ni(SO4)2 and Na2Co(SO4)2 is determined. • Unique sulfate-transition metal binding observed in the new structure. • Combined diffraction and spectroscopic techniques were used. • Magnetization measurements show negligible interactions between sites.

  7. Coannihilation scenarios and particle spectroscopy in SU(4){sub c}xSU(2){sub L}xSU(2){sub R}

    SciTech Connect

    Gogoladze, Ilia; Khalid, Rizwan; Shafi, Qaisar

    2009-11-01

    We identify a variety of coannihilation scenarios in a supersymmetric SU(4){sub c}xSU(2){sub L}xSU(2){sub R} model with discrete left-right symmetry. Nonuniversal gaugino masses, compatible with the gauge symmetry, play an essential role in realizing gluino and bino-wino coannihilation regions that are consistent with the WMAP dark matter constraints. We also explore regions of the parameter space in which the little hierarchy problem is partially resolved. We present several phenomenologically interesting benchmark points and the associated sparticle and Higgs mass spectra.

  8. Spin Waves in the Frustrated Kagome Lattice Antiferromagnet KFe3(OH)6(SO4sub>)2

    SciTech Connect

    Matan, K.; Grohol, D.; Nocera, D. G.; Yildirim, T.; Harris, A. B.; Lee, S.-H.; Nagler, Stephen E; Lee, Y. S.

    2006-01-01

    The spin wave excitations of the S=5/2 kagome lattice antiferromagnet KFe{sub 3}(OH){sub 6}(SO{sub 4}){sub 2} have been measured using high-resolution inelastic neutron scattering. We directly observe a flat mode which corresponds to a lifted ''zero energy mode,'' verifying a fundamental prediction for the kagome lattice. A simple Heisenberg spin Hamiltonian provides an excellent fit to our spin wave data. The antisymmetric Dzyaloshinskii-Moriya interaction is the primary source of anisotropy and explains the low-temperature magnetization and spin structure.

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

    SciTech Connect

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

    2013-01-01

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

  10. Integrated chip-scale Si3N4sub> wavemeter with narrow free spectral range and high stability.

    PubMed

    Xiang, Chao; Tran, Minh A; Komljenovic, Tin; Hulme, Jared; Davenport, Michael; Baney, Doug; Szafraniec, Bogdan; Bowers, John E

    2016-07-15

    We designed, fabricated, and characterized an integrated chip-scale wavemeter based on an unbalanced Mach-Zehnder interferometer with 300 MHz free spectral range. The wavemeter is realized in the Si3N4sub> platform, allowing for low loss with ∼62  cm of on-chip delay. We also integrated an optical hybrid to provide phase information. The main benefit of a fully integrated wavemeter, beside its small dimensions, is increased robustness to vibrations and temperature variations and much improved stability over fiber-based solutions. PMID:27420522

  11. Investigation of the structure of Cs{sub 3}(HSO{sub 4}){sub 2}(H{sub 2}PO{sub 4}) single crystals

    SciTech Connect

    Makarova, I. P. Grebenev, V. V.; Vasiliev, I. I.; Dmitricheva, E. V.; Komornikov, V. A.; Dolbinina, V. V.

    2015-07-15

    Cs{sub 3}(HSO{sub 4}){sub 2}(H{sub 2}PO{sub 4}) single crystals, obtained for the first time based on a systematic study of the phase diagram of the CsH{sub 2}PO{sub 4}–CsHSO{sub 4}–H{sub 2}O ternary system, have been studied by X-ray diffraction. The atomic structure of the crystals at room temperature is determined, and their structural features are analyzed.

  12. Diagnostic value of H3F3A mutations in giant cell tumour of bone compared to osteoclast‐rich mimics

    PubMed Central

    Presneau, Nadège; Baumhoer, Daniel; Behjati, Sam; Pillay, Nischalan; Tarpey, Patrick; Campbell, Peter J; Jundt, Gernot; Hamoudi, Rifat; Wedge, David C; Loo, Peter Van; Hassan, A Bassim; Khatri, Bhavisha; Ye, Hongtao; Tirabosco, Roberto; Amary, M Fernanda

    2015-01-01

    Abstract Driver mutations in the two histone 3.3 (H3.3) genes, H3F3A and H3F3B, were recently identified by whole genome sequencing in 95% of chondroblastoma (CB) and by targeted gene sequencing in 92% of giant cell tumour of bone (GCT). Given the high prevalence of these driver mutations, it may be possible to utilise these alterations as diagnostic adjuncts in clinical practice. Here, we explored the spectrum of H3.3 mutations in a wide range and large number of bone tumours (n = 412) to determine if these alterations could be used to distinguish GCT from other osteoclast‐rich tumours such as aneurysmal bone cyst, nonossifying fibroma, giant cell granuloma, and osteoclast‐rich malignant bone tumours and others. In addition, we explored the driver landscape of GCT through whole genome, exome and targeted sequencing (14 gene panel). We found that H3.3 mutations, namely mutations of glycine 34 in H3F3A, occur in 96% of GCT. We did not find additional driver mutations in GCT, including mutations in IDH1, IDH2, USP6, TP53. The genomes of GCT exhibited few somatic mutations, akin to the picture seen in CB. Overall our observations suggest that the presence of H3F3A p.Gly34 mutations does not entirely exclude malignancy in osteoclast‐rich tumours. However, H3F3A p.Gly34 mutations appear to be an almost essential feature of GCT that will aid pathological evaluation of bone tumours, especially when confronted with small needle core biopsies. In the absence of H3F3A p.Gly34 mutations, a diagnosis of GCT should be made with caution. PMID:27499898

  13. Diagnostic value of H3F3A mutations in giant cell tumour of bone compared to osteoclast-rich mimics.

    PubMed

    Presneau, Nadège; Baumhoer, Daniel; Behjati, Sam; Pillay, Nischalan; Tarpey, Patrick; Campbell, Peter J; Jundt, Gernot; Hamoudi, Rifat; Wedge, David C; Loo, Peter Van; Hassan, A Bassim; Khatri, Bhavisha; Ye, Hongtao; Tirabosco, Roberto; Amary, M Fernanda; Flanagan, Adrienne M

    2015-04-01

    Driver mutations in the two histone 3.3 (H3.3) genes, H3F3A and H3F3B, were recently identified by whole genome sequencing in 95% of chondroblastoma (CB) and by targeted gene sequencing in 92% of giant cell tumour of bone (GCT). Given the high prevalence of these driver mutations, it may be possible to utilise these alterations as diagnostic adjuncts in clinical practice. Here, we explored the spectrum of H3.3 mutations in a wide range and large number of bone tumours (n = 412) to determine if these alterations could be used to distinguish GCT from other osteoclast-rich tumours such as aneurysmal bone cyst, nonossifying fibroma, giant cell granuloma, and osteoclast-rich malignant bone tumours and others. In addition, we explored the driver landscape of GCT through whole genome, exome and targeted sequencing (14 gene panel). We found that H3.3 mutations, namely mutations of glycine 34 in H3F3A, occur in 96% of GCT. We did not find additional driver mutations in GCT, including mutations in IDH1, IDH2, USP6, TP53. The genomes of GCT exhibited few somatic mutations, akin to the picture seen in CB. Overall our observations suggest that the presence of H3F3A p.Gly34 mutations does not entirely exclude malignancy in osteoclast-rich tumours. However, H3F3A p.Gly34 mutations appear to be an almost essential feature of GCT that will aid pathological evaluation of bone tumours, especially when confronted with small needle core biopsies. In the absence of H3F3A p.Gly34 mutations, a diagnosis of GCT should be made with caution. PMID:27499898

  14. Anti-proliferative and pro-apoptotic activity of GD2 ganglioside-specific monoclonal antibody 3F8 in human melanoma cells

    PubMed Central

    Tsao, Chun-Yen; Sabbatino, Francesco; Cheung, Nai-Kong V; Hsu, Jeff Chi-feng; Villani, Vincenzo; Wang, Xinhui; Ferrone, Soldano

    2015-01-01

    The beneficial clinical effects of immunotherapy with GD2-specific monoclonal antibodies (mAbs) in melanoma and neuroblastoma patients have stimulated interest in characterizing the mechanisms underlying their antitumor effects. Previous studies have shown that GD2-specific mAbs mediate complement- and cell-dependent cytotoxicity and induce caspase-dependent apoptosis of tumor cells. In this study, we showed that GD2-specific mAb 3F8, which is undergoing clinical evaluation, inhibited the in vitro growth and induced apoptosis of melanoma cells. This effect was dose- and time-dependent, mediated by the interaction of mAb 3F8 combining site with GD2 ganglioside, associated with GD2 expression level on the cell surface, mAb internalization and increase of GD2 containing endosomes triggered by mAb 3F8. The induction of apoptosis by mAb 3F8 was mediated by caspase 3-, 7-, and 8-dependent pathways, downregulation of the anti-apoptotic molecules survivin and cytochrome c, and caspase 9 independent-AIF release from mitochondria. In addition, analyses of signaling pathway components demonstrated that mAb 3F8 strongly inhibited AKT and FAK activation and increased cleaved PARP expression. These results indicated that multiple mechanisms played a role in the antitumor activity of mAb 3F8 in melanoma cells. This information should provide a mechanistic basis for the optimization of the rational design of immunotherapeutic strategies in the mAb-based treatment of GD2 positive tumors. PMID:26405581

  15. Synthesis and crystal structure of a new open-framework iron phosphate (NH{sub 4}){sub 4}Fe{sub 3}(OH){sub 2}F{sub 2}[H{sub 3}(PO{sub 4}){sub 4}]: Novel linear trimer of corner-sharing Fe(III) octahedra

    SciTech Connect

    Mi, Jin-Xiao; Wang, Cheng-Xin; Chen, Ning; Li, Rong; Pan, Yuanming

    2010-12-15

    A new iron phosphate (NH{sub 4}){sub 4}Fe{sub 3}(OH){sub 2}F{sub 2}[H{sub 3}(PO{sub 4}){sub 4}] has been synthesized hydrothermally at HF concentrations from 0.5 to 1.2 mL. Single-crystal X-ray diffraction analysis reveals its three-dimensional open-framework structure (monoclinic, space group P2{sub 1}/n (No. 14), a=6.2614(13) A, b=9.844(2) A, c=14.271(3) A, {beta}=92.11(1){sup o}, V=879.0(3) A{sup 3}). This structure is built from isolated linear trimers of corner-sharing Fe(III) octahedra, which are linked by (PO{sub 4}) groups to form ten-membered-ring channels along [1 0 0]. This isolated, linear trimer of corner-sharing Fe(III) octahedra, [(FeO{sub 4}){sub 3}(OH){sub 2}F{sub 2}], is new and adds to the diverse linkages of Fe polyhedra as secondary building units in iron phosphates. The trivalent iron at octahedral sites for the title compound has been confirmed by synchrotron Fe K-edge XANES spectra and magnetic measurements. Magnetic measurements also show that this compound exhibit a strong antiferromagnetic exchange below T{sub N}=17 K, consistent with superexchange interactions expected for the linear trimer of ferric octahedra with the Fe-F-Fe angle of 132.5{sup o}. -- Graphical abstract: The three-dimensional open-framework structure of (NH{sub 4}){sub 4}Fe{sub 3}(OH){sub 2}F{sub 2}[H{sub 3}(PO{sub 4}){sub 4}] is built from a novel isolated, linear (FeO{sub 4}){sub 3}(OH){sub 2}F{sub 2} trimer of corner-sharing Fe(III) octahedra linked by PO{sub 4} tetrahedra. Display Omitted

  16. Luminescent properties of SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} and its luminescence improvement by incorporating A{sup +} (A=Li, Na, and K)

    SciTech Connect

    Li, Panlai Wang, Zhijun Yang, Zhiping; Guo, Qinglin

    2014-12-15

    A novel green phosphor SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} is synthesized by a high temperature solid-state method, and its luminescent property is investigated. X-ray diffraction patterns of SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} indicate a similarity crystalline phase to SrZn{sub 2}(PO{sub 4}){sub 2}. SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} shows green emission under 369 nm excitation, and the prominent luminescence in green (544 nm) due to {sup 5}D{sub 4}–{sup 7}F{sub 5} transition of Tb{sup 3+}. For the 544 nm emission, excitation spectrum has several excitation band from 200 nm to 400 nm. Emission intensity of SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} is influenced by Tb{sup 3+} concentration, and concentration quenching effect of Tb{sup 3+} in SrZn{sub 2}(PO{sub 4}){sub 2} is also observed. With incorporating A{sup +} (A=Li, Na, and K) as compensator charge, the emission intensity of SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} can be obviously enhanced. CIE color coordinates of SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} locate in the green region. The results indicate this phosphor may be a potential application in white LEDs. - Graphical abstract: SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} can produce green emission under near-UV excitation, and its luminescent properties can be improved by incorporating A{sup +} (A=Li, Na, and K). - Highlights: • SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} can produce green emission under near-UV excitation. • Concentration quenching effect of Tb{sup 3+} in SrZn{sub 2}(PO{sub 4}){sub 2} is observed. • Emission intensities of SrZn{sub 2}(PO{sub 4}){sub 2}:Tb{sup 3+} are enhanced by codoped A{sup +} (A=Li, Na, K)

  17. Investigations of the R5(SixGe1-x)4sub> Intermetallic Compounds by X-Ray Resonant Magnetic Scattering

    SciTech Connect

    Tan, Lizhi

    2008-08-18

    The XRMS experiment on the Gd5Ge4sub> system has shown that, below the Neel temperature, TN = 127 K, the magnetic unit cells is the same as the chemical unit cell. From azimuth scans and the Q dependence of the magnetic scattering, all three Gd sites in the structure were determined to be in the same magnetic space group Pnma. The magnetic moments are aligned along the c-axis and the c-components of the magnetic moments at the three different sites are equal. The ferromagnetic slabs are stacked antiferromagnetically along the b-direction. They found an unusual order parameter curve in Gd5Ge4sub>. A spin-reorientation transition is a possibility in Gd5Ge4sub>, which is similar to the Tb5Ge4sub> case. Tb5Ge4sub> possesses the same Sm5Ge4sub>-type crystallographic structure and the same magnetic space group as Gd5Ge4sub> does. The difference in magnetic structure is that Tb5Ge4sub> has a canted one but Gd5Ge4sub> has nearly a collinear one in the low temperature antiferromagnetic phase. The competition between the magneto-crystalline anisotropy and the nearest-neighbor magnetic exchange interactions may allow a 3-dimensional canted antiferromagnetic structure in Tb5Ge4sub>. The spin-reorientation transition in both Gd5Ge4sub> and Tb5Ge4sub> may arise from the competition between the magnetic anisotropy from the spin-orbit coupling of the conduction electrons and the dipolar interactions anisotropy.

  18. Promotion of hepatic preneoplastic lesions in male B6C3F1 mice by unleaded gasoline.

    PubMed Central

    Standeven, A M; Wolf, D C; Goldsworthy, T L

    1995-01-01

    In previous studies, unleaded gasoline (UG) vapor was found to be a liver tumor promoter and hepatocarcinogen in female mice, but UG was not a hepatocarcinogen in male mice. However, UG vapor had similar transient mitogenic effects in nonlesioned liver of both male and female mice under the conditions of the cancer bioassay. We used an initiation-promotion protocol to determine whether UG vapor acts as a liver tumor promoter in male mice and to examine proliferative effects that may be critical to tumor development. Twelve-day-old male B6C3F1 mice were injected with N-nitrosodiethylamine (DEN; 5 mg/kg, intraperitoneally) or vehicle. Starting at 5-7 weeks of age, mice were exposed by inhalation 6 hr/day, 5 days/week for 16 weeks to 0 or 2046 ppm of PS-6 blend UG. UG treatment caused a significant 2.3-fold increase in the number of macroscopic hepatic masses in DEN-initiated mice, whereas no macroscopic masses were observed in non-initiated mice. Altered hepatic foci (AHF), which were predominantly basophilic in phenotype, were found almost exclusively in DEN-initiated mice. UG treatment significantly increased both the mean volume (threefold) and the volume fraction (twofold) of the AHF without increasing the number of AHF per unit area. UG also induced hepatic pentoxyresorufin-O-dealkylase (PROD) activity, a marker of CYP2B, by more than 12-fold over control with or without DEN cotreatment. To study hepatocyte proliferative effects of UG, we treated mice with 5-bromo-2'-deoxyuridine (BrdU) via osmotic pump for 3 days before necropsy and measured hepatocyte BrdU labeling index (LI) in AHF and nonlesioned liver.(ABSTRACT TRUNCATED AT 250 WORDS) Images Figure 1. PMID:7588481

  19. Toxicity and carcinogenicity studies of boric acid in male and female B6C3F1 mice.

    PubMed Central

    Dieter, M P

    1994-01-01

    Toxicity and potential carcinogenicity studies of boric acid were investigated in mice to verify in a second rodent species that this was a noncarcinogenic chemical. Earlier chronic studies in rats indicated boric acid was not a carcinogen. The chemical is nominated for testing because over 200 tons are produced annually, there are multiple uses for the product, and there is potential for widespread human exposure, both orally and dermally. Both sexes of B6C3F1 mice were offered diets mixed with boric acid for 14 days, 13 weeks, or 2 years. Dietary doses used in the acute, 14-day study were 0, 0.62, 1.25, 2.5, 5, and 10%; those in the subchronic, 13-week study were 0, 0.12, 0.25, 0.50, 1, and 2%; and doses in the 2-year, chronic study were 0, 0.25, and 0.50% in the diet. Mortality, clinical signs of toxicity, estimates of food consumption, body weight gain, and histopathologic examination of selected tissues constituted the variables measured. In the 14-day study mortality was proportional to dose and time of exposure in both sexes, occurring in dose groups as low as 2.5% and as early as 7 days of exposure. Body weights were depressed more than 10% below controls in the higher dose groups of both sexes. Mortality in the 13-week study was confined to the two highest dose groups in male mice and to the 2%-dose group in females. Body weight depression from 8 to 23% below those of controls occurred in the 0.50% and higher dose groups of both sexes.(ABSTRACT TRUNCATED AT 250 WORDS) PMID:7889889

  20. Toxicity of divinylbenzene-55 for B6C3F1 mice in a two-week inhalation study.

    PubMed

    Morgan, D L; Mahler, J F; Wilson, R E; Moorman, M P; Price, H C; O'connor, R W

    1997-10-01

    Divinylbenzene (DVB) is a crosslinking monomer used primarily for copolymerization with styrene to produce ion-exchange resins. The toxicity of inhaled DVB was investigated because of the potential for worker exposure and the structural similarity of DVB to styrene, a potential carcinogen. Male and female B6C3F1 mice were exposed to 0, 25, 50, or 75 ppm DVB for 6 hr/day, 5 days/week for up to 2 weeks. Six mice/sex/dose group were killed after 3, 5, and 10 exposures and six mice/sex in the 75 ppm group were killed 7 days after 10 exposures. The most severe effects occurred in the nasal cavity and liver, with less severe effects occurring in the kidneys. In the nasal cavity olfactory epithelium acute necrosis and inflammation were present at early time points followed by regeneration, architectural reorganization, and focal respiratory metaplasia by 7 days after the last exposure. Olfactory epithelial changes were concentration-dependent with extensive involvement at 75 ppm and peripheral sparing at 25 ppm. There was also necrosis and regeneration of olfactory-associated Bowman's glands as well as the lateral nasal (Steno's) glands. Hepatocellular centrilobular (CL) necrosis was observed only in the 75 ppm dose group and was similar to that caused by styrene. A time-dependent progression was observed, characterized by CL degeneration after 1 exposure, necrosis after 3 and 5 exposures, and chronic inflammation with CL karyomegaly after 10 exposures and 7 days after the 10th exposure. Hepatic GSH levels were decreased in a dose-dependent manner. In the kidneys, transient tubular damage was observed in some male mice exposed to 75 ppm, and appeared to be a response to DVB-induced tubular epithelial injury.

  1. Early metabolomics changes in heart and plasma during chronic doxorubicin treatment in B6C3F1 mice.

    PubMed

    Schnackenberg, Laura K; Pence, Lisa; Vijay, Vikrant; Moland, Carrie L; George, Nysia; Cao, Zhijun; Yu, Li-Rong; Fuscoe, James C; Beger, Richard D; Desai, Varsha G

    2016-11-01

    The present study aimed to identify molecular markers of early stages of cardiotoxicity induced by a potent chemotherapeutic agent, doxorubicin (DOX). Male B6C3F1 mice were dosed with 3 mg kg(-1) DOX or saline via tail vein weekly for 2, 3, 4, 6 or 8 weeks (cumulative DOX doses of 6, 9, 12, 18 or 24 mg kg(-1) , respectively) and euthanized a week after the last dose. Mass spectrometry-based and nuclear magnetic resonance spectrometry-based metabolic profiling were employed to identify initial biomarkers of cardiotoxicity before myocardial injury and cardiac pathology, which were not noted until after the 18 and 24 mg kg(-1) cumulative doses, respectively. After a cumulative dose of 6 mg kg(-1) , 18 amino acids and four biogenic amines (acetylornithine, kynurenine, putrescine and serotonin) were significantly increased in cardiac tissue; 16 amino acids and two biogenic amines (acetylornithine and hydroxyproline) were significantly altered in plasma. In addition, 16 acylcarnitines were significantly increased in plasma and five were significantly decreased in cardiac tissue compared to saline-treated controls. Plasma lactate and succinate, involved in the Krebs cycle, were significantly altered after a cumulative dose of 6 mg kg(-1) . A few metabolites remained altered at higher cumulative DOX doses, which could partly indicate a transition from injury processes at 2 weeks to repair processes with additional injury happening concurrently before myocardial injury at 8 weeks. These altered metabolic profiles in mouse heart and plasma during the initial stages of injury progression due to DOX treatment may suggest these metabolites as candidate early biomarkers of cardiotoxicity. Published 2016. This article is a U.S. Government work and is in the public domain in the USA.

  2. Early metabolomics changes in heart and plasma during chronic doxorubicin treatment in B6C3F1 mice.

    PubMed

    Schnackenberg, Laura K; Pence, Lisa; Vijay, Vikrant; Moland, Carrie L; George, Nysia; Cao, Zhijun; Yu, Li-Rong; Fuscoe, James C; Beger, Richard D; Desai, Varsha G

    2016-11-01

    The present study aimed to identify molecular markers of early stages of cardiotoxicity induced by a potent chemotherapeutic agent, doxorubicin (DOX). Male B6C3F1 mice were dosed with 3 mg kg(-1) DOX or saline via tail vein weekly for 2, 3, 4, 6 or 8 weeks (cumulative DOX doses of 6, 9, 12, 18 or 24 mg kg(-1) , respectively) and euthanized a week after the last dose. Mass spectrometry-based and nuclear magnetic resonance spectrometry-based metabolic profiling were employed to identify initial biomarkers of cardiotoxicity before myocardial injury and cardiac pathology, which were not noted until after the 18 and 24 mg kg(-1) cumulative doses, respectively. After a cumulative dose of 6 mg kg(-1) , 18 amino acids and four biogenic amines (acetylornithine, kynurenine, putrescine and serotonin) were significantly increased in cardiac tissue; 16 amino acids and two biogenic amines (acetylornithine and hydroxyproline) were significantly altered in plasma. In addition, 16 acylcarnitines were significantly increased in plasma and five were significantly decreased in cardiac tissue compared to saline-treated controls. Plasma lactate and succinate, involved in the Krebs cycle, were significantly altered after a cumulative dose of 6 mg kg(-1) . A few metabolites remained altered at higher cumulative DOX doses, which could partly indicate a transition from injury processes at 2 weeks to repair processes with additional injury happening concurrently before myocardial injury at 8 weeks. These altered metabolic profiles in mouse heart and plasma during the initial stages of injury progression due to DOX treatment may suggest these metabolites as candidate early biomarkers of cardiotoxicity. Published 2016. This article is a U.S. Government work and is in the public domain in the USA. PMID:26934058

  3. Structural instability of the CoO4sub> tetrahedral chain in SrCoO3-δ thin films

    SciTech Connect

    Glamazda, A.; Choi, Kwang-yong; Lemmens, P.; Choi, Woo Seok; Jeen, Hyoungjeen; Meyer, Tricia L.; Lee, Ho Nyung

    2015-08-31

    Raman scattering experiments together with detailed lattice dynamic calculations are performed to elucidate crystallographic and electronic peculiarities of SrCoO3-δ films. We observe that the 85 cm-1 phonon mode involving the rotation of a CoO4sub> tetrahedron undergoes a hardening by 21 cm-1 when the temperature is decreased. In addition, new phonon modes appear at 651.5 and 697.6 cm-1 . The latter modes are attributed to the Jahn-Teller activated modes. Upon cooling from room temperature, all phonons exhibit an exponential-like increase of intensity with a characteristic energy of about 103–107 K. We attribute this phenomenon to an instability of the CoO4sub> tetrahedral chain structure, which constitutes a key ingredient to understand the electronic and structural properties of the brownmillerite SrCoO2.5.

  4. Conduction below 100 °C in nominal Li6ZnNb4sub>O14

    SciTech Connect

    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.; Manthiram, Arumugam; Goodenough, John B.

    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. Li6ZnNb4sub>O14 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 Li6ZnNb4sub>O14 composition is shown to have bulk σ Li 3.3 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.

  5. Metastability in the MgAl2O4sub>-Al2O3 System

    SciTech Connect

    Wilkerson, Kelley R.; Smith, Jeffrey D.; Hemrick, James G.

    2014-07-22

    Aluminum oxide must take a spinel form ( γ-Al2O3) at elevated temperatures in order for extensive solid solution to form between MgAl2O4sub> and α-Al2O3. The solvus line between MgAl2O4sub> and Al2O3 has been defined at 79.6 wt% Al2O3 at 1500°C, 83.0 wt% Al2O3 at 1600°C, and 86.5 wt% Al2O3 at 1700°C. A metastable region has been defined at temperatures up to 1700°C which could have significant implications for material processing and properties. Additionally, initial processing could have major implications on final chemistry. The spinel solid solution region has been extended to form an infinite solid solution with Al2O3 at elevated temperatures. A minimum in melting at 1975°C and a chemistry of 96 wt% Al2O3 rather than a eutectic is present, resulting in no eutectic crystal formation during solidification.

  6. Modification of the activity of Mg{sub 3}(PO{sub 4}){sub 2} in the gas-phase conversion of cyclohexanol by addition of sodium carbonate

    SciTech Connect

    Aramendia, M.A.; Borau, V.; Jimenez, C.

    1995-11-01

    This paper reports the synthesis and characterization of solid NaMgPO{sub 4}, obtained by adding Na{sub 2}CO{sub 3} to freshly formed Mg{sub 3}(PO{sub 4}){sub 2}{center_dot}22H{sub 2}O. The magnesium orthophosphate was prepared by gelling an aqueous solution of MgCl{sub 2} and Na{sub 2}HPO{sub 4} with 3 N NaOH. The solid products thus obtained were characterized by using various structural (XRD), surface (XPS, DRIFT,BET), and morphological (SEM) elucidation techniques. The results show that the NaMgPO{sub 4} surface also contains Na{sub 2}CO{sub 3}, NaCl, and MgO, which endow it with increased activity and selectivity. Thus, Mg{sub 3}(PO{sub 4}){sub 2} yields cyclohexene (CHE) preferentially, and some cyclohexanone (CHONE), in the gas-phase conversion of cyclohexanol. On the other hand, NaMgPO{sub 4} produces CHONE selectively under the same reaction conditions. 61 refs., 9 figs., 4 tabs.

  7. In situ studies of surface of NiFe2O4sub> catalyst during complete oxidation of methane

    SciTech Connect

    Zhang, Shiran; Shan, Junjun; Nie, Longhui; Nguyen, Luan; Wu, Zili; Tao, Franklin

    2015-12-21

    Here, NiFe2O4sub> with an inverse spinel structure exhibits high activity for a complete oxidation of methane at 400 °C–425 °C and a higher temperature. The surface of the catalyst and its adsorbates were well characterized with ambient pressure X-ray photoelectron spectroscopy (AP-XPS) and in situ infrared spectroscopy (IR). In situ studies of the surface of NiFe2O4sub> using AP-XPS suggest the formation of methoxy-like and formate-like intermediates at a temperature lower than 200 °C, supported by the observed vibrational signatures in in situ IR studies. Evolutions of C1s photoemission features and the nominal atomic ratios of C/(Ni + Fe) of the catalyst surface suggest that the formate-like intermediate is transformed to product molecules CO2 and H2O in the temperature range of 250–300 °C. In situ studies suggest the formation of a spectator, – Olattice – CH2 – Olattice –. It strongly bonds to surface through C–O bonds and cannot be activated even at 400 °C.

  8. Thermodynamic Properties of α-Fe2O3 and Fe3O4sub> Nanoparticles

    SciTech Connect

    Spencer, Elinor C.; Ross, Nancy L.; Olsen, Rebecca E.; Huang, Baiyu; Kolesnikov, Alexander I.; Woodfield, Brian F.

    2015-04-21

    Here we comprehansively assessed the thermodynamic properties of hydrated α-Fe2O3 (hematite) and Fe3O4sub> (magnetite) nanoparticles. In addition to 9 nm Fe3O4sub>, three α-e2O3nanoparticles samples of different sizes (11, 14, and 25 nm) and bulk α-e2O3 have been evaluated by inelastic neutron scattering methods. The contribution of the two-level magnetic spin flip transition to the heat capacity of the α-e2O3 particles has been determined. The isochoric heat capacity of the water confined on the surface of these two types of iron oxide particles have been calculated from their INS spectra, and is affected by the chemical composition of the underlying particle. Furthermore, the heat capacity and dynamics of the particle hydration layers appear to be influenced by a complex array of factors including particle size, water coverage, and possibly the magnetic state of the particle itself.

  9. Disorder from order among anisotropic next-nearest-neighbor Ising spin chains in SrHo2O4sub>

    SciTech Connect

    Wen, J. -J.; Tian, W.; Garlea, V. O.; Koohpayeh, S. M.; McQueen, T. M.; Li, H. -F.; Yan, J. -Q.; Rodriguez-Rivera, J. A.; Vaknin, D.; Broholm, C. L.

    2015-02-26

    In this study, we describe why Ising spin chains with competing interactions in SrHo2O4sub> segregate into ordered and disordered ensembles at low temperatures (T). Using elastic neutron scattering, magnetization, and specific heat measurements, the two distinct spin chains are inferred to have Néel (↑↓↑↓) and double-Néel (↑↑↓↓) ground states, respectively. Below TN = 0.68(2)K, the Néel chains develop three-dimensional long range order (LRO), which arrests further thermal equilibration of the double-Néel chains so they remain in a disordered incommensurate state for T below TS = 0.52(2)K. SrHo2O4sub> distills an important feature of incommensurate low dimensional magnetism: kinetically trapped topological defects in a quasi–d–dimensional spin system can preclude order in d + 1 dimensions.

  10. Magnetic excitations from an S=1/2 diamond-shaped tetramer compound Cu2PO4sub>OH

    SciTech Connect

    Matsuda, Masaaki; Dissanayake, Sachith E.; Abernathy, Douglas L.; Totsuka, K.; Belik, A. A.

    2015-11-30

    Inelastic neutron scattering experiments have been carried out on a powder sample of Cu2PO4sub>OH, which consists of diamond-shaped tetramer spin units with S=1/2. We have observed two nearly dispersionless magnetic excitations at E1 ~2 and E2 ~0 meV, whose energy width are broader than the instrumental resolution. The simplest square tetramer model with one dominant interaction, which predicts two sharp excitation peaks at E1 and E2(=2E1), does not explain the experimental result. We found that two diagonal intratetramer interactions compete with the main interaction and weak intertetramer interactions connect the tetramers. The main intratetramer interaction is found to split into two inequivalent ones due to a structural distortion below 160 K. Cu2PO4sub>OH is considered to be a good material to study the S=1/2 Heisenberg tetramer system.

  11. NMR Studies of the Vanadium Spin Dynamics and Spin Structure in LiV2O4sub>, CaV2O4sub>, and (LixV1-x)3BO5 (x ≈ 0.33, 0.40)

    SciTech Connect

    Zong, Xiaopeng

    2007-01-01

    Strong electron correlation is believed to be an essential and unifying factor in diverse properties of condensed matter systems. Ground states that can arise due to electron correlation effects include Mott insulators, heavy fermion, ferromagnetism and antiferromagnetism, spin glasses, and high-temperature superconductivity. The electronic systems in transition metal oxide compounds are often highly correlated. In this thesis, the author presents experimental studies on three strongly correlated vanadium oxide compounds: LiV2O4sub>, (LixV1-x)3BO5, and CaV2O4sub>, which have completely different ground states.

  12. Electrochemically influenced cation inter-diffusion and Co3O4sub> formation on La0.6Sr0.4sub>CoO3 infiltrated into SOFC cathodes

    SciTech Connect

    Song, Xueyan; Lee, Shiwoo; Chen, Yun; Gerdes, Kirk

    2015-06-18

    Nanosized LSC electrocatalyst was infiltrated into a porous scaffold cathode composed of Sm2O3-doped CeO2 (SDC) and La0.6Sr0.4sub>Co0.2Fe0.8O3-δ (LSCF) in a commercial button solid oxide fuel cell (SOFC). To understand the stability of cathodes infiltrated with LSC, the infiltrated composite cells were subjected to both electrochemical operating and thermal aging states at 750 °C for 1500 h. Nanostructure and local chemistry evolution of La0.6Sr0.4sub>CoO3 (LSC) infiltrated cathodes upon operation and aging were investigated by transmission electron microscopy. After operation, the LSC remained a cubic perovskite, and the crystal grains exhibit comparable size to as-infiltrated LSC grains. Inter-diffusion of Fe from the LSCF to a Fe-incorporated LSC layer developed on the LSCF backbone. However, only sharp interfaces were observed between LSC and SDC backbone in the as-infiltrated cathode and such interfaces remain after operation. The infiltrated LSC on the SDC backbone also retains granular particle morphology. Furthermore, newly grown Co3O4sub> nanocrystals were found in the operated cathode. After thermal aging, on the other hand, cation inter-diffusion across the interfaces of the infiltrate particles and the cathode backbones is less than that from the operated cells. Lastly, the following hypothesis is proposed: Co3O4sub> forms on LSC arising from local charge balancing between cobalt and oxygen vacancies.

  13. EFFECT OF TRICHLOROETHYLENE ON DNA METHYLATION AND EXPRESSION OF EARLY-INTERMEDIATE PROTOONCOGENES IN THE LIVER OF B6C3F1 MICE. (R825384)

    EPA Science Inventory

    Trichloroethylene (TCE) is a multimedia environmental pollution that is carcinogenic in mouse liver. The ability of TCE to modulate DNA methylation and the expression of immediate-early protooncogenes was evaluated. Female B6C3F1 mice were administered 1000 mg/kg TCE by gavage 5 ...

  14. Tunneling Splittings in Vibronic Structure of CH_3F^+ ( X^2E): Studied by High Resolution Photoelectron Spectra and AB Initio Theoretical Method

    NASA Astrophysics Data System (ADS)

    Mo, Yuxiang; Gao, Shuming; Dai, Zuyang; Li, Hua

    2013-06-01

    We report a combined experimental and theoretical study on the vibronic structure of CH_3F^+. The results show that the tunneling splittings of vibrational energy levels occur in CH_3F^+ due to the Jahn-Teller effect. Experimentally, we have measured a high resolution ZEKE spectrum of CH_3F up to 3500 cm^-^1 above the ground state. Theoretically, we performed an ab initio calculation based on the diabatic model. The adiabatic potential energy surfaces (APES) of CH_3F^+ have been calculated at the MRCI/CAS/avq(t)z level and expressed by Taylor expansions with normal coordinates as variables. The energy gradients for the lower and upper APES, the derivative couplings between them and also the energies of the APES have been used to determine the coefficients in the Taylor expansion. The spin-vibronic energy levels have been calculated by accounting all six vibrational modes and their couplings. The experimental ZEKE spectra were assigned based on the theoretical calculations. W. Domcke, D. R. Yarkony, and H. Köpple (Eds.), Conical Intersections: Eletronic Structure, Dynamics and Spectroscopy (World Scientific, Singapore, 2004). M. S. Schuurman, D. E. Weinberg, and D. R. Yarkony, J. Chem. Phys. 127, 104309 (2007).

  15. Search and Rescue Aircrewman/HH3F Flight Mechanic, 2-10. Military Curriculum Materials for Vocational and Technical Education.

    ERIC Educational Resources Information Center

    Ohio State Univ., Columbus. National Center for Research in Vocational Education.

    This self-paced, individualized course, adapted from military curriculum materials for use in vocational and technical education, teaches students the skills needed to become a qualified avionics worker on the HH-3F helicopter. The course materials consist of three pamphlets: two student workbooks and a composite ground/flight syllabus. Each…

  16. PET scanning of iodine-124-3F9 as an approach to tumor dosimetry during treatment planning for radioimmunotherapy in a child with neuroblastoma.

    PubMed

    Larson, S M; Pentlow, K S; Volkow, N D; Wolf, A P; Finn, R D; Lambrecht, R M; Graham, M C; Di Resta, G; Bendriem, B; Daghighian, F

    1992-11-01

    A patient with advanced neuroblastoma who had failed chemotherapy presented with a large abdominal mass and virtually total bone marrow replacement by tumor on repeated marrow biopsies. She was considered a candidate for a Phase I 131I-3F8 radioimmunotherapy trial, (MSKCC 89-141A). As a potential aid to treatment planning, a test dose of 124I-3F8 was injected and the patient was imaged over the 72 hr postinjection using two BGO based PET scanners of different designs. Time activity curves were obtained, and the cumulated activity concentration of radiolabeled 3F8 in tumor was determined. Based on MIRD, an estimated radiation absorbed dose for 131I-3F8 was 7.55 rad/mCi, in the most antibody avid lesions. Because of low uptake and unfavorable dosimetry in some bulky tumor sites, it was decided not to treat the patient with radiolabeled antibody. Positron emission tomography of 124I-labeled antibodies can be used to measure cumulated activity or residence time in tumor for more accurate estimates of radiation absorbed tumor dose from radioiodinated antibodies and can help guide management decisions in patients who are candidates for radioimmunotherapy.

  17. CARCINOGENICITY OF BROMODICHLOROMETHANE ADMINISTERED IN DRINKING WATER TO MALE F344/N RATS AND B6C3F1 MICE

    EPA Science Inventory

    A life-time exposure study was conducted to assess the carcinogenicity of bromodichloromethane (BDCM) administered in the drinking water to male F344/N rats and B6C3F1 mice. Mouse: Target concentrations of BDCM (dissolved in deionized water containing 0.25% emulphor) were 0.05, ...

  18. H3F3A K27M mutation in pediatric CNS tumors: a marker for diffuse high-grade astrocytomas.

    PubMed

    Gielen, Gerrit H; Gessi, Marco; Hammes, Jennifer; Kramm, Christof M; Waha, Andreas; Pietsch, Torsten

    2013-03-01

    Brain tumors are one of the most common childhood malignancies. Diffuse high-grade gliomas represent approximately 10% of pediatric brain tumors. Exon sequencing has identified a mutation in K27M of the histone H3.3 gene (H3F3A K27M and G34R/V) in about 20% of pediatric glioblastomas, but it remains to be seen whether these mutations can be considered specific for pediatric diffuse high-grade astrocytomas or also occur in other pediatric brain tumors. We performed a pyrosequencing-based analysis for the identification of H3F3A codon 27 and codon 34 mutations in 338 pediatric brain tumors. The K27M mutation occurred in 35 of 129 glioblastomas (27.1%) and in 5 of 28 (17.9%) anaplastic astrocytomas. None of the other tumor entities showed H3F3A K27M mutation. Because H3F3A K27M mutations occur exclusively in pediatric diffuse high-grade astrocytomas, analysis of codon 27 mutational status could be useful in the differential diagnosis of these neoplasms. PMID:23429371

  19. EVALUATION OF THE IMMUNOMODULATORY EFFECTS OF THE DISINFECTION BYPRODUCT, SODIUM CHLORITE, IN FEMALE B6C3F1 MICE: A DRINKING WATER STUDY

    EPA Science Inventory

    Evaluation of the Immunomodulatory Effects of the Disinfection By-product, Sodium chlorite, in Female B6C3f1 mice: A Drinking Water Study.

    Niel A. Karrow, Tal, L. Guo, J. Ann McCay, Greg W. Johnson, Ronnetta D. Brown, Debrorah L. Musgrove, Dori R. Germolec, Robert W. Lueb...

  20. De novo mutation in X-linked hearing loss-associated POU3F4 in a sporadic case of congenital hearing loss

    PubMed Central

    Moteki, Hideaki; Shearer, A Eliot; Izumi, Shuji; Kubota, Yamato; Azaiez, Hela; Booth, Kevin T; Sloan, Christina M; Kolbe, Diana L; Smith, Richard JH; Usami, Shin-ichi

    2015-01-01

    Objective In this report, we present a male patient with no family history of hearing loss, in whom we identified a novel de novo mutation in the POU3F4 gene. Methods One hundred ninety-four (194) Japanese subjects from unrelated and families were enrolled in this study. We used targeted genomic enrichment and massively parallel sequencing of all known non-syndromic hearing loss genes for identifying the genetic causes of hearing loss. Results A novel de novo frameshift mutation of POU3F4, to c.727_728insA (p.N244KfsX26) was identified. The patient was a 7-year-old male with congenital progressive hearing loss and inner ear deformity. Although the patient had received a cochlear implant, auditory skills were still limited. The patient also exhibited developmental delays similar to those previously associated with POU3F4 mutation. Conclusion This is the first report of a mutation in POU3F4 causing hearing loss in a Japanese patient without a family history of hearing loss. This study underscores the importance of comprehensive genetic testing of patients with hearing loss for providing accurate prognostic information and guiding the optimal management of patient rehabilitation. PMID:25792666

  1. Application of the explicitly correlated coupled-cluster models CCSD(F12*) and CC3(F12*) to the hyperpolarizability of the Ne atom

    SciTech Connect

    Hanauer, Matthias; Köhn, Andreas

    2015-01-22

    This work demonstrates the performance of the recently proposed explicitly correlated coupled-cluster method CCSD(F12*) and a new method using explicitly correlated triple excitations, CC3(F12*), in the calculation of the static ESHG hyperpolarizability of the Ne atom.

  2. THE INDUCTION OF HEPATOCELLULAR NEOPLASIA BY TRICHLOROACETIC ACID ADMINISTERED IN THE DRINKING WATER OF THE MALE B6C3F1 MOUSE

    EPA Science Inventory

    Summary What is the study? The study is a chronic bioassay (2 years) of trichloroacetic acid, a drinking water disinfection by-product, in the male B6C3F1 mouse.
    What is the impact to the field and the Agency?
    The impact of this study will derive from the use of...

  3. Three-step laser excitation of the odd-parity 5s5d 3D → 5s nf 3F states of cadmium

    NASA Astrophysics Data System (ADS)

    Nadeem, Ali; Shah, M.; Haq, S. U.; Shahzada, S.; Mumtaz, M.; Waheed, A.; Nawaz, M.; Ahmed, M.; Baig, M. A.

    2014-07-01

    We report new experimental data on the term energies and effective quantum numbers of the highly excited odd parity states of cadmium in the 71 773-72 500 cm-1 energy range. The experiment was performed using three dye lasers simultaneously pumped by the second harmonic (532 nm) of the Nd;YAG laser. The vapor containment and detection system was a thermionic diode ion detector working in a space charge limited mode. The new observations include the 5snf3F3 (12 ⩽ n ⩽ 52), 5snf3F4 (13 ⩽ n ⩽ 33) and 5snf3F2 (12 ⩽ n ⩽ 22) Rydberg series excited from the 5s5d3D multiplet. A two parameter fit to the transitions energies of the 5snf3F3 series yields the binding energy of the 5snd 2D2 level as 13 042.178 ± 0.02 cm-1 and consequently the first ionization of cadmium is determined as 72 540.05 ± 0.13 cm-1, which is in good agreement with the previously reported value.

  4. KY3F10:Er3+/Yb3+ nanocrystals doped laser-induced self-written waveguide for optical amplification in the C-band

    NASA Astrophysics Data System (ADS)

    Xue, Xiaojie; Cheng, Tonglei; Suzuki, Takenobu; Ohishi, Yasutake

    2016-02-01

    We successfully synthesized Er3+/Yb3+ co-doped KY3F10 nanocrystals by a facile hydrothermal method. The average size of the as-prepared nanocrystals was about 60 nm based on the observation of scanning electron microscope. Under the excitation of a 976 nm laser, the Er3+/Yb3+ doped KY3F10 nanocrystals showed intense near-infrared emission band centered at 1539 nm. The optimal concentrations of Er3+ were carefully selected according to the quantum yield measurement for a stronger emission in the C-band. The as-prepared nanocrystals were dispersed into a monomer, bisphenol A ethoxylate diacrylates, in which self-written waveguides can be fabricated under the irradiation of an induced laser at 450 nm. The KY3F10: Er3+/Yb3+ nanocrystals embedded polymer waveguide were fabricated by laser-induced self-written technique. Two pieces of single mode fiber were well connected with the waveguide in the fabrication procedure. Under a 976 nm laser pumping, amplified spontaneous emission at 1539 nm was observed in the KY3F10: Er3+/Yb3+ nanocrystals doped waveguide.

  5. Self-organized homo-epitaxial growth in nonlinear optical BaAlBO3F2 crystal crossing lines patterned by laser in glass

    NASA Astrophysics Data System (ADS)

    Shinozaki, K.; Abe, S.; Honma, T.; Komatsu, T.

    2015-11-01

    Crystallization processing of glasses is important as a novel technique for the development of new optical materials, and laser-induced crystallization provides a new challenge in science and technology of materials. Nonlinear optical BaAlBO3F2 crystal lines with crossing, bending, and spiral shapes were patterned at the surface of 2NiO-49BaF2-24.5Al2O3-24.5B2O3 (mol%) and 2.9NiO-48.5BaF2-24.3Al2O3-24.3B2O3 (mol%) glasses by laser irradiation (Yb:YVO4 laser with a wavelength of 1080 nm) and the orientation state of BaAlBO3F2 crystals was examined from birefringence image observations. The birefringence images indicate that the growth of highly c-axis oriented BaAlBO3F2 crystals follows along the laser scanning direction even if the laser scanning direction changes, and in particular the direction of the c-axis of BaAlBO3F2 crystals changes gradually at the crossing and bending points. The model of "self-organized homo-epitaxial growth" is proposed for the crystal orientation at the crossing and bending points, as a new crystal growth science and engineering beyond the wise providence of nature.

  6. Migration of Chadic speaking pastoralists within Africa based on population structure of Chad Basin and phylogeography of mitochondrial L3f haplogroup

    PubMed Central

    Černý, Viktor; Fernandes, Verónica; Costa, Marta D; Hájek, Martin; Mulligan, Connie J; Pereira, Luísa

    2009-01-01

    Background Chad Basin, lying within the bidirectional corridor of African Sahel, is one of the most populated places in Sub-Saharan Africa today. The origin of its settlement appears connected with Holocene climatic ameliorations (aquatic resources) that started ~10,000 years before present (YBP). Although both Nilo-Saharan and Niger-Congo language families are encountered here, the most diversified group is the Chadic branch belonging to the Afro-Asiatic language phylum. In this article, we investigate the proposed ancient migration of Chadic pastoralists from Eastern Africa based on linguistic data and test for genetic traces of this migration in extant Chadic speaking populations. Results We performed whole mitochondrial genome sequencing of 16 L3f haplotypes, focused on clade L3f3 that occurs almost exclusively in Chadic speaking people living in the Chad Basin. These data supported the reconstruction of a L3f phylogenetic tree and calculation of times to the most recent common ancestor for all internal clades. A date ~8,000 YBP was estimated for the L3f3 sub-haplogroup, which is in good agreement with the supposed migration of Chadic speaking pastoralists and their linguistic differentiation from other Afro-Asiatic groups of East Africa. As a whole, the Afro-Asiatic language family presents low population structure, as 92.4% of mtDNA variation is found within populations and only 3.4% of variation can be attributed to diversity among language branches. The Chadic speaking populations form a relatively homogenous cluster, exhibiting lower diversification than the other Afro-Asiatic branches (Berber, Semitic and Cushitic). Conclusion The results of our study support an East African origin of mitochondrial L3f3 clade that is present almost exclusively within Chadic speaking people living in Chad Basin. Whole genome sequence-based dates show that the ancestral haplogroup L3f must have emerged soon after the Out-of-Africa migration (around 57,100 ± 9,400 YBP), but

  7. Subchronic toxicity of triethylenetetramine dihydrochloride in B6C3F1 mice and F344 rats.

    PubMed

    Greenman, D L; Morrissey, R L; Blakemore, W; Crowell, J; Siitonen, P; Felton, P; Allen, R; Cronin, G

    1996-02-01

    Triethylenetetramine dihydrochloride (trien-2HCl; CAS No. 38260-01-04), a chelating agent used to treat Wilson's disease patients who are intolerant of the drug of choice, was tested for subchronic toxicity in B6C3F1 mice and F344 rats. Mice and rats received trien-2HCl in the drinking water at concentrations of 0, 120, 600, or 3000 ppm for up to 92 days. Twenty mice and 18 rats of each sex were assigned to each dose group fed either a cereal-based (NIH-31) or a purified (AIN-76A) diet, both containing nutritionally adequate levels of copper. An additional control group of rats and mice received a Cu-deficient AIN-76A diet. This low copper diet resulted in Cu-deficiency symptoms, such as anemia, liver periportal cytomegaly, pancreatic atrophy and multifocal necrosis, spleen hematopoietic cell proliferation, and increased heart weight, together with undetectable levels of plasma copper in rats but not in mice. Trien-2HCl lowered plasma copper levels some-what (at 600 and 3000 ppm) in rats fed the AIN-76A diet, but did not induce the usual signs of copper deficiency. Trien-2HCl caused an increased frequency of uterine dilatation at 3000 ppm in rats fed AIN-76A diet that was not noted in females fed the Cu-deficient diet. Trien-2HCl toxicity occurred only in mice in the highest dose group fed an AIN-76A diet. Increased frequencies of inflammation of the lung interstitium and liver periportal fatty infiltration were seen in both sexes, and hematopoietic cell proliferation was seen in the spleen of males. Kidney and body weights were reduced in males as was the incidence of renal cytoplasmic vacuolization. There were no signs of copper deficiency in mice exposed to trien-2HCl. The only effect of trien-2HCl in animals fed the NIH-31 diet was a reduced liver copper level in both rat sexes, noted at 3000 ppm.

  8. Characterization of hepatocellular resistance and susceptibility to styrene toxicity in B6C3F1 mice.

    PubMed

    Mahler, J F; Price, H C; O'Connor, R W; Wilson, R F; Eldridge, S R; Moorman, M P; Morgan, D L

    1999-03-01

    Short-term inhalation exposure of B6C3F1 mice to styrene causes necrosis of centrilobular (CL) hepatocytes. However, in spite of continued exposure, the necrotic parenchyma is rapidly regenerated, indicating resistance by regenerated cells to styrene toxicity. These studies were conducted to test the hypothesis that resistance to repeated styrene exposure is due to sustained cell proliferation, with production of hepatocytes that have reduced metabolic capacity. Male mice were exposed to air or 500 ppm styrene (6 h/day); hepatotoxicity was evaluated by microscopic examination, serum liver enzyme levels, and bromodeoxyuridine (BrdU)-labeling index (LI). Metabolism was assessed by measurement of blood styrene and styrene oxide. Both single and repeated exposures to styrene resulted in mortality by Day 2; in mice that survived, there was CL necrosis with elevated BrdU LI at Day 6, and complete restoration of the necrotic parenchyma by Day 15. The BrdU LI in mice given a single exposure had returned to control levels by Day 15. Re-exposure of these mice on Day 15 resulted in additional mortality and hepatocellular necrosis, indicating that regenerated CL cells were again susceptible to the cytolethal effect of styrene following a 14-day recovery. However, in mice repeatedly exposed to styrene for 14 days, the BrdU LI remained significantly increased on Day 15, with preferential labeling of CL hepatocytes with enlarged nuclei (karyomegaly). If repeated exposures were followed by a 10-day recovery period, CL karyomegaly persisted, but the BrdU LI returned to control level and CL hepatocytes became susceptible again to styrene toxicity as demonstrated by additional mortality and acute necrosis after a challenge exposure. These findings indicated a requirement for continued styrene exposure and DNA synthesis in order to maintain this resistant phenotype. Analyses of proliferating-cell nuclear-antigen (PCNA) labeling were conducted to further characterize the cell cycle

  9. Comparison of methods of identifying Helicobacter hepaticus in B6C3F1 mice used in a carcinogenesis bioassay.

    PubMed

    Fox, J G; MacGregor, J A; Shen, Z; Li, X; Lewis, R; Dangler, C A

    1998-05-01

    In a long-term rodent bioassay evaluating the carcinogenicity of triethanolamine, there was equivocal evidence of carcinogenic activity in male B6C3F1 mice, based on a marginal increase in the number of hepatocellular adenomas and hepatoblastomas. Interpretation was complicated by the presence of Helicobacter hepaticus in selected silver-stained liver sections which also had histological evidence of karyomegaly and oval cell hyperplasia. An increase in numbers of liver tumors, as evidence of carcinogenic activity, was also noted in female mice. However, H. hepaticus was not considered a complicating factor, because the livers of the female mice did not have histological features compatible with H. hepaticus infection. A retrospective analysis of 51 liver tissue samples from the original carcinogenicity study was conducted to determine the incidence of H. hepaticus infection and to evaluate different diagnostic approaches for assessing the presence of H. hepaticus in livers lacking characteristic lesions. In an initial evaluation of seven mice with liver tumors, argyrophilic bacteria resembling H. hepaticus were observed in liver sections, associated with characteristic liver lesions of hepatocytic karyomegaly and oval cell hyperplasia. Frozen liver tissue was available from four of these mice; all were confirmed to be infected with H. hepaticus by culture and PCR. In a larger subsequent analysis using frozen liver tissues from 44 mice without characteristic hepatic lesions, H. hepaticus-specific DNA was amplified from the livers of 21 of 44 of the mice (47%), compared to 14 of 44 of the mice (32%) having H. hepaticus cultured from their frozen liver tumors. The results of H. hepaticus culture and H. hepaticus-specific PCR concurred (i.e., both positive and negative results) in 84% of the cases. Microscopic detection of immunofluorescence-labeled or silver-stained bacteria in liver sections was relatively insensitive compared to either culture or PCR detection. This

  10. Biochemical effects of manufactured gas plant residue following ingestion by B6C3F1 mice

    SciTech Connect

    Weyand, E.H.; Wu, Yun; Patel, S. ); Goldstein, L. )

    1994-01-01

    The toxic potential of manufactured gas plant residue (MGP) given in the diet to male and female B6C3F1 mice was evaluated. In addition, the bioavailability of chemical components of MGP were also investigated by monitoring polycyclic aromatic hydrocarbon (PAH) metabolites in urine and DNA adduct formation in forestomach and lung tissue. Basal gel diets containing 0.05, 0.25, 0.50% benzo[a]pyrene (BaP) were fed to animals for 94 and 185 d. Mice readily consumed adulterated diets without any evidence of acute toxicity. The total amount of MGP and BaP consumed by mice ranged from 118 to 2604 mg and from 12 to 29 mg, respectively. Male mice fed a control or BaP diet and female mice fed a 0.05% MGP diet had the highest body weight gains. Male and female mice fed a 0.50% MGP diet had the lowest body weight gains. the bioavailability of chemical components of MGP was evaluated by monitoring the urinary excretion of PAH metabolites by male mice fed a 0.25% MGP diet. 1-Hydroxypyrene was determined by high-performance liquid chromatography analysis to be the major fluorescent metabolite excreted by mice throughout the 185 d of diet administration. At necropsy, no chemical-related gross lesions were detected. In addition, no treatment-related microscopic lesions were evident in tissues obtained from animals fed a 0.50% MGP- or BaP-adulterated diet. The [sup 32]P-postlabeling assay was used to evaluate MGP- and BaP-induced DNA adduct formation in lung and forestomach tissue. The level of DNA adducts formed from the chemical components of MGP paralleled the amount of material ingested by animals. Lung DNA adduct levels were considerably higher than forestomach levels when mice ingested a 0.25% or 0.50% MGP diet. These studies demonstrate that the continuous ingestion of MGP or BaP for 185 d does not result in acute toxicity or chemical-related lesions at doses up to 0.50% MGP or 0.005% BaP. 36 refs., 3 figs., 4 tabs.

  11. Global trends and annual releases of CCl3F and CCl2F2 estimated from ALE/GAGE and other measurements from July 1978 to June 1991

    NASA Technical Reports Server (NTRS)

    Cunnold, D. M.; Fraser, P. J.; Weiss, R. F.; Prinn, R. G.; Simmonds, P. G.; Miller, B. R.; Alyea, F. N.; Crawford, A. J.

    1994-01-01

    Thirteen years of Atmospheric Lifetime Experiment/Global Atmospheric Gases Experiment CCl3F and CCl2F2 measurements at five remote, surface, globally distributed sites are analyzed. Comparisons are made against shipboard measurements by the Scripps Institution of Oceanography (SIO) group and archived air samples collected at Cape Grim, Tasmania, since 1978. CCl3F in the lower troposphere was increasing at an average rate of 9.2 ppt/yr over the period July 1978 to June 1988. CCl2F2 was increasing at an average 17.3 ppt/yr in the lower troposphere over the same period. However, between July 1988 and June 1991 the increases of CCl3F and CCl2F2 in this region have averaged just 7.0 ppt/yr and 15.7 ppt/yr, respectively. The rate of increase has been decreasing 2.4 ppt/yr(exp 2) and 2.9 ppt/yr(exp 2) over this 3-year period. Based on a recent scenario of the global releases of these compounds and using the new calibration scale SIO 1993, the equilibrium lifetimes are estimated to be 44 +17/-10 and 180 +820/-81 years for CCl3F and CCl2F2, respectively. Using these lifetime estimates and a two-dimensional model, it is estimated that global releases of these two chlorofluorocarbons in 1990 were 249 +/- 28 x 10(exp 6) kg for CCl3F and 366 +/- 30 x 10(exp 6) kg for CCl2F2. It is also estimated that combined releases of these chlorofluorocarbons in 1990 were 21 +/- 5% less than those in 1986.

  12. Crystal structure and luminescence properties of a novel red-emitting phosphor BaAlBO{sub 3}F{sub 2}:Eu{sup 3+}

    SciTech Connect

    Chen, Wanping Zhou, Ahong; Liu, Yan; Dai, Xiaoyan; Yang, Xin

    2014-12-15

    A series of novel red-emitting phosphors BaAlBO{sub 3}F{sub 2}:xEu{sup 3+} (0.001≤x≤0.08) were first synthesized via a high temperature solid-state reaction. X-ray diffraction and photoluminescence spectroscopy were used to characterize the crystal structure and photoluminescence properties of the phosphor, respectively. The phosphor can be effectively excited with a 395 nm light, and shows a dominant {sup 5}D{sub 0}−{sup 7}F{sub 2} emission with chromatic coordination of 0.628 and 0.372. The optimal doping concentration is about 0.04. Rietveld refinement results and the luminescence behavior of Eu{sup 3+} indicate that the Eu{sup 3+} ion occupies a C{sub 3} symmetry site, and the host BaAlBO{sub 3}F{sub 2} has a hexagonal structure with P-6 space group. In addition, the phosphor could be a potential candidate as red-emitting phosphor for application in white light-emitting diode. - Graphical abstract: The luminescence behavior and Rietveld refinement of BaAlBO{sub 3}F{sub 2}:Eu{sup 3+} indicate that the red-emitting phosphor has potential application in white LED and the host has a hexagonal structure with P-6 space group. - Highlights: • A novel red-emitting phosphor BaAlBO{sub 3}F{sub 2}:Eu{sup 3+} is first synthesized. • The crystal structure of BaAlBO{sub 3}F{sub 2} is confirmed. • The phosphor shows potential application in white LED.

  13. Crystal structure and magnetic properties of NaCu{sup II}[(Cu{sup II}{sub 3}O)(PO{sub 4}){sub 2}Cl

    SciTech Connect

    Jin Tengteng; Liu Wei; Chen Shuang; Prots, Yurii; Schnelle, Walter; Zhao Jingtai; Kniep, Ruediger; Hoffmann, Stefan

    2012-08-15

    A new copper(II) oxide phosphate chloride, NaCu{sup II}[(Cu{sup II}{sub 3}O)(PO{sub 4}){sub 2}Cl], has been synthesized by flux synthesis. Single-crystal X-ray diffraction data show that the title compound crystallizes in the monoclinic system, space group P2{sub 1}/c (No. 14), with lattice parameters a=8.392(2) A, b=6.3960(10) A, c=16.670(2) A, {beta}=109.470(10) Degree-Sign , V=843.6(3) A{sup 3}, Z=4. The crystal structure is characterized by a complex chain of copper-centered polyhedra running along [0 1 0] which are connected by phosphate tetrahedra. The resulting three-dimensional polyhedra framework exhibits channels filled by additional copper and sodium atoms. Field and temperature dependent measurements of the specific heat and the magnetic susceptibility reveal low-dimensional magnetic behavior. The compound starts to decompose at 700 K under release of oxygen and evaporation of Cu{sup I}Cl as shown by simultaneous thermogravimetry and mass spectrometry. - Graphical abstract: The crystal structure of the new copper(II) phosphate chloride, NaCu{sup II}[(Cu{sup II}{sub 3}O)(PO{sub 4}){sub 2}Cl], exhibits linear chains of copper tetrahedra which show low-dimensional magnetic behavior proven by specific heat and magnetic susceptibility measurements. Highlights: Black-Right-Pointing-Pointer A new copper(II) oxide phosphate chloride, NaCu{sup II}[(Cu{sup II}{sub 3}O)(PO{sub 4}){sub 2}Cl], has been synthesized by flux synthesis. Black-Right-Pointing-Pointer The crystal structure comprises chains of Cu{sub 4}O tetrahedra. Black-Right-Pointing-Pointer Low-dimensional behavior has been proven by magnetic and specific heat measurements. Black-Right-Pointing-Pointer On heating, Cu{sup I}Cl and oxygen are released shown by simultaneous thermogravimetry and mass spectrometry.

  14. Determination of ketone body kinetics using a D-(-)-3-hydroxy(4,4,4-/sub 2/H/sup 3/)butyrate tracer

    SciTech Connect

    Bougneres, P.F.; Balasse, E.O.; Ferre, P.; Bier, D.M.

    1986-02-01

    In studies where D-(-)-3-hydroxy(4,4,4-/sub 2/H/sup 3/)butyrate is employed as isotopic tracer in vivo, we have described a selected ion monitoring, gas-liquid chromatography-mass spectrometry micromethod which measures (/sub 2/H/sup 3/) tracer enrichment in 3-hydroxybutyrate and acetoacetate from 300-microliters blood samples. For plasma samples in the physiologic range, intra- and interassay precisions for each ketone averaged better than +/- 1% and +/- 2%, respectively. The use of the method was validated by comparing kinetic data obtained with the above tracer with simultaneous flux data obtained with conventional D-(-)-3-hydroxy(3-/sup 14/C)butyrate tracer in five fasted rats.

  15. New insights into the thermodynamic behavior of 2LiBH4sub>-MgH2 composite for hydrogen storage

    SciTech Connect

    Cova, Federico; Ronnebro, Ewa; Choi, Yong-Joon; Gennari, Fabiana; Larochette, Pierre

    2015-06-15

    The composite 2LiBH4sub>:MgH2 has been studied as a possible hydrogen storage material due to its high storage capacity. The present work is directed towards the clarification of the thermodynamic behavior of the system, especially in the temperature region above 400°C. We reveal different reaction paths during hydrogen absorption and desorption at various temperatures which has important implication for applications. At temperatures higher than 413°C, the observation of two different absorption pressure plateaus indicates that two different reactions occur, however, below this temperature there is only one plateau present in the system. During desorption, the double plateau can be observed at temperatures as low as 375°C.

  16. Cw and Q-switched Nd:NaLa(MoO{sub 4}){sub 2} laser noncritical to the temperature drift of the diode pump laser wavelength

    SciTech Connect

    Ushakov, S N; Lis, Denis A; Subbotin, Kirill A; Romanyuk, V A; Shestakov, A V; Ryabochkina, P A; Shestakova, I A; Zharikov, Evgeny V

    2010-08-27

    Lasing in Nd:NaLa(MoO{sub 4}){sub 2} crystals is obtained without stabilisation of the diode pump wavelength. A dependence of the cw laser power (at a wavelength of 1059 nm) on the pump diode temperature is found within a range of 10-458C. It is shown that the variations in the diode temperature within this region change the lasing efficiency no more than by 30%. In the passive Q-switching regime, the experiments were performed under both pulsed and cw pumping. Upon pulsed pumping, the laser energy was 16 {mu}J at the output pulse duration of 11 ns. The laser wavelength was 1059 nm, as well as in the case of cw operation. Upon cw pumping with a power of 1.5 W, laser pulses were obtained with an energy of 15 {mu}J. (lasers)

  17. The migration mechanism of transition metal ions in LiNi 0.5 Mn 1.5O4sub>

    SciTech Connect

    Xu, Gui-Liang; Qin, Yan; Ren, Yang; Cai, Lu; An, Ke; Amine, Khalil; Chen, Zonghai

    2015-05-12

    The migration of transition metal ions in the oxygen framework was recently proposed to be responsible for the continuous loss of average working potential of high energy density layered–layered composite cathodes for lithium-ion batteries. The potential migration pathway in a model material, LiNi 0.5 Mn 1.5O4sub> spinel, was investigated using in situ high-energy X-ray diffraction and in situ neutron diffraction during the solid state synthesis process. It was found that the migration of transition metal ions among octahedral sites is possible by using tetrahedral vacancies as intermediate sites. It was also suggested that the number of electrons in 3d orbitals has a significant impact on their mobility in the hosting oxygen framework.

  18. Negative to positive magnetoresistance and magnetocaloric effect in Pr0.6Er0.4sub>Al2

    SciTech Connect

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

    2014-10-13

    We report on the magnetic, magnetocaloric and magnetotransport properties of Pr0.6Er0.4sub>Al2. 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.

  19. Beam quality management by periodic reproduction of wavefront aberrations in end-pumped Nd:YVO4sub> laser amplifiers.

    PubMed

    Liu, Bin; Liu, Chong; Shen, Lifeng; Wang, Chunhua; Ye, Zhibin; Liu, Dong; Xiang, Zhen

    2016-04-18

    A method for beam quality management is presented in a master oscillator power amplifier (MOPA) using Nd:YVO4sub> as the gain medium by extra-cavity periodic reproduction of wavefront aberrations. The wavefront aberration evolution of the intra-cavity beams is investigated for both symmetrical and asymmetrical resonators. The wavefront aberration reproduction process is successfully realized outside the cavity in four-stage amplifiers. In the MOPA with a symmetrical oscillator, the laser power increases linearly and the beam quality hardly changes. In the MOPA with an asymmetrical oscillator, the beam quality is deteriorated after the odd-stage amplifier and is improved after the even-stage amplifier. The wavefront aberration reproduction during the extra-cavity beam propagation in the amplifiers is equivalent to that during the intra-cavity propagation. This solution helps to achieve the effective beam quality management in laser amplifier chains. PMID:27137329

  20. Beam quality management by periodic reproduction of wavefront aberrations in end-pumped Nd:YVO4sub> laser amplifiers.

    PubMed

    Liu, Bin; Liu, Chong; Shen, Lifeng; Wang, Chunhua; Ye, Zhibin; Liu, Dong; Xiang, Zhen

    2016-04-18

    A method for beam quality management is presented in a master oscillator power amplifier (MOPA) using Nd:YVO4sub> as the gain medium by extra-cavity periodic reproduction of wavefront aberrations. The wavefront aberration evolution of the intra-cavity beams is investigated for both symmetrical and asymmetrical resonators. The wavefront aberration reproduction process is successfully realized outside the cavity in four-stage amplifiers. In the MOPA with a symmetrical oscillator, the laser power increases linearly and the beam quality hardly changes. In the MOPA with an asymmetrical oscillator, the beam quality is deteriorated after the odd-stage amplifier and is improved after the even-stage amplifier. The wavefront aberration reproduction during the extra-cavity beam propagation in the amplifiers is equivalent to that during the intra-cavity propagation. This solution helps to achieve the effective beam quality management in laser amplifier chains.

  1. 119Sn-NMR investigations on superconducting Ca3Ir4sub>Sn13: Evidence for multigap superconductivity

    SciTech Connect

    Sarkar, R.; Petrovic, C.; Bruckner, F.; Gunther, M.; Wang, Kefeng; Biswas, P. K.; Luetkens, H.; Morenzoni, E.; Amato, A.; Klauss, H. -H.

    2015-09-25

    In this study, we report bulk superconductivity (SC) in Ca3Ir4sub>Sn13 by means of 119Sn nuclear magnetic resonance (NMR) experiments. Two classical signatures of BCS superconductivity in spin-lattice relaxation rate (1/T1), namely the Hebel–Slichter coherence peak just below the Tc, and the exponential decay in the superconducting phase, are evident. The noticeable decrease of 119Sn Knight shift below Tc indicates spin-singlet superconductivity. The temperature dependence of the spin-lattice relaxation rate 119(1/T1) is convincingly described by the multigap isotropic superconducting gap. NMR experiments do not witness any sign of enhanced spin fluctuations.

  2. Temperature, Oxygen, and Soot-Volume-Fraction Measurements in a Turbulent C2H4sub>-Fueled Jet Flame

    SciTech Connect

    Kearney, Sean P.; Guildenbecher, Daniel Robert; Winters, Caroline; Farias, Paul Abraham; Grasser, Thomas W.; Hewson, John C.

    2015-09-01

    We present a detailed set of measurements from a piloted, sooting, turbulent C 2 H 4 sub>- fueled diffusion flame. Hybrid femtosecond/picosecond coherent anti-Stokes Raman scattering (CARS) is used to monitor temperature and oxygen, while laser-induced incandescence (LII) is applied for imaging of the soot volume fraction in the challenging jet-flame environment at Reynolds number, Re = 20,000. Single-laser shot results are used to map the mean and rms statistics, as well as probability densities. LII data from the soot-growth region of the flame are used to benchmark the soot source term for one-dimensional turbulence (ODT) modeling of this turbulent flame. The ODT code is then used to predict temperature and oxygen fluctuations higher in the soot oxidation region higher in the flame.

  3. Optical modeling and optimizations of Cu2ZnSnSe4sub> solar cells using the modified transfer matrix method.

    PubMed

    Cozza, Dario; Ruiz, Carmen M; Duché, David; Giraldo, Sergio; Saucedo, Edgardo; Simon, Jean Jacques; Escoubas, Ludovic

    2016-09-01

    The fast and computationally inexpensive Modified Transfer Matrix Method (MTM) is employed to simulate the optical response of kesterite Cu2ZnSnSe4sub> solar cells. This method can partially take into account the scattering effects due to roughness at the interfaces between the layers of the stack. We analyzed the optical behavior of the whole cell structure by varying the thickness of the TCO layer (iZnO + ITO) between 50 and 1200 nm and the buffer CdS layer between 0 and 100 nm. We propose optimal combinations of the TCO/CdS thicknesses that can locally maximize the device photocurrent. We provide experimental data that qualitatively confirm our theoretical predictions. PMID:27607723

  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

    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

  5. The behavior of thermal conductivity in the chaotic phase of [N(CH{sub 3}){sub 4}]{sub 2}ZnCl{sub 4} crystal

    SciTech Connect

    Sveleba, S. A. Karpa, I. V.; Kunyo, I. M.; Semotyuk, O. V.; Katerynchuk, I. M.; Phitsych, E. I.; Pankivskyi, Yu. I.

    2010-07-15

    A thermal investigation of the modulated structure dynamics at the transition between metastable states in the incommensurate phase of [N(CH{sub 3}){sub 4}]{sub 2}ZnCl{sub 4} crystal have been performed. It is established that the anomalous behavior of the thermal conductivity in the absence of a defect-density wave is due to the inelastic scattering of thermal phonons from critical phonons of the soft optical branch. In the presence of a defect-density wave, the anomalous increase in thermal conductivity is caused by the existence of a chaotic phase and is related to the contribution that soft optical phonons make to the heat transfer due to the increase in their group velocity.

  6. Nanoparticles of K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}:Eu as effective detectors for swift heavy ions

    SciTech Connect

    Salah, Numan; Lochab, S. P.; Kanjilal, D.; Ranjan, Ranju; Habib, Sami S.; Rupasov, A. A.; Aleynikov, V. E.

    2007-09-15

    The modification of thermoluminescence (TL) and photoluminescence (PL) properties of K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}:Eu nanoparticles by swift heavy ions (SHI), irradiation is studied. Pellets form of the nanomaterials were irradiated by 48 MeV Li{sup 3+}, 75 MeV C{sup 6+}, and 90 MeV O{sup 7+} ion beams. The fluence range is 1x10{sup 9}-1x10{sup 13} ions/cm{sup 2}. The modification in TL glow curves of the nanomaterials irradiated by Li{sup 3+}, C{sup 6+}, and O{sup 7+} ion beams are essentially similar to those induced by {gamma}-ray irradiation. These glow curves have single peaks at around 427 K with a small variation in their positions by around {+-}3 K. The TL intensity of the ion beams irradiated nanomaterials is found to decease, while going from low to high atomic number (Z) ions (i.e., Li{sup 3+}{yields}O{sup 7+}). The TL response curve of the pellets irradiated by Li{sup 3+} ions is linear in the whole range of studied fluences. The curves for C{sup 6+} and O{sup 7+} irradiated samples are linear at lower fluences (1x10{sup 9}-1x10{sup 12} ion/cm{sup 2}) and then saturate at higher fluence. These results for the nanomaterials are much better than that of the corresponding microcrystalline samples irradiated with a Li{sup 3+} ion. The curves were linear up to the fluence 1x10{sup 11} ion/cm{sup 2} and then become sublinear at higher fluences. The TL efficiency values of K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}:Eu nanoparticles irradiated by 48 MeV Li{sup 3+}, 75 MeV C{sup 6+}, and 90 MeV O{sup 7+} ion beams have been measured relative to {gamma} rays of {sup 60}Co and are found to be 0.515, 0.069, and 0.019, respectively. This value for the Li{sup 3+} ion (0.515) is much higher than that of the corresponding microcrystalline material (0.0014). These superiorities for the nanomaterials make K{sub 2}Ca{sub 2}(SO{sub 4}){sub 3}:Eu nanophosphor a suitable candidate for detecting the doses of swift heavy ions. PL studies on the ion beams irradiated and

  7. One Dimensional(1D)-to-2D Crossover of Spin Correlations in the 3D Magnet ZnMn2O4sub>

    SciTech Connect

    Disseler, S. M.; Chen, Y.; Yeo, S.; Gasparovic, G.; Piccoli, P. M. B.; Schultz, A. J.; Qiu, Y.; Huang, Q.; Cheong, S. -W.; Ratcliff, W.

    2015-12-08

    In this paper we report on the intriguing evolution of the dynamical spin correlations of the frustrated spinel ZnMn2O4sub>. Inelastic neutron scattering and magnetization studies reveal that the dynamical correlations at high temperatures are 1D. At lower temperature, these dynamical correlations become 2D. Surprisingly, the dynamical correlations condense into a quasi 2D Ising-like ordered state, making this a rare observation of two dimensional order on the spinel lattice. Remarkably, 3D ordering is not observed down to temperatures as low as 300 mK. This unprecedented dimensional crossover stems from frustrated exchange couplings due to the huge Jahn-Teller distortions around Mn3+ ions on the spinel lattice.

  8. Structure and magnetism of nanocrystalline and epitaxial (Mn,Zn,Fe)3O4sub> thin films

    SciTech Connect

    Alaan, U. S.; Wong, F. J.; Grutter, A. J.; Iwata-Harms, J. M.; Mehta, V. V.; Arenholz, E.; Suzuki, Y.

    2012-02-21

    We study nanocrystalline (NC) textured Mn0.5Zn0.6Fe1.9O4sub> (MZFO) films, grown at room temperature on both isostructural and non-isostructural substrates, that show magnetization values significantly suppressed from epitaxial MZFO films. X-ray absorption spectroscopy and x-ray magnetic circular dichroism measurements indicate larger ratios of Fe3+ to Fe2+ ions on the tetrahedral sites in the NC films compared to the epitaxialfilms. The magnetization loops of the NC films are shifted by 200-400 Oe at low temperatures. No such effect is observed in the epitaxialfilms. In conclusion, we hypothesize that the presence of a more structurally disordered, possibly magnetically frustrated, matrix exchange biases the crystalline regions.

  9. Multiband Te p Based Superconductivity of Ta4sub>Pd3Te16

    SciTech Connect

    Singh, David J.

    2014-10-06

    We recently discovered that Ta4sub>Pd3Te16 is a superconductor that has been suggested to be an unconventional superconductor near magnetism. Here, we report electronic structure calculations showing that despite the layered crystal structure the material is an anisotropic three-dimensional (3D) metal. The Fermi surface contains prominent one-dimensional (1D) and two-dimensional (2D) features, including nested 1D sheets, a 2D cylindrical section, and a 3D sheet. Moreover, the electronic states that make up the Fermi surface are mostly derived from Te p states with small Ta d and Pd d contributions. This places the compound far from magnetic instabilities. The results are discussed in terms of multiband superconductivity.

  10. Thermal expansion of NaTi/sub 2/(PO/sub 4/)/sub 3/ studied by Rietveld method from x-ray diffraction data

    SciTech Connect

    Rodrigo, J.L.; Carrasco, P.; Alamo, J. )

    1989-05-01

    Previous disagreement about the thermal expansion of the rhombohedral compound, NZP-type, NaTi/sub 2/(PO/sub 4/)/sub 3/ is clarified. It is shown that thermal stresses affect the thermal expansion, but they relax after some time of storage. Its anisotropic thermal expansion, has been calculate from high temperature X-ray diffraction, and it is linear in the range from room temperature up to 800{sup 0}C. The predictability of thermal expansion and the tailoring of the composition of NZP ceramics require checking whether the thermal effect on the rotations and distortions of the atomic polyhedra in this structure is the responsible for the high anisotropy in the thermal expansion. This effect has been determined experimentally by solving the chemical structure at five different temperatures, applying the Rietveld method to deconvolute the powder X-ray diffraction profiles.

  11. Optical modeling and optimizations of Cu2ZnSnSe4sub> solar cells using the modified transfer matrix method.

    PubMed

    Cozza, Dario; Ruiz, Carmen M; Duché, David; Giraldo, Sergio; Saucedo, Edgardo; Simon, Jean Jacques; Escoubas, Ludovic

    2016-09-01

    The fast and computationally inexpensive Modified Transfer Matrix Method (MTM) is employed to simulate the optical response of kesterite Cu2ZnSnSe4sub> solar cells. This method can partially take into account the scattering effects due to roughness at the interfaces between the layers of the stack. We analyzed the optical behavior of the whole cell structure by varying the thickness of the TCO layer (iZnO + ITO) between 50 and 1200 nm and the buffer CdS layer between 0 and 100 nm. We propose optimal combinations of the TCO/CdS thicknesses that can locally maximize the device photocurrent. We provide experimental data that qualitatively confirm our theoretical predictions.

  12. Complex conductance of ultrathin La2-xSrxCuO4sub> films and heterostructures

    SciTech Connect

    V. A. Gasparov; Bozovic, I.

    2015-10-23

    We used atomic-layer molecular beam epitaxy to synthesize bilayers of a cuprate metal (La1.55Sr0.45CuO4sub>) and a cuprate insulator (La2CuO4sub>), in which each layer is just one unit cells thick. We have studied the magnetic field and temperature dependence of the complex sheet conductance, σ(ω), of these films. Experiments have been carried out at frequencies between 2 and 50 MHz using the single-spiral coil technique. We found that: (i) the inductive response starts at ΔT = 3 K lower temperatures than Re σ(T), which in turn is characterized by a peak close to the transition, (ii) this shift is almost constant with magnetic field up to 14 mT; (iii) ΔT increases sharply up to 4 K at larger fields and becomes constant up to 8 T; (iv) the vortexdiffusion constant D(T) is not linear with T at low temperatures as in the case of free vortices, but is rather exponential due to pinning of vortex cores, and (v) the dynamic Berezinski–Kosterlitz–Thouless (BKT) transition temperature occurs at the point where Y=(lω/ξ+)2 = 1. As a result, our experimental results can be described well by the extended dynamic theory of the BKT transition and dynamics of bound vortex–antivortex pairs with short separation lengths.

  13. Enhanced thermoelectric performance driven by high-temperature phase transition in the phase change material Ge4sub>SbTe5

    SciTech Connect

    Williams, Jared B.; Lara-Curzio, Edgar; Cakmak, Ercan; Watkins, Thomas R.; Morelli, Donald T.

    2015-05-15

    Phase change materials are identified for their ability to rapidly alternate between amorphous and crystalline phases and have large contrast in the optical/electrical properties of the respective phases. The materials are primarily used in memory storage applications, but recently they have also been identified as potential thermoelectric materials. Many of the phase change materials researched today can be found on the pseudo-binary (GeTe)1-x(Sb2Te3)x tie-line. While many compounds on this tie-line have been recognized as thermoelectric materials, here we focus on Ge4sub>SbTe5, a single phase compound just off of the (GeTe)1-x(Sb2Te3)x tie-line, that forms in a stable rocksalt crystal structure at room temperature. We find that stoichiometric and undoped Ge4sub>SbTe5 exhibits a thermal conductivity of ~1.2 W/m-K at high temperature and a large Seebeck coefficient of ~250 μV/K. The resistivity decreases dramatically at 623 K due to a structural phase transition which lends to a large enhancement in both thermoelectric power factor and thermoelectric figure of merit at 823 K. In a more general sense the research presents evidence that phase change materials can potentially provide a new route to highly efficient thermoelectric materials for power generation at high temperature.

  14. Decoupling of the antiferromagnetic and insulating states in Tb-doped Sr2IrO4sub>

    SciTech Connect

    Wang, J. C.; Aswartham, S.; Ye, Feng; Terzic, J.; Zheng, H.; Haskel, Daniel; Chikara, Shalinee; Choi, Yong; Schlottmann, P.; Custelcean, Radu; Yuan, S. J.; Cao, G.

    2015-12-08

    Sr2IrO4sub> is a spin-orbit coupled insulator with an antiferromagnetic (AFM) transition at TN = 240 K. We report results of a comprehensive study of single-crystal Sr2Ir1-xTbxO4sub> (0≤x≤0.03). This study found that mere 3% (x=0.03) tetravalent Tb4+(4f7) substituting for Ir4+ (rather than Sr2+) completely suppresses the long-range collinear AFM transition but retains the insulating state, leading to a phase diagram featuring a decoupling of magnetic interactions and charge gap. The insulating state at x = 0.03 is characterized by an unusually large specific heat at low temperatures and an incommensurate magnetic state having magnetic peaks at (0.95, 0, 0) and (0, 0.95, 0) in the neutron diffraction, suggesting a spiral or spin density wave order. It is apparent that Tb doping effectively changes the relative strength of the SOI and the tetragonal CEF and enhances the Hund’s rule coupling that competes with the SOI, and destabilizes the AFM state. However, the disappearance of the AFM accompanies no metallic state chiefly because an energy level mismatch for the Ir and Tb sites weakens charge carrier hopping and renders a persistent insulating state. Furthermore, this work highlights an unconventional correlation between the AFM and insulating states in which the magnetic transition plays no critical role in the formation of the charge gap in the iridate.

  15. Self-powdering and nonlinear optical domain structures in ferroelastic beta'-Gd{sub 2}(MoO{sub 4}){sub 3} crystals formed in glass

    SciTech Connect

    Tsukada, Y.; Honma, T.; Komatsu, T.

    2009-08-15

    Ferroelastic beta'-Gd{sub 2}(MoO{sub 4}){sub 3}, (GMO), crystals are formed through the crystallization of 21.25Gd{sub 2}O{sub 3}-63.75MoO{sub 3}-15B{sub 2}O{sub 3} glass (mol%), and two scientific curious phenomena are observed. (1) GMO crystals formed in the crystallization break into small pieces with a triangular prism or pyramid shape having a length of 50-500 {mu}m spontaneously during the crystallizations in the inside of an electric furnace, not during the cooling in air after the crystallization. This phenomenon is called 'self-powdering phenomenon during crystallization' in this paper. (2) Each self-powdered GMO crystal grain shows a periodic domain structure with different refractive indices, and a spatially periodic second harmonic generation (SHG) depending on the domain structure is observed. It is proposed from polarized micro-Raman scattering spectra and the azimuthal dependence of second harmonic intensities that GMO crystals are oriented in each crystal grain and the orientation of (MoO{sub 4}){sup 2-} tetrahedra in GMO crystals changes periodically due to spontaneous strains in ferroelastic GMO crystals. - Graphical abstract: This figure shows the polarized optical photograph at room temperature for a particle (piece) obtained by a heat treatment of the glass at 590 deg. C for 2 h in an electric furnace in air. This particle was obtained through the self-powdering behavior in the crystallization of glass. The periodic domain structure is observed. Ferroelastic beta'-Gd{sub 2}(MoO{sub 4}){sub 3} crystals are formed in the particle, and second harmonic generations are detected, depending on the domain structure.

  16. Enhanced ferromagnetic order in Sr{sub 4}Mn{sub 3}O{sub 3}(GeO{sub 4}){sub 3} featuring canted [MnO{sub 4}]{sub ∞} spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr{sub 4−x}Ln{sub x}Mn{sup III}{sub 2+x}Mn{sup IV}{sub 1−x}O{sub 3}(GeO{sub 4}){sub 3} solid-solution

    SciTech Connect

    West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh

    2013-10-15

    Crystals of Sr{sub 4−x}Ln{sub x}Mn{sub 3}O{sub 3}(GeO{sub 4}){sub 3} (x=0; x∼0.15 for Ln=La, Pr, Nd, Sm. Eu, Gd, Dy; x∼0.3 for Ln=Gd) were isolated upon using high-temperature, solid-state methods in molten-salt media. These compounds are isostructural with the previously reported Na{sub 3}LnMn{sub 3}O{sub 3}(AsO{sub 4}){sub 3} (Ln=La, Sm, Gd) series that contains the same [MnO{sub 4}]{sub ∞} spin chains. The synthesis of the Sr{sub 4}Mn{sub 3}O{sub 3}(GeO{sub 4}){sub 3} (x=0) phase was carried out by a double aliovalent substitution with respect to the Sr{sup 2+} and Ge{sup 4+} ions that replace Na{sup +}/Ln{sup 3+} and As{sup 5+} in Na{sub 3}LnMn{sub 3}O{sub 3}(AsO{sub 4}){sub 3}, respectively. The title series contains mixed-valent Mn(III)/Mn(IV) and shows a limited range of solid solution, both of which were not observed in the previously reported Na{sub 3}LnMn{sub 3}O{sub 3}(AsO{sub 4}){sub 3} series. To form the Sr{sub 4−x}Ln{sub x}Mn{sub 3}O{sub 3}(GeO{sub 4}){sub 3} solid solution, one of the Sr{sup 2+} sites, i.e., the original Ln-site in Na{sub 3}LnMn{sub 3}O{sub 3}(AsO{sub 4}){sub 3}, is partially substituted by Ln{sup 3+} in a statistical disorder of Sr{sub 1−x}/Ln{sub x}. Initial magnetic investigations of selected derivatives reveal higher ferromagnetic ordering temperatures than those reported for the Na{sub 3}LnMn{sub 3}O{sub 3}(AsO{sub 4}){sub 3} series, presumably attributed to a lesser degree of canting as a result of introducing non-Jahn–Teller Mn{sup 4+} ions. Also intriguing is the observation of multiple anomalies at low temperatures which appear to be of electronic origins. - Graphical abstract: Sr{sub 4−x}Ln{sub x}Mn(III){sub 2+x}Mn(IV){sub 1−x}O{sub 3}(GeO{sub 4}){sub 3}. Display Omitted - Highlights: • Double aliovalent substitution: Sr{sub 4}Mn{sub 3}O{sub 3}(GeO{sub 4}){sub 3} with respect to Na{sub 3}LnMn{sub 3}O{sub 3}(AsO{sub 4}){sub 3}. • Solid solution with respect to statistical disorder of Sr{sub 1

  17. TOXICITY AND CARCINOGENICITY STUDIES OF 4-METHYLIMIDAZOLE IN F344/N RATS AND B6C3F1 MICE

    PubMed Central

    Chan, P.C.; Hills, G. D; Kissling, G.E.; Nyska, A

    2008-01-01

    4-Methylimidazole (4MI) is used in the manufacture of pharmaceuticals, photographic chemicals, dyes and pigments, cleaning and agricultural chemicals, and rubber. It has been identified as a by-product of fermentation in foods and has been detected in mainstream and side stream tobacco smoke. 4MI was studied because of its high potential for human exposure. Groups of 50 male and 50 female F344/N rats were fed diets containing 0-, 625-, 1,250-, or 2,500-ppm 4MI (males) or 0-, 1,250-, 2,500-, or 5,000-ppm 4MI (females) for 106 weeks. Based on the food consumption the calculated average daily doses were approximately 30, 55, or 115 mg 4MI/kg body weight to males and 60, 120, or 250 mg 4MI/kg to females. Survival of all exposed groups of males and females was similar to that of the control groups. Mean body weights of males in the 1,250- and 2,500-ppm groups and females in the 2,500- and 5,000-ppm groups were less than those of the control groups throughout the study. Feed consumption by 5,000-ppm females was less than that by the controls. Clonic seizures, excitability, hyperactivity, and impaired gait were observed primarily in 2,500- and 5,000-ppm females. The incidence of mononuclear cell leukemia in the 5,000-ppm females was significantly greater than that in the controls. The incidences of hepatic histiocytosis, chronic inflammation, and focal fatty change were significantly increased in all exposed groups of male and female rats. The incidences of hepatocellular eosinophilic and mixed cell foci were significantly increased in 2,500-ppm males and 5,000-ppm females. Groups of 50 male and 50 female B6C3F1 mice were fed diets containing 0-, 312-, 625-, or 1,250-ppm 4MI for 106 weeks. Based on the food consumption the calculated average daily doses were approximately 40, 80, or 170 mg 4MI/kg body weight to males and females. Survival of all exposed groups of males and females was similar to that of the control groups. Mean body weights of males and females in the 1

  18. Morphology of neoplastic lesions induced by 1,3-butadiene in B6C3F1 mice.

    PubMed Central

    Miller, R A; Boorman, G A

    1990-01-01

    1,3-Butadiene (CAS No. 106-99-0) was studied for potential carcinogenicity and chronic toxicity by inhalation in B6C3F1 mice. Groups of 50 mice of each sex were exposed to 0, 625, or 1250 ppm 1,3-butadiene for 6 hr/day, 5 days/week for 60 weeks (male) or 61 weeks (female). The study was scheduled for 104 weeks of exposure but was terminated early because of reduced survival related to induction of a variety of tumors in 1,3-butadiene-exposed mice. A second chronic inhalation study was conducted in which male and female mice were exposed to 0, 6.25, 20, 62.5, 200, or 625 ppm for up to 2 years. Additional groups of 50 male mice were exposed to 625 ppm for 13 or 26 weeks, 312 ppm for 52 weeks, or 200 ppm for 40 weeks, then held without exposure until scheduled sacrifice 104 weeks after initial exposure. 1,3-Butadiene-exposed mice from both studies had increased incidences of malignant lymphomas that were observed as early as week 20 in the first study and week 23 in the second study. The lymphomas were primarily lymphocytic and originated in the thymus, although generalized lymphoma was often present. Exposed mice in both studies developed cardiac hemangiosarcomas that were observed as early as week 32 in the first study and week 41 in the second study. Also present were foci of endothelial hyperplasia in the myocardium that were regarded as early evidence of developing hemangiosarcoma. Alveolar epithelial hyperplasia, alveolar/bronchiolar adenomas and alveolar/bronchiolar carcinomas represented the spectrum of proliferative lung lesions induced by exposure to 1,3-butadiene in both studies. Exposure-related proliferative forestomach lesions observed in both studies included epithelial hyperplasia, squamous cell papillomas, and squamous cell carcinomas. 1,3-Butadiene-exposed female mice in both studies developed mammary gland neoplasms at increased incidences. Most of the mammary tumors were pleomorphic adenocarcinomas, but several adenoacanthomas were also seen

  19. Effect of the [Ba2BO3F]∞ Layer on the Band Gap: Synthesis, Characterization, and Theoretical Studies of BaZn2B2O6·nBa2BO3F (n = 0, 1, 2).

    PubMed

    Wu, Hongping; Su, Xin; Han, Shujuan; Yang, Zhihua; Pan, Shilie

    2016-05-16

    Two new zincoborate fluorides with the common formula BaZn2B2O6·nBa2BO3F (n = 1, 2) have been successfully synthesized for the relationship study between the band gaps and crystal structures in zinc-containing borate fluorides. Ba3Zn2B3O9F with n = 1 in the common formula belongs to the orthorhombic space group Pnma (No. 20), and Ba5Zn2B4O12F2 with n = 2 in the common formula crystallizes in the monoclinic space group C2/c (No. 62). They can both be seen as compounds with the n[Ba2BO3F]∞ (n = 1 or 2) layer inserted in the structure of BaZn2B2O6. UV-vis-near-IR diffuse-reflectance spectra show that the band gaps of BaZn2B2O6·nBa2BO3F (n = 0, 1, 2) gradually increase with more [Ba2BO3F]∞ layers inserted. The first-principles calculation indicates that the inserted n[Ba2BO3F]∞ layers play a positive effect in increasing the band gaps of zincoborate fluorides. Furthermore, the IR spectra, thermal behaviors, and refractive indices of these compounds are also studied. PMID:27119618

  20. Synthesis of MoS2/g-C3N4sub> nanocomposites with enhanced visible-light photocatalytic activity for the removal of nitric oxide (NO).

    PubMed

    Wen, M Q; Xiong, T; Zang, Z G; Wei, W; Tang, X S; Dong, F

    2016-05-16

    Molybdenum disulfide and graphitic carbon nitride (MoS2-g-C3N4sub>) nanocomposites with visible-light induced photocatalytic activity were successfully synthesized by a facile ultrasonic dispersion method. The crystalline structure and morphology of the MoS2-g-C3N4sub> nanocomposites were characterized by X-ray diffraction (XRD), transmission electron microcopy (TEM), high-resolution TEM (HRTEM) and scanning electron microscopy (SEM). The optical property of the as-prepared nanocomposites was studied by ultraviolet visible diffusion reflection (UV-vis) and photoluminescence(PL) spectrum. It could be observed from the TEM image that the MoS2 nanosheets and g-C3N4sub> nanoparticles were well combined together. Moreover, the photocatalytic activity of MoS2-g-C3N4sub> composites was evaluated by the removal of nitric oxide under visible light irradiation (>400nm). The experimental results demonstrated that the nanocomposites with the MoS2 content of 1.5 wt% exhibited optimal photocatalytic activity and the corresponding removal rate of NO achieved 51.67%, higher than that of pure g-C3N4sub> nanoparticles. A possible photocatalytic mechanism for the MoS2-g-C3N4sub> nanocomposites with enhanced photocatalytic activity could be ascribed to the hetero-structure of MoS2 and g-C3N4sub>. PMID:27409846

  1. Electronic Structure and Optical Properties of Cu2ZnGeSe4sub>. First-Principles Calculations and Vacuum-Ultraviolet Spectroscopic Ellipsometric Studies

    SciTech Connect

    Choi, Sukgeun; Park, Ji-Sang; Donohue, Andrea; Christensen, Steven T.; To, Bobby; Beall, Carolyn; Wei, Su-Huai; Repins, Ingid L.

    2015-11-19

    Cu2ZnGeSe4sub> is of interest for the development of next-generation thin-film photovoltaic technologies. To understand its electronic structure and related fundamental optical properties, we perform first-principles calculations for three structural variations: kesterite, stannite, and primitive-mixed CuAu phases. The calculated data are compared with the room-temperature dielectric functionϵ=ϵ1+iϵ2 spectrum of polycrystalline Cu2ZnGeSe4sub> determined by vacuum-ultraviolet spectroscopic ellipsometry in the photon-energy range of 0.7 to 9.0 eV. Ellipsometric data are modeled with the sum of eight Tauc-Lorentz oscillators, and the best-fit model yields the band-gap and Tauc-gap energies of 1.25 and 1.19 eV, respectively. A comparison of overall peak shapes and relative intensities between experimental spectra and the calculated ϵ data for three structural variations suggests that the sample may not have a pure (ordered) kesterite phase. We found that the complex refractive index N=n+ik, normal-incidence reflectivity R, and absorption coefficients α are calculated from the modeled ϵ spectrum, which are also compared with those of Cu2ZnSnSe4sub> . The spectral features for Cu2ZnGeSe4sub> appear to be weaker and broader than those for Cu2ZnSnSe4sub> , which is possibly due to more structural imperfections presented in Cu2ZnGeSe4sub> than Cu2ZnSnSe4sub> .

  2. Synthesis of MoS2/g-C3N4sub> nanocomposites with enhanced visible-light photocatalytic activity for the removal of nitric oxide (NO).

    PubMed

    Wen, M Q; Xiong, T; Zang, Z G; Wei, W; Tang, X S; Dong, F

    2016-05-16

    Molybdenum disulfide and graphitic carbon nitride (MoS2-g-C3N4sub>) nanocomposites with visible-light induced photocatalytic activity were successfully synthesized by a facile ultrasonic dispersion method. The crystalline structure and morphology of the MoS2-g-C3N4sub> nanocomposites were characterized by X-ray diffraction (XRD), transmission electron microcopy (TEM), high-resolution TEM (HRTEM) and scanning electron microscopy (SEM). The optical property of the as-prepared nanocomposites was studied by ultraviolet visible diffusion reflection (UV-vis) and photoluminescence(PL) spectrum. It could be observed from the TEM image that the MoS2 nanosheets and g-C3N4sub> nanoparticles were well combined together. Moreover, the photocatalytic activity of MoS2-g-C3N4sub> composites was evaluated by the removal of nitric oxide under visible light irradiation (>400nm). The experimental results demonstrated that the nanocomposites with the MoS2 content of 1.5 wt% exhibited optimal photocatalytic activity and the corresponding removal rate of NO achieved 51.67%, higher than that of pure g-C3N4sub> nanoparticles. A possible photocatalytic mechanism for the MoS2-g-C3N4sub> nanocomposites with enhanced photocatalytic activity could be ascribed to the hetero-structure of MoS2 and g-C3N4sub>.

  3. Synthesis, crystal structure, infrared and Raman spectra of Sr{sub 4}Cu{sub 3}(AsO{sub 4}){sub 2}(AsO{sub 3}OH){sub 4}.3H{sub 2}O and Ba{sub 2}Cu{sub 4}(AsO{sub 4}){sub 2}(AsO{sub 3}OH){sub 3}

    SciTech Connect

    Dordevic, Tamara Karanovic, Ljiljana

    2008-11-15

    The two new compounds, Sr{sub 4}Cu{sub 3}(AsO{sub 4}){sub 2}(AsO{sub 3}OH){sub 4}.3H{sub 2}O (1) and Ba{sub 2}Cu{sub 4}(AsO{sub 4}){sub 2}(AsO{sub 3}OH){sub 3}(2), were synthesized under hydrothermal conditions. They represent previously unknown structure types and are the first compounds synthesized in the systems SrO/BaO-CuO-As{sub 2}O{sub 5}-H{sub 2}O. Their crystal structures were determined by single-crystal X-ray diffraction [space group C2/c, a=18.536(4) A, b=5.179(1) A, c=24.898(5) A, {beta}=93.67(3){sup o}, V=2344.0(8) A{sup 3}, Z=4 for 1; space group P4{sub 2}/n, a=7.775(1) A, c=13.698(3) A, V=828.1(2) A{sup 3}, Z=2 for 2]. The crystal structure of 1 is related to a group of compounds formed by Cu{sup 2+}-(XO{sub 4}){sup 3-} layers (X=P{sup 5+}, As{sup 5+}) linked by M cations (M=alkali, alkaline earth, Pb{sup 2+}, or Ag{sup +}) and partly by hydrogen bonds. In 1, worth mentioning is the very short hydrogen bond length, D...A=2.477(3) A. It is one of the examples of extremely short hydrogen bonds, where the donor and acceptor are crystallographically different. Compound 2 represents a layered structure consisting of Cu{sub 2}O{sub 8} centrosymmetric dimers crosslinked by As1{phi}{sub 4} tetrahedra, where {phi} is O or OH, which are interconnected by Ba, As2 and hydrogen bonds to form a three-dimensional network. The layers are formed by Cu{sub 2}O{sub 8} centrosymmetric dimers of CuO{sub 5} edge-sharing polyhedra, crosslinked by As1O{sub 4} tetrahedra. Vibrational spectra (FTIR and Raman) of both compounds are described. The spectroscopic manifestation of the very short hydrogen bond in 1, and ABC-like spectra in 2 were discussed. - Graphical abstract: The two new compounds, Sr{sub 4}Cu{sub 3}(AsO{sub 4}){sub 2}(AsO{sub 3}OH){sub 4}.3H{sub 2}O (1) and Ba{sub 2}Cu{sub 4}(AsO{sub 4}){sub 2}(AsO{sub 3}OH){sub 3}(2), were synthesized under hydrothermal conditions. They represent previously unknown structure types and are the first compounds synthesized in the

  4. Small 6q16.1 Deletions Encompassing POU3F2 Cause Susceptibility to Obesity and Variable Developmental Delay with Intellectual Disability.

    PubMed

    Kasher, Paul R; Schertz, Katherine E; Thomas, Megan; Jackson, Adam; Annunziata, Silvia; Ballesta-Martinez, María J; Campeau, Philippe M; Clayton, Peter E; Eaton, Jennifer L; Granata, Tiziana; Guillén-Navarro, Encarna; Hernando, Cristina; Laverriere, Caroline E; Liedén, Agne; Villa-Marcos, Olaya; McEntagart, Meriel; Nordgren, Ann; Pantaleoni, Chiara; Pebrel-Richard, Céline; Sarret, Catherine; Sciacca, Francesca L; Wright, Ronnie; Kerr, Bronwyn; Glasgow, Eric; Banka, Siddharth

    2016-02-01

    Genetic studies of intellectual disability and identification of monogenic causes of obesity in humans have made immense contribution toward the understanding of the brain and control of body mass. The leptin > melanocortin > SIM1 pathway is dysregulated in multiple monogenic human obesity syndromes but its downstream targets are still unknown. In ten individuals from six families, with overlapping 6q16.1 deletions, we describe a disorder of variable developmental delay, intellectual disability, and susceptibility to obesity and hyperphagia. The 6q16.1 deletions segregated with the phenotype in multiplex families and were shown to be de novo in four families, and there was dramatic phenotypic overlap among affected individuals who were independently ascertained without bias from clinical features. Analysis of the deletions revealed a ∼350 kb critical region on chromosome 6q16.1 that encompasses a gene for proneuronal transcription factor POU3F2, which is important for hypothalamic development and function. Using morpholino and mutant zebrafish models, we show that POU3F2 lies downstream of SIM1 and controls oxytocin expression in the hypothalamic neuroendocrine preoptic area. We show that this finding is consistent with the expression patterns of POU3F2 and related genes in the human brain. Our work helps to further delineate the neuro-endocrine control of energy balance/body mass and demonstrates that this molecular pathway is conserved across multiple species.

  5. Experimental and theoretical methods to study structural phase transition mechanisms in K{sub 3}WO{sub 3}F{sub 3} oxyfluoride

    SciTech Connect

    Krylov, A.S.; Sofronova, S.N.; Kolesnikova, E.M.; Ivanov, Yu.N.; Sukhovsky, A.A.; Goryainov, S.V.; Ivanenko, A.A.; Shestakov, N.P.; Kocharova, A.G.; Vtyurin, A.N.

    2014-10-15

    The results of structural phase transitions mechanisms study in K{sub 3}WO{sub 3}F{sub 3}oxyfluoride are represented by different experimental and theoretical methods. The structural phase transition anomalies at T{sub 1}=452 K and T{sub 2}=414 K of Raman and IR spectra have been analyzed. Using vibrational spectroscopy methods, the NMR-experiment has been done to clarify the nature of found phase transitions: displacive types or order-disorder types. The model of “disordered” crystal was proposed, and the results of lattice dynamics calculation in frameworks of the generalized Gordon–Kim method of ordered (R3) and “disordered” crystals were compared. The high pressure phases were studied by the Raman technique too. - Graphical abstract: (1) Two possible configuration of octahedra. (2). All phases Raman lines of octahedra. (3) All phases IR lines of octahedra. (4) NMR spectra of all phases. - Highlights: • The results of study oxyfluoride K{sub 3}WO{sub 3}F{sub 3} are represented by Raman, IR, NMR technique. • The high pressure phases were studied by the Raman technique. • The anionic octahedra [WO{sub 3}F{sub 3}]{sup 3−} are not ordered below the both phase transitions. • The ferroelectric phase is realized due to the shift of atoms without F/O ordering. • Both of found phase transitions are close to the second order.

  6. Thalidomide enhances both primary and secondary host resistances to Listeria monocytogenes infection by a neutrophil-related mechanism in female B6C3F1 mice

    SciTech Connect

    Guo, Tai L. . E-mail: tlguo@hsc.vcu.edu; Chi, Rui P.; Karrow, Niel A.; Zhang, Ling X.; Pruett, Stephen B.; Germolec, Dori R.; White, Kimber L.

    2005-12-15

    Previously, we have reported that thalidomide can modulate the immune responses in female B6C3F1 mice. Furthermore, thalidomide immunomodulation increased primary host resistance to intravenously infected Listeria monocytogenes. The present study was intended to evaluate the mechanisms underlying the enhanced host resistance to L. monocytogenes by focusing on the neutrophils. Female B6C3F1 mice were treated intraperitoneally with thalidomide (100 mg/kg) for 15 days. Exposure to thalidomide increased the numbers of neutrophils in the spleens and livers of L. monocytogenes-infected mice when compared to the L. monocytogenes-infected control mice. Additionally, the percentage of neutrophils was also significantly increased after Thd treatment in L. monocytogenes-infected mice. Further studies using antibodies to deplete corresponding cells indicated that thalidomide-mediated increase in primary host resistance (both the moribundity and colony counts in the liver and spleen) to L. monocytogenes infection was due to its effect on neutrophils but not CD8{sup +} T cells or NK cells. Finally, Thd exposure also increased host resistance to secondary host resistance to L. monocytogenes infection, and depletion of neutrophils abolished the protective effect. In conclusion, thalidomide enhanced host resistance to both primary and secondary L. monocytogenes infections by a neutrophil-related mechanism in female B6C3F1 mice.

  7. Collisional quenching reaction rate coefficients of N2 (A3Σu+) by C2F6 and C3F8

    NASA Astrophysics Data System (ADS)

    Suzuki, Susumu; Kuboaki, Masaru; Itoh, Haruo

    2015-09-01

    The collisional quenching reaction rate coefficient of N2 (A3Σu+) by various air pollutant gases were determined from the measurement of the effective lifetime of N2 (A3Σu+) in pure N2 (5-nine) with a small amount of air pollutant gases as an admixture. Derivation of the rate coefficient was performed the waveform analysis of the transient ionization current after turning off the UV light in the Townsend discharge. In this paper, we report that the obtained collisional quenching reaction rate coefficients of N2 (A3Σu+) by C2F6 and C3F8 are (2.3 +/- 1.8) × 10-15 cm3/s and (1.6 +/- 0.8) × 10-14 cm3/s, respectively. Furthermore, we investigate the relationship between the rate coefficient and the mass number of their quenching molecular gases. Firstly, it is confirmed that the rate coefficient take large value with an increase in the mass number of the quenching gases. Secondly, if H atom is included in the gas molecules such as CH4, C2F6 and C3F8 the rate coefficient take large value, but if the molecules including F atom such as C2F6 and C3F8 instead of H atom in this study, more smaller values of the collisional quenching reaction rate coefficient are observed.

  8. New oxyfluoride glass with high fluorine content and laser patterning of nonlinear optical BaAlBO{sub 3}F{sub 2} single crystal line

    SciTech Connect

    Shionozaki, K.; Honma, T.; Komatsu, T.

    2012-11-01

    A new oxyfluoride glass of 50BaF{sub 2}-25Al{sub 2}O{sub 3}-25B{sub 2}O{sub 3} (mol. %) with a large fraction of fluorine, i.e., F/(F + O) = 0.4, was prepared using a conventional melt-quenching method in order to synthesize new glass-ceramics containing nonlinear optical oxyfluoride crystals. The refractive index at 632.8 nm and ultra-violet cutoff wavelength of the glass were 1.564 and {approx}200 nm, respectively. Eu{sup 3+} ions in the glass showed a high quantum yield of 88% in the photoluminescence spectrum in the visible region. BaAlBO{sub 3}F{sub 2} crystals (size: 50-100 nm) showing second harmonic generations were formed through the crystallization of the glass. Lines consisting of BaAlBO{sub 3}F{sub 2} crystals were patterned successfully on the glass surface by laser irradiations (Yb:YVO{sub 4} laser with a wavelength of 1080 nm, laser power of 1.1 W, scanning speed of 8 {mu}m/s). High resolution transmission electron microscope observations combined with a focused ion beam technique indicate that BaAlBO{sub 3}F{sub 2} crystals are highly oriented just like a single crystal. The present study proposes that the new oxyfluoride glass and glass-ceramics prepared have a high potential for optical device applications.

  9. New organically templated gallium oxalate-phosphate structures based on Ga{sub 4}(PO{sub 4}){sub 4}(C{sub 2}O{sub 4}) building unit

    SciTech Connect

    Chen Zhenxia; Tan Songliang; Weng Linhong; Zhou Yaming; Gao Xiang; Zhao Dongyuan . E-mail: dyzhao@fudan.edu.cn

    2006-07-15

    Five organic-inorganic hybrid gallium oxalate-phosphates, [Ga{sub 2}(PO{sub 4}){sub 2}(H{sub 2}O)(C{sub 2}O{sub 4}){sub 0.5}](C{sub 3}N{sub 2}H{sub 12}){sub 0.5}(H{sub 2}O) (1), [Ga{sub 2}(PO{sub 4}){sub 2}(C{sub 2}O{sub 4}){sub 0.5}](C{sub 2}N{sub 2}H{sub 10}){sub 0.5}(H{sub 2}O) (2), [Ga{sub 2}(PO{sub 4}){sub 2}(C{sub 2}O{sub 4}){sub 0.5}](C{sub 3}N{sub 2}H{sub 12}){sub 0.5} (3), [Ga{sub 2}(PO{sub 4}){sub 2}(H{sub 2}PO{sub 4}){sub 0.5}(C{sub 2}O{sub 4}){sub 0.5}](C{sub 4}N{sub 3}H{sub 16}){sub 0.5} (H{sub 2}O){sub 1.5} (4) and [Ga{sub 2.5}(PO{sub 4}){sub 2.5}(H{sub 2}O){sub 1.5}(C{sub 2}O{sub 4}){sub 0.5}](C{sub 4}N{sub 3}H{sub 15}){sub 0.5} (5), have been synthesized by using 1,3-diaminopropane, ethylenediamine and diethylene triamine as structure-directing agents under hydrothermal condition. The structures of 1-5 are based on Ga{sub 4}(PO{sub 4}){sub 4}(C{sub 2}O{sub 4}) building unit made up from Ga{sub 2}O{sub 8}(C{sub 2}O{sub 4}) oxalate-bridging dimer and alternating PO{sub 4} and GaO{sub 4} tetrahedral units. Compound 1 is layered structure where the building units link together in the same orientation. Corner sharing of these similar layers result in three-dimensional (3-D) structure 2. However, in compound 3, the building units arrange in a wave-like way to generate two types of eight member ring (8MR) channels. Both 4 and 5 contain the layers where the building units have an opposite orientation. Those layers are linked by H{sub 2}PO{sub 4} group and Ga(PO{sub 4})(H{sub 2}O){sub 3} cluster, respectively, to form 3-D frameworks with 12MR large pore channels. Compounds 2-5 exhibit intersecting 3-D channels where the protoned amines are located. - Graphical abstract: Compound 4 contains layers where the Ga{sub 4}(PO{sub 4}){sub 4}(C{sub 2}O{sub 4}) building units are connected to each other in an opposite orientation. The phosphorous atom sits on a twofold axis, is positioned between the layers and joins the GaO{sub 4}(C{sub 2}O{sub 4}) group from

  10. Beyond Yolk–Shell Nanoparticles: Fe 3 O 4sub> @Fe 3 C Core@Shell Nanoparticles as Yolks and Carbon Nanospindles as Shells for Efficient Lithium Ion Storage

    SciTech Connect

    Zhang, Jianan; Wang, Kaixi; Xu, Qun; Zhou, Yunchun; Cheng, Fangyi; Guo, Shaojun

    2015-02-25

    In order to well address the problems of large volume change and dissolution of Fe3O4sub> nanomaterials during Li+ intercalation/extraction, herein we demonstrate a one-step in situ nanospace-confined pyrolysis strategy for robust yolk–shell nanospindles with very sufficient internal void space (VSIVS) for high-rate and long-term lithium ion batteries (LIBs), in which an Fe3O4sub>@Fe3C core@shell nanoparticle is well confined in the compartment of a hollow carbon nanospindle. This structure can not only introduce VSIVS to accommodate volume change of Fe3O4sub> but also afford a dual shell of Fe3C and carbon to restrict Fe3O4sub> dissolution, thus providing dual roles for greatly improving the capacity retention. Consequently, Fe3O4sub>@Fe3C–C yolk–shell nanospindles deliver a high reversible capacity of 1128.3 mAh g–1 at even 500 mA g–1, excellent high rate capacity (604.8 mAh g–1 at 2000 mA g1), and prolonged cycling life (maintaining 1120.2 mAh g–1 at 500 mA g–1 for 100 cycles) for LIBs, which are much better than those of Fe3O4sub>@C core@shell nanospindles and Fe3O4sub> nanoparticles. The present Fe3O4sub>@Fe3C–C yolk–shell nanospindles are the most efficient Fe3O4sub>-based anode materials ever reported for LIBs.

  11. Insight into the Atomic Structure of High-Voltage Spinel LiNi0.5Mn1.5O4sub> Cathode Material in the First Cycle

    SciTech Connect

    Huang, Xuejie; Yu, Xiqian; Lin, Mingxiang; Ben, Liubin; Sun, Yang; Wang, Hao; Yang, Zhenzhong; Gu, Lin; Yang, Xiao -Qing; Zhao, Haofei; Yu, Richeng; Armand, Michel

    2014-12-22

    Application of high-voltage spinel LiNi0.5Mn1.5O4sub> cathode material is the closest and the most realistic approach to meeting the midterm goal of lithium-ion batteries for electric vehicles (EVs) and plug-in hybrid electric vehicles (HEVs). However, this application has been hampered by long-standing issues, such as capacity degradation and poor first-cycle Coulombic efficiency of LiNi0.5Mn1.5O4sub> cathode material. Although it is well-known that the structure of LiNi0.5Mn1.5O4sub> into which Li ions are reversibly intercalated plays a critical role in the above issues, performance degradation related to structural changes, particularly in the first cycle, are not fully understood. Here, we report detailed investigations of local atomic-level and average structure of LiNi0.5Mn1.5O4sub> during first cycle (3.5–4.9 V) at room temperature. We observed two types of local atomic-level migration of transition metals (TM) ions in the cathode of a well-prepared LiNi0.5Mn1.5O4sub>//Li half-cell during first charge via an aberration-corrected scanning transmission electron microscopy (STEM). Surface regions (~2 nm) of the cycled LiNi0.5Mn1.5O4sub> particles show migration of TM ions into tetrahedral Li sites to form a Mn3O4sub>-like structure. However, subsurface regions of the cycled particles exhibit migration of TM ions into empty octahedral sites to form a rocksalt-like structure. The migration of these TM ions are closely related to dissolution of Ni/Mn ions and building-up of charge transfer impedance, which contribute significantly to the capacity degradation and the poor first-cycle Coulombic efficiency of spinel LiNi0.5Mn1.5O4sub> cathode material. Accordingly, we provide suggestions of effective stabilization of LiNi0.5

  12. Crystal structure and thermal expansion of the low- and high-temperature forms of BaM{sup IV}(PO{sub 4}){sub 2} compounds (M=Ti, Zr, Hf and Sn)

    SciTech Connect

    Bregiroux, D.; Popa, K.; Jardin, R.; Raison, P.E.; Wallez, G.; Quarton, M.; Brunelli, M.; Ferrero, C.; Caciuffo, R.

    2009-05-15

    The crystal structure of beta-BaZr(PO{sub 4}){sub 2}, archetype of the high-temperature forms of BaM(PO{sub 4}){sub 2} phosphates (with M=Ti, Zr, Hf and Sn), has been solved ab initio by Rietveld analysis from synchrotron X-ray powder diffraction data. The phase transition appears as a topotactic modification of the monoclinic (S.G. C2/m) lamellar alpha-structure into a trigonal one (S.G. P3-barm1) through a simple mechanism involving the unfolding of the [Zr(PO{sub 4}){sub 2}]{sub n}{sup 2-} layers. The thermal expansion is very anisotropic (e.g., -4.14}){sub 2}) and quite different in the two forms, as a consequence of symmetry. It stems from a complex combination of several mechanisms, involving bridging oxygen rocking in M-O-P linkages, and 'bond thermal expansion'. - Graphical abstract: The layered high-temperature form of BaM(PO{sub 4}){sub 2}, only expands along the c-axis.

  13. Temperature-dependent framework–template interaction of |Na{sub 6}(H{sub 2}O){sub 8}|[ZnPO{sub 4}]{sub 6} sodalite

    SciTech Connect

    Robben, Lars Gesing, Thorsten M.

    2013-11-15

    The partial dehydration followed by the decomposition of sodium-zincophosphate-hydrosodalite caused by the total water loss was examined by temperature-dependent X-ray powder diffraction, Fourier transform infrared (FTIR) and Raman spectroscopy as well as thermogravimetry combined with difference thermoanalysis. The dehydration causing the decomposition of this sodalite could be described in a two step-process. Initially two water molecules per unit-cell were lost, changing the interaction between the zincophosphate framework and the remaining water molecules as well as sodium cations as non-framework constituents. In this stage a 3+3 coordination of water molecules and sodium cations in the sodalite cage is observed. Using the autocorrelation function (AC) for the evaluation of the temperature-dependent FTIR spectra of sodalites is reported here for the first time. Calculating the changes in the AC broadness, structural features could well be analyzed due to its correlation with respective structural parameters. Temperature dependent Raman data was used to give a band assignment of bands at Raman shifts below 300 cm{sup −1}. - Graphical abstract: The thermal decomposition of |Na{sub 6}(H{sub 2}O){sub 8}|[ZnPO{sub 4}]{sub 6} sodalite is a two-step process with an initial loss of two water molecules at 400 K, intermediately stabilizing the highly stressed framework. Further heating leads to a subsequent loss of the remaining six water molecules and a breakup of the sodalite framework. A beryllonite-type NaZnPO{sub 4} is the final product of this process. Display Omitted - Highlights: • The decomposition of |Na{sub 6}(H{sub 2}O){sub 8}|[ZnPO{sub 4}]{sub 6} sodalite is a two-step process. • Initial loss of two water molecule at 400 K stabilizes the sodalite (step 1). • Further heating leads to complete loss of water and structural breakdown. • Autocorrelation of temperature dependent FTIR-spectra gives structural information.

  14. Dipole ordering, ionic conductivity, and cold nuclear fusion: Three types of cation mobility in the orthophosphates KTiOPO{sub 4} Na{sub 3}M{sub 2}(PO{sub 4}){sub 3} (M=Sc,Fe,Cr), NaTh{sub 2}(PO{sub 4}){sub 3}, KD{sub 2}PO{sub 4}, and related compounds

    SciTech Connect

    Kalinin, V.B.

    1995-05-01

    As shown in earlier studies, crystals whose structures contain closely located positions statistically occupied by metal cations (split positions) may exhibit anomalies in physical properties, such as ferroelectric (FE) or antiferroelectric (AFE) ordering, superionic conduction (SIC), low thermal expansion coefficients, ultrarapid nuclear relaxation, etc. For example, splitting of Na positions lead to Fe ordering in low-temperature structures of Na{sub 3}Sc{sub 2}(PO{sub 4}){sub 3} and NaTh{sub 2}(PO{sub 4}){sub 3} and to AFE ordering in Na{sub 3}Zr{sub 2}Si{sub 2}PO{sub 12} (stoichiometric NASICON - one of the best three-dimensional superionic conductors). The coexistance of two types of split cation positions in KFeFPO{sub 4} was reported by Belokoeneva et al.; later, these splittings were shown to be accompanied by FE and AFE ordering. In this paper, the authors report an attempt to establish inter-relations between various physical phenomena related to cation mobility. They discuss three manifestations of cation mobility in orthophosphates with split cation positions: dipole ordering of both FE and AFE types, superionic conduction, and cold nuclear fusion (CNF).

  15. Passive Q-switching of a Tm,Ho:KLu(WO4sub>)2 microchip laser by a Cr:ZnS saturable absorber.

    PubMed

    Serres, J M; Loiko, P; Mateos, X; Jambunathan, V; Yasukevich, A S; Yumashev, K V; Petrov, V; Griebner, U; Aguiló, M; Díaz, F

    2016-05-10

    A diode-pumped Tm,Ho:KLu(WO4sub>)2 microchip laser passively Q-switched with a Cr:ZnS saturable absorber generated an average output power of 131 mW at 2063.6 nm with a slope efficiency of 11% and a Q-switching conversion efficiency of 58%. The pulse characteristics were 14  ns/9  μJ at a pulse repetition frequency of 14.5 kHz. With higher modulation depth of the saturable absorber, 9  ns/10.4  μJ/8.2  kHz pulses were generated at 2061.1 nm, corresponding to a record peak power extracted from a passively Q-switched Tm,Ho laser of 1.15 kW. A theoretical model is presented, predicting the pulse energy and duration. The simulations are in good agreement with the experimental results. PMID:27168288

  16. Band alignment of atomic layer deposited (HfZrO{sub 4}){sub 1−x}(SiO{sub 2}){sub x} gate dielectrics on Si (100)

    SciTech Connect

    Heo, Sung; Tahir, Dahlang; Chung, Jae Gwan; Lee, Jae Cheol; Kim, KiHong; Lee, Junho; Lee, Hyung-Ik; Park, Gyeong Su; Oh, Suhk Kun; Kang, Hee Jae; Choi, Pyungho; Choi, Byoung-Deog

    2015-11-02

    The band alignment of atomic layer deposited (HfZrO{sub 4}){sub 1−x}(SiO{sub 2}){sub x} (x = 0, 0.10, 0.15, and 0.20) gate dielectric thin films grown on Si (100) was obtained by using X-ray photoelectron spectroscopy and reflection electron energy loss spectroscopy. The band gap, valence band offset, and conduction band offset values for HfZrO{sub 4} silicate increased from 5.4 eV to 5.8 eV, from 2.5 eV to 2.75 eV, and from 1.78 eV to 1.93 eV, respectively, as the mole fraction (x) of SiO{sub 2} increased from 0.1 to 0.2. This increase in the conduction band and valence band offsets, as a function of increasing SiO{sub 2} mole fraction, decreased the gate leakage current density. As a result, HfZrO{sub 4} silicate thin films were found to be better for advanced gate stack applications because they had adequate band gaps to ensure sufficient conduction band offsets and valence band offsets to Si.

  17. Anisotropic lattice thermal expansion of PbFeBO4sub>: A study by X-ray and neutron diffraction, Raman spectroscopy and DFT calculations

    SciTech Connect

    Murshed, M. Mangir; Mendive, Cecilia B.; Curti, Mariano; Nénert, Gwilherm; Kalita, Patricia E.; Lipinska, Kris; Cornelius, Andrew L.; Huq, Ashfia; Gesing, Thorsten M.

    2014-11-01

    We present the lattice thermal expansion of mullite-type PbFeBO4sub> in this study. The thermal expansion coefficients of the metric parameters were obtained from composite data collected from temperature-dependent neutron and X-ray powder diffraction between 10 K and 700 K. The volume thermal expansion was modeled using extended Grüneisen first-order approximation to the zero-pressure equation of state. The additive frame of the model includes harmonic, quasi-harmonic and intrinsic anharmonic potentials to describe the change of the internal energy as a function of temperature. Moreover, the unit-cell volume at zero-pressure and 0 K was optimized during the DFT simulations. Harmonic frequencies of the optical Raman modes at the Γ-point of the Brillouin zone at 0 K were also calculated by DFT, which help to assign and crosscheck the experimental frequencies. The low-temperature Raman spectra showed significant anomaly in the antiferromagnetic regions, leading to softening or hardening of some phonons. Selected modes were analyzed using a modified Klemens model. The shift of the frequencies and the broadening of the line-widths helped to understand the anharmonic vibrational behaviors of the PbO4, FeO6 and BO3 polyhedra as a function of temperature.

  18. An air-stable Na3SbS4sub> superionic conductor prepared by a rapid and economic synthetic procedure

    SciTech Connect

    Wang, Hui; Chen, Yan; Hood, Zachary D.; Samuthira Pandian, Amaresh; Keum, Jong Kahk; An, Ke; Sahu, Gayatri; Liang, Chengdu

    2016-01-01

    All-solid-state sodium batteries, using abundant sodium resources and solid electrolyte, hold much promise for safe, low cost, large-scale energy storage. To realize the practical applications of all solid Na-ion batteries at ambient temperature, the solid electrolytes are required to have high ionic conductivity, chemical stability, and ideally, easy preparation. Ceramic electrolytes show higher ionic conductivity than polymers, but they often require extremely stringent synthesis conditions, either high sintering temperature above 1000 C or long-time, low-energy ball milling. Herein, we report a new synthesis route for Na3SbS4sub>, a novel Na superionic conductor that needs much lower processing temperature below 200 C and easy operation. This new solid electrolyte exhibits a remarkable ionic conductivity of 1.05 mS cm-1 at 25 °C and is chemically stable under ambient atmosphere. In conclusion, this synthesis process provides unique insight into the current state-of-the-art solid electrolyte preparation and opens new possibilities for the design of similar materials.

  19. Stable platinum nanoparticles on specific MgAl2O4sub> spinel facets at high temperatures in oxidizing atmospheres

    SciTech Connect

    Li, Wei-Zhen; Kovarik, Libor; Mei, Donghai; Liu, Jun; Wang, Yong; Peden, Charles H. F.

    2013-09-25

    The development of thermally stable, nanometer-sized precious metal-based catalysts remains a daunting challenge. Such materials, especially those based on the use of costly platinum metal, are essential and, to date, non-replaceable for a large number of industrially important catalytic processes. Here we report a well-defined cuboctahedral MgAl2O4sub> spinel support material that is capable of stabilizing platinum particles in the range of 1–3 nm on its relatively abundant {111} facets during extremely severe aging at 800 °C in air for 1 week. The aged catalysts retain platinum dispersions of 15.9% with catalytic activities for methanol oxidation being ~80% of that of fresh ones, whereas a conventional Pt/γ-Al2O3 catalyst is severely sintered and nearly inactive. Finally, we reveal the origin of the markedly superior ability of spinel {111} facets, resulting from strong interactions between spinel surface oxygens and epitaxial platinum {111} facets, inspiring the rational design of anti-sintering supported platinum group catalysts.

  20. Optical gain in capillary light guides filled with NaYF4sub>: Yb3+, Er3+ nanocolloids.

    PubMed

    Patel, Darayas N; Sarkisov, Sergey S; Darwish, Abdalla M; Ballato, John

    2016-09-01

    A capillary light guide optical amplifier using nanocolloids of Yb3+-Er3+ co-doped NaYF4sub> as a filler was successfully demonstrated. A 7-cm-long and 150-micron-inner-diameter capillary light guide was capable to amplify a pulsed optical signal at 1550 nm with a gain coefficient of 0.15 cm-1 at a pump power of 4 mW (980-nm wavelength). The nanocolloid gain medium was prepared by pulverizing the phosphor powder with a high-speed planetary ball mill. Ball milling of the powder in water produced nanoparticles with a size of approximately 130 nm that after drying were transferred to a liquid with high refractive index (1.551 at 1550 nm) required to maintain light confinement within the fused silica capillary light guide. The results show that RE-doped colloids of nanocrystals can be potentially used as liquid gain media fillers in capillary light guide lasers and amplifiers with high photostability and low toxicity. PMID:27607717

  1. X-ray absorption spectroscopy of LiBF 4sub> in propylene carbonate. A model lithium ion battery electrolyte

    SciTech Connect

    Smith, Jacob W.; Lam, Royce K.; Sheardy, Alex T.; Shih, Orion; Rizzuto, Anthony M.; Borodin, Oleg; Harris, Stephen J.; Prendergast, David; Saykally, Richard J.

    2014-08-20

    Since their introduction into the commercial marketplace in 1991, lithium ion batteries have become increasingly ubiquitous in portable technology. Nevertheless, improvements to existing battery technology are necessary to expand their utility for larger-scale applications, such as electric vehicles. Advances may be realized from improvements to the liquid electrolyte; however, current understanding of the liquid structure and properties remains incomplete. X-ray absorption spectroscopy of solutions of LiBF4sub> in propylene carbonate (PC), interpreted using first-principles electronic structure calculations within the eXcited electron and Core Hole (XCH) approximation, yields new insight into the solvation structure of the Li+ ion in this model electrolyte. By generating linear combinations of the computed spectra of Li+-associating and free PC molecules and comparing to the experimental spectrum, we find a Li+–solvent interaction number of 4.5. This result suggests that computational models of lithium ion battery electrolytes should move beyond tetrahedral coordination structures.

  2. Structure and conductivity of the NASICON analog Na/sub 3/SC/sub 2/(PO/sub 4/)/sub 3/

    SciTech Connect

    Susman, S.; Delbecq, C.J.; Brun, T.O.; Prince, E.

    1982-01-01

    Neutron and x-ray diffraction data of Na/sub 3/SC/sub 2/(PO/sub 4/)/sub 3/ are presented that show the transition from an ordinary-conducting, high temperature phase to a still higher temperature, superionic conducting phase. There are at least four polymorphic modifications. At room temperature, the refined neutron diffraction data confirm the Cc space group reported by Efremov and Kalinin but with a = 16.0449(24), b = 8.9225(15), c = 9.0656(13)A, ..beta.. = 126.918(21), R/sub weighted pattern/ = 17.5%, and R/sub expected/ = 7%. Between 25/sup 0/C and 64/sup 0/C, a second polymorph appears. The structure is monoclinic but has not yet been refined. At 64/sup 0/C, a third polymorph C appears. It is rhombohedral R3c. Using hexagonal axes, a = 8.9273(2), c = 22.3668A, R/sub wp/ = 6.28% and R/sub e/ = 3.83% at 100/sup 0/C. At 166/sup 0/C, the high temperature polymorph D appears. It is the superconducting phase of NASICON(Sc). It, too, is rhombohedral R3c with a = 8.9274(1), c = 22.5493(6)A, R/sub wp/ = 5.81% and R/sub e/ = 3.87% at 225/sup 0/C. The diffraction data are correlated with ionic conductivity measurements as a function of temperature.

  3. Upper critical fields of high-T/sub c/ superconducting Y/sub 2-//sub x/Ba/sub x/CuO/sub 4-//sub y/

    SciTech Connect

    Orlando, T.P.; Delin, K.A.; Foner, S.; McNiff E.J. Jr.; Tarascon, J.M.; Greene, L.H.; McKinnon, W.R.; Hull, G.W.

    1987-05-01

    We have measured the upper critical field B/sub c//sub 2/(T) of Y/sub 2-//sub x/Ba/sub x/CuO/sub 4-//sub y/ with x = 0.4 near T/sub c/ in dc fields up to 20 T and at 77 K with pulsed fields to 45 T. The data yield (dB/sub c//sub 2//dT)/sub T //sub = //sub T>c/ = 1.3 T/K and T/sub c/ = 89.5 K for the midpoint of the resistive transitions, and (dB/sub c//sub 2//dT)/sub T //sub = //sub T>c/ = 5 +- 1 T/K and T/sub c/ = 95.1 K for the onset. The estimates for B/sub c//sub 2/(0) range from 80 to 320 T. Pulsed-field data suggest that a fraction of the material is still superconducting above 45 T at 77 K.

  4. New localized/delocalized emitting state of Eu2+ in orange-emitting hexagonal EuAl2O4sub>

    SciTech Connect

    Liu, Feng; Meltzer, Richard S.; Li, Xufan; Budai, John D.; Chen, Yu -Sheng; Pan, Zhengwei

    2014-11-18

    Eu2+-activated phosphors are being widely used in illuminations and displays. Some of these phosphors feature an extremely broad and red-shifted Eu2+ emission band; however, convincing explanation of this phenomenon is lacking. Here we report a new localized/delocalized emitting state of Eu2+ ions in a new hexagonal EuAl2O4sub> phosphor whose Eu2+ luminescence exhibits a very large bandwidth and an extremely large Stokes shift. At 77 K, two luminescent sites responsible for 550 nm and 645 nm broadband emissions are recognized, while at room temperature only the 645 nm emission band emits. The 645 nm emission exhibits a typical radiative lifetime of 1.27 μs and an unusually large Stokes shift of 0.92 eV. We identify the 645 nm emission as originating from a new type of emitting state whose composition is predominantly that of localized 4f65d character but which also contains a complementary component with delocalized conduction-band-like character. This investigation gives new insights into a unique type of Eu2+ luminescence in solids whose emission exhibits both a very large bandwidth and an extremely large Stokes shift.

  5. Hydrothermal synthesis, structural and physico-chemical characterizations of two Nasicon phosphates: M{sub 0.50}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} (M = Mn, Co)

    SciTech Connect

    Essehli, Rachid; Bali, Brahim El; Benmokhtar, S.; Fejfarova, Karla; Dusek, Michal

    2009-07-01

    The family of titanium Nasicon-phosphates of generic formula M{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} has been revisited using hydrothermal techniques. Two phases have been synthesized: Mn{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} (MnTiP) and Co{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} (CoTiP). Single crystal diffraction studies show that they exhibit two different structural types. Mn{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} phosphate crystallizes in the R-3 space group, with the cell parameters a = 8.51300(10) A and c = 21.0083(3) A (V = 1318.52(3) A{sup 3} and Z = 6). The Co{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} phosphate crystallizes in the R-3c space group, with a = 8.4608(9) A and c = 21.174(2) A (V = 1312.7(2) A{sup 3} and Z = 6). These two compounds are clearly related to the parent Nasicon-type rhombohedral structure, which can be described using [Ti{sub 2}(PO{sub 4}){sub 3}] framework composed of two [TiO{sub 6}] octahedral interlinked via three [PO{sub 4}] tetrahedra. {sup 31}P magic-angle spinning nuclear magnetic resonance (MAS-NMR) data are presented as supporting data. Curie-Weiss-type behavior is observed in the magnetic susceptibility. The phases are also characterized by IR spectroscopy and UV-visible.

  6. Scintillation properties of Eu2+-doped KBa2I5 and K2BaI4sub>

    SciTech Connect

    Stand, L.; Zhuravleva, M.; Chakoumakos, Bryan C.; Johnson, J.; Lindsey, Adam; Melcher, Charles L.

    2015-09-25

    We report two new ternary metal halide scintillators, KBa2I5 and K2BaI4sub>, activated with divalent europium. Single crystal X-ray diffraction measurements confirmed that KBa2I5 has a monoclinic structure (P21/c) and that K2BaI4sub> has a rhombohedral structure (R3c). Differential scanning calorimetry showed singular melting and crystallization points, making these compounds viable candidates for melt growth. We grew 13 mm diameter single crystals of KBa2I5:Eu2+ and K2BaI4sub>:Eu2+ in evacuated quartz ampoules via the vertical Bridgman technique. The optimal Eu2+ concentration was 4% for KBa2I5 and 7% for K2BaI4sub>. The X-ray excited emissions at 444 nm for KBa2I5:Eu 4% and 448 nm for K2BaI4sub>:Eu 7% arise from the 5d-4f radiative transition in Eu2+. KBa2I5:Eu 4% has a light yield of 90,000 photons/MeV, with an energy resolution of 2.4% and K2BaI4sub>:Eu 7% has a light yield of 63,000 ph/MeV, with an energy resolution of 2.9% at 662 keV. Both crystals have an excellent proportional response to a wide range of gamma-ray energies.

  7. Synthesis and photoluminescence properties of Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14}:Sm{sup 3+} red phosphor for white light emitting diodes

    SciTech Connect

    Zhu, Ge; Ci, Zhipeng; Shi, Yurong; Wang, Yuhua

    2014-07-01

    Highlights: • A novel red phosphor Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14}:Sm{sup 3+} was synthesized and investigated firstly. • The structure and characteristic luminescence properties are discussed. • The excellent thermal stability was found and investigated. • It has good color saturation, the CIE is close to that of commercial Y{sub 2}O{sub 3}:Eu{sup 3+}. - Abstract: A series of Sm{sup 3+} doped Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14} red phosphors were successfully synthesized. X-ray diffraction analysis indicates that all the samples are single phased. The luminescence property is investigated in detail by measuring their photoluminescence excitation and emission spectra. Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14}:Sm{sup 3+} phosphors show strong absorption in 400–410 nm region, which is suitable for application in LEDs. When excited at 403 nm, Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14}:Sm{sup 3+} phosphor can emit red emission with CIE chromaticity coordinates (0.615, 0.384). The optimal doping concentration of Sm{sup 3+} doped Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14} is measured to be 0.02. The thermal quenching property is also measured and compared with the commercial red phosphor Y{sub 2}O{sub 3}:Eu{sup 3+} (Topstar, TXC-RIA). The results indicate Ca{sub 19}Mg{sub 2}(PO{sub 4}){sub 14}:Sm{sup 3+} phosphors have potential to serve as a red phosphor for white LEDs.

  8. Upregulation of estrogen receptor expression in the uterus of ovariectomized B6C3F1 mice and Ishikawa cells treated with bromoethane

    SciTech Connect

    Aoyama, Hiroaki; Couse, John F.; Hewitt, Sylvia C.; Haseman, Joseph K.; He, Hong; Zheng, Xiaolin; Majstoravich, Sonja; Korach, Kenneth S.; Dixon, D. . E-mail: dixon@niehs.nih.gov

    2005-12-15

    In a 2-year NTP bioassay, Bromoethane (BE) was found to induce endometrial neoplasms in the uterus of B6C3F1 mice [; ]. In women, hormonal influences, such as 'unopposed' estrogenic stimulus, have been implicated as important etiologic factors in uterine cancer. BE, however, does not affect the serum concentrations of sex hormones in female B6C3F1 mice [] and the mechanism of BE-induced uterine carcinogenesis still remains unclear. In the present study, we examined the estrogenic effects of BE on the uterus of ovariectomized B6C3F1 mice and on Ishikawa cells. Groups of 6 mice were given daily s.c. injections of 0, 100, 500 or 1000 mg BE/kg for 3 consecutive days. Mice treated with 17{beta}-estradiol served as positive controls. Mice were necropsied 24 h after the final injection, and uteri were weighed and examined histologically and immunohistochemically along with the vagina. Changes observed in the estrogen-treated mice included increased uterine weights, edema and inflammation of the endometrium, increased epithelial layers of the uterine and vaginal lumens and keratinization of the vaginal epithelium. In the BE-treated mice, no such changes occurred; however, immunohistochemical staining of the uterus revealed a significant increase in immunoexpression of the estrogen receptor alpha (ER{alpha}) in the two higher dose groups. Analysis of mRNA also showed slightly increased uterine ER{alpha} expression in these groups. Upregulated expression of ER{alpha} was confirmed in BE-treated Ishikawa cells, in which Western blotting analyses identified an intense signal at approximately 66 kDa, which is consistent with ER{alpha}. These data suggest that upregulated expression of ER{alpha} may be important in the induction of endometrial neoplasms in BE-treated mice.

  9. Pump and Probe Spectroscopy of CH_3F-({ortho}-H_2){n} Clusters in Solid Parahydrogen by Using Two Cw-Ir Quantum Cascade Lasers

    NASA Astrophysics Data System (ADS)

    Kawasaki, Hiroyuki; Mizoguchi, Asao; Kanamori, Hideto

    2016-06-01

    The absorption spectrum of the ν3 (C-F stretching) mode of CH_3F in solid {para}-H_2 by FTIR showed a series of equal interval peaks Their interpretation was that the {n}-th peak of this series was due to CH_3F-({ortho}-H_2){n} clusters which were formed CH_3F and {n}'s {ortho}-H_2 in first nearest neighbor sites of the {para}-H_2 crystal with {hcp} structure. In order to understand this system in more detail, we have studied these peaks, especially {n} = 0 - 3 corresponding to 1037 - 1041 wn, by using high-resolution and high-sensitive infrared quantum cascade laser (QCL) spectroscopy. Before now, we have observed photochromic phenomena of these peaks by taking an advantage of the high brightness of the laser. However, it has not been revealed what kind of mechanism is undergoing in these processes. In order to solve this problem we introduced two cw-IR QCLs for pump and prove experiment. While the pumping laser is breaching a certain peak with high power, the probing laser is monitoring the increase of other peaks by rapid scan method. The time resolution of this spectroscopy is 5 msec. The new precise kinetic information will help us to understand the molecular interaction in solid {para}-H_2. K. Yoshioka and D. T. Anderson, J. Chem. Phys. 119 (2003) 4731-4742 A. R. W. McKellar, A. Mizoguchi, and H. Kanamori, Phys. Chem. Chem. Phys. 13 (2011) 11587-11589

  10. Enhancement of the Hepatotoxicity of chloroform in B6C3F1 mice by corn oil: implications for chloroform carcinogenesis

    SciTech Connect

    Bull, R.J.; Brown, J.M.; Meierhenry, E.A.; Jorgenson, T.A.; Robinson, M.; Stober, J.A.

    1986-11-01

    A recent study of the ability of chloroform in drinking water to produce cancer reported that male Osborne-Mendel rats developed renal tumors, but that female B6C3F1 mice failed to develop hepatocellular carcinomas. The results obtained in the male Osborne-Mendel rats were comparable to those observed in an earlier study sponsored by the National Cancer Institute (NCI). On the other hand, the lack of an increased incidence of hepatocellular carcinomas in female B6C3F1 mice was in sharp contrast to previously reported results. The doses of chloroform used were comparable to that which produced an 85% incidence in the NCI study. The authors have investigated the extent to which the vehicle might be responsible for the different results in these two studies by examining the differential effects of chloroform when it was administered by gavage using corn oil versus a 2% Emulphor suspension as the vehicle. Male and female B6C3F1 mice were administered chloroform at 60, 130, and 270 mg/kg per day for 90 days. At sacrifice, body and organ weights were measured, and blood was recovered to perform the following serum chemistry measurements (in order of priority): glutamate oxalacetate transaminase (SGOT), lactate dehydrogenase (LDH), blood urea nitrogen (BUN), and triglyceride (TG) levels. The liver was sectioned for histopathological examination. These data indicate that administration of chloroform by corn oil gavage results in more marked hepatotoxic effects than observed when it is provided in an aqueous suspension. A major difference between two recent carcinogenesis bioassays of chloroform in this same mouse strain was the vehicle used.

  11. Efficient blue emission of ytterbium-doped Sr5(PO4)3F under quasi-three-level intracavity pumping

    NASA Astrophysics Data System (ADS)

    Yang, Y.; Cao, G. H.

    2012-02-01

    We report an Yb:Sr5(PO4)3F (Yb:S-FAP) laser emitting at 985 nm intracavity pumped by a 912 nm diode-pumped Nd:GdVO4 laser. A 808 nm diode laser is used to pump the Nd:GdVO4 crystal emitting at 912 nm, and the Yb:S-FAP laser emitting at 985 nm intracavity pumped at 912 nm. With incident pump power of 17.5 W, intracavity second harmonic generation has been demonstrated with a power of 131 mW at 492.5 nm by using a LBO nonlinear crystal.

  12. Lasing in a Tm:Ho:Yb3Al5O12 crystal pumped into the 3H6 - 3F4 transition

    NASA Astrophysics Data System (ADS)

    Zavartsev, Yu D.; Zagumennyi, A. I.; Kalachev, Yu L.; Kutovoi, S. A.; Mikhailov, V. A.; Shcherbakov, I. A.

    2016-03-01

    A growth technology has been developed, and a Tm:Ho:Yb3Al5O12 laser crystal of high optical quality has been grown by Czochralski method. Its spectral and luminescent characteristics are studied. Lasing at a wavelength of 2100 nm is obtained under pumping into the absorption line on the 3H6 - 3F4 transition of the Tm3+ ion at a wavelength of 1678 nm. The slope and total (optical) efficiencies of the laser at an output power of up to 320 mW reach 41% and 30%, respectively.

  13. Magnetic field, frequency and temperature dependence of complex conductance of ultrathin La1.65Sr0.45CuO4sub>/La2CuO4sub> films and the organic superconductors κ-(BEDT-TTF)2Cu[N(CN)2]Br

    SciTech Connect

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

    2015-09-01

    In this study, we used atomic-layer molecular beam epitaxy (ALL-MBE) to synthesize bilayer films of a cuprate metal (La1.65Sr0.45CuO4sub>) and a cuprate insulator (La2CuO4sub>), in which interface superconductivity occurs in a layer that is just one-half unit cell thick. We have studied the magnetic field and temperature dependence of the complex sheet conductance, σ(ω), of these films, and compared them to κκ-(BEDT-TTF)2Cu[N(CN)2]Br single crystals. The magnetic field H was applied both parallel and perpendicular to the 2D conducting layers. Experiments have been carried out at frequencies between 23 kHz and 50 MHz using either two-coil mutual inductance technique, or the LC resonators with spiral or rectangular coils. The real and the imaginary parts of the mutual-inductance M(T,ω) between the coil and the sample were measured and converted to complex conductivity. For H perpendicular to the conducting layers, we observed almost identical behavior in both films and κ-Br single crystals: (i) the transition onset in the inductive response, Lk–1(T) occurs at a temperature lower by 2 K than in Re σ(T), (ii) this shift is almost constant with magnetic field up to 8 T; (iii) the vortex diffusion constant D(T) is exponential due to pinning of vortex cores. These results can be described by the extended dynamic theory of the Berezinski–Kosterlitz–Thouless (BKT) transition and dynamics of bound vortex–antivortex pairs with short separation lengths.

  14. Fundamental Understanding of Methane-Carbon Dioxide-Water (CH4sub>-CO2-H2O) Interactions in Shale Nanopores under Reservoir Conditions. Quarterly Report.

    SciTech Connect

    Wang, Yifeng

    2015-10-27

    This project focuses on the systematic study of CH4sub>-CO2-H2O interactions in shale nanopores under high-pressure and high temperature reservoir conditions. The proposed work will help to develop new stimulation strategies to enable efficient resource recovery from fewer and less environmentally impactful wells.

  15. Longitudinally diode-pumped 1.06-{mu}m Nd{sup 3+}:NaLa(MoO{sub 4}){sub 2} laser without pump-wavelength stabilisation

    SciTech Connect

    Zharikov, Evgeny V; Lis, Denis A; Subbotin, Kirill A; Ushakov, S N; Onishchenko, A M; Romanyuk, V A; Shestakov, A V

    2006-01-31

    The spectral and lasing characteristics of a Nd{sup 3+}:NaLa(MoO{sub 4}){sub 2} crystal longitudinally diode-pumped without pump-wavelength stabilisation are studied. A variation in the output power did not exceed 30% when the pump wavelength was changed in the spectral region from 0.794 to 0.811 {mu}m. (lasers)

  16. Origin of Active Oxygen in a Ternary CuOx /Co3O4sub>–CeO 2 Catalyst for CO Oxidation

    SciTech Connect

    Liu, Zhigang; Wu, Zili; Peng, Xihong; Binder, Andrew; Chai, Songhai; Dai, Sheng

    2014-11-14

    In this paper, we have studied CO oxidation over a ternary CuOx/Co3O4sub>-CeO2 catalyst and employed the techniques of N2 adsorption/desporption, XRD, TPR, TEM, in situ DRIFTS and QMS (Quadrupole mass spectrometer) to explore the origin of active oxygen. DRIFTS-QMS results with labeled 18O2 indicate that the origin of active oxygens in CuOx/Co3O4sub>-CeO2 obeys a model, called as queue mechanism. Namely gas-phase molecular oxygens are dissociated to atomic oxygens and then incorporate in oxygen vacancies located at the interface of Co3O4sub>-CeO2 to form active crystalline oxygens, and these active oxygens diffuse to the CO-Cu+ sites thanks to the oxygen vacancy concentration magnitude and react with the activated CO to form CO2. This process, obeying a queue rule, provides active oxygens to form CO2 from gas-phase O2 via oxygen vacancies and crystalline oxygen at the interface of Co3O4sub>-CeO2.

  17. In situ determination of the spinel-post-spinel transition in Fe3O4sub> at high pressure and temperature by synchrotron X-ray diffraction

    SciTech Connect

    Schollenbruch, K; Woodland, A B; Frost, D J; Wang, Y; Sanehira, T; Langenhorst, F

    2011-08-10

    The position of the spinel-post-spinel phase transition in Fe3O4sub> has been determined in pressure-temperature space by in situ measurements using a multi-anvil press combined with white synchrotron radiation. Pressure measurement using the equation of state for MgO permitted pressure changes to be monitored at high temperature. The phase boundary was determined by the first appearance of diffraction peaks of the high-pressure polymorph (h-Fe3O4sub>) during pressure increase and the disappearance of these peaks on pressure decrease along several isotherms. We intersected the phase boundary over the temperature interval of 700-1400 ºC. The boundary is linear and nearly isobaric, with a slightly positive slope. Post-experiment investigation by TEM confirms that the reverse reaction from h-Fe 3O4sub> to magnetite during decompression leads to the formation of microtwins on the (311) plane in the newly formed magnetite. Observations made during the phase transition suggest that the transition has a pseudomartensitic character, explaining in part why magnetite persists at conditions well within the stability field of h-Fe3O4sub>, even at high temperatures. This study emphasizes the utility of studying phase transitions in situ at simultaneously high temperatures and pressures since the reaction kinetics may not be favorable at room temperature.

  18. Polyselenide chemistry of indium and thallium in dimethylformamide, acetonitrile, and water. Syntheses, structures, and properties of the new complexes [In[sub 2](Se[sub 4])[sub 4](Se[sub 5])][sup 4[minus

    SciTech Connect

    Dhingra, S.S.; Kanatzidis, M.G. )

    1993-04-14

    The reaction of InCl[sub 3] with Na[sub 2]Se[sub 5] in dimethylformamide (DMF) in the presence of Ph[sub 4]PCl gave (Ph[sub 4]P)[sub 4][In[sub 2](Se[sub 4])[sub 4](Se[sub 5])] (I) in 75% yield. Under the same conditions, InCl[sub 3] reacted with Na[sub 2]Se[sub 5] in the presence of Pr[sub 4]NBr or Et[sub 4]NBr and afforded (Pr[sub 4]N)[sub 4][In[sub 2](Se[sub 4])[sub 4](Se[sub 5])] (II) in 65% yield and (Et[sub 4]N)[sub 4][In[sub 2](Se[sub 4])[sub 4](Se[sub 5])] (III) in 72% yield, respectively. Single-crystal X-ray diffraction studies show that (I), (II), and (III) contain the same anion, [In[sub 2](Se[sub 4])[sub 4](Se[sub 5])][sup 4[minus

  19. Properties and Crystallization Phenomena in Li2Si2O5–Ca5(PO4)3F and Li2Si2O5–Sr5(PO4)3F Glass–Ceramics Via Twofold Internal Crystallization

    PubMed Central

    Rampf, Markus; Dittmer, Marc; Ritzberger, Christian; Schweiger, Marcel; Höland, Wolfram

    2015-01-01

    The combination of specific mechanical, esthetic, and chemical properties is decisive for the application of materials in prosthodontics. Controlled twofold crystallization provides a powerful tool to produce special property combinations for glass–ceramic materials. The present study outlines the potential of precipitating Ca5(PO4)3F as well as Sr5(PO4)3F as minor crystal phases in Li2Si2O5 glass–ceramics. Base glasses with different contents of CaO/SrO, P2O5, and F− were prepared within the glasses of the SiO2–Li2O–K2O–CaO/SrO–Al2O3–P2O5–F system. Preliminary studies of nucleation by means of XRD and scanning electron microscopy (SEM) of the nucleated base glasses revealed X-ray amorphous phase separation phenomena. Qualitative and quantitative crystal phase analyses after crystallization were conducted using XRD in combination with Rietveld refinement. As a main result, a direct proportional relationship between the content of apatite-forming components in the base glasses and the content of apatite in the glass–ceramics was established. The microstructures of the glass–ceramics were investigated using SEM. Microstructural and mechanical properties were found to be dominated by Li2Si2O5 crystals and quite independent of the content of the apatite present in the glass–ceramics. Biaxial strengths of up to 540 MPa were detected. Ca5(PO4)3F and Sr5(PO4)3F influence the translucency of the glass–ceramics and, hence, help to precisely tailor the properties of Li2Si2O5 glass–ceramics. The authors conclude that the twofold crystallization of Li2Si2O5–Ca5(PO4)3F or Li2Si2O5–Sr5(PO4)3F glass–ceramics involves independent solid-state reactions, which can be controlled via the chemical composition of the base glasses. The influence of the minor apatite phase on the optical properties helps to achieve new combinations of features of the glass–ceramics and, hence, displays new potential for dental applications. PMID:26389112

  20. NaLa(MoO{sub 4}){sub 2}: RE{sup 3+} (RE{sup 3+} = Eu{sup 3+}, Sm{sup 3+}, Er{sup 3+}/Yb{sup 3+}) microspheres: the synthesis and optical properties

    SciTech Connect

    Gao, Zhiyi; Wang, Zhiying; Fu, Linlin; Yang, Xingxing; Fu, Zuoling; Wu, Zhijian; Jeong, Jung Hyun

    2015-10-15

    The strong green upconversion (UC) emission were observed in various Er{sup 3+}, Yb{sup 3+} co-doped NaLa(MoO{sub 4}){sub 2} samples synthesized via a hydrothermal route. The UC intensity depends on the dopant concentration, and the optimal UC emission was obtained in NaLa(MoO{sub 4}){sub 2}: 0.02Er{sup 3+}/0.10 Yb{sup 3+}. - Highlights: • The NaLa(MoO{sub 4}){sub 2} microspheres doped with Eu{sup 3+}, Sm{sup 3+} and Er{sup 3+}/Yb{sup 3+} were synthesized by a hydrothermal method. • The effects of the EDTA in the initial solution crystal phase and morphology were studied. • The down-conversion luminescence properties of NaLa(MoO{sub 4}){sub 2}: RE{sup 3+} (RE{sup 3+} = Eu{sup 3+}, Sm{sup 3+}) were investigated. • The UC luminescence properties and mechanism of Er{sup 3+}/Yb{sup 3+} co-doped NaLa(MoO{sub 4}){sub 2} was discussed. - Abstract: NaLa(MoO{sub 4}){sub 2}: RE{sup 3+} (RE{sup 3+} = Eu{sup 3+}, Sm{sup 3+}) microspheres have been synthesized at 180 °C via a facile EDTA-mediated hydrothermal route. X-ray diffraction (XRD), field-emission scanning electron microscopy (FE-SEM), photoluminescence (PL) spectra were employed to characterize the samples. It was found that the amount of EDTA in the initial solution was responsible for crystal phase and shape determination. The effect of Eu{sup 3+} and Sm{sup 3+} doping concentrations on the luminescent intensity was also investigated in details. Furthermore, the up-conversion (UC) emissions have been observed in a series of Er{sup 3+}/Yb{sup 3+} co-doped NaLa(MoO{sub 4}){sub 2} samples. Concentration dependent studies revealed that the optimal composition was realized for a 2% Er{sup 3+} and 10% Yb{sup 3+}-doping concentration.

  1. Radiosynthesis binding affinity and biodistribution of 3-[F-18]fluoro-N-({alpha},{alpha},{alpha}-trifluoro-m-tolyl)piperazine (FTFMPP), a radioligand for the Serotonin system

    SciTech Connect

    Mishani, E.; Cristel, M.E.; McCarthy, T.J.; Welch, M.J.

    1996-05-01

    The serotonin agonist N({alpha},{alpha},{alpha}-trifluoro-m-tolyl)piperazine (TFMPP) is a potent ligand for the serotonin system. Angelini and co-workers previously synthesized the c.a [F-18]TFMPP but the low specific activity (less than 0.2GBq/mmol) limited the application of this ligand. We have recently reported the formation of phenylpiperazines by a novel alumina supported bis-alkylation. We report the application of this method and biological evaluation of 3-[F-18]FTFMPP, a fluoro derivative of TFMPP. Reaction of [F-18]fluoride with 3,5-dinitrobenzotrifluoride gave the 3-[F-18]fluoro-5-nitrobenzotrifluoride in 70% yield. Reduction of the nitro group with Raney nickel and hydrazine hydrate gave the [F-18]aniline derivative in 70% yield. Finally, the phenylpiperazine was constructed by reaction of the [F-18]aniline derivative with bis-2-bromoethyl-N-(ethoxy carbonyl)amine on basic alumina (pH=9) as a solid support. After extraction of the activity with basic MeOH and HPLC purification on normal phase the final product- [F-18]FTFMPP was obtained in 50% yield (98% radiochemical purity). The specific activity of the final product was 100GBq/mmol. The binding affinity of FTFMPP to 5-HT receptor was determined (Ki = 80-100 nM) and found to be similar to the binding affinity of the TFMPP (160-180 nM). The biodistribution of [F-18]FTFMPP was performed in rats.

  2. Bacillus subtilis subsp. subtilis CBMDC3f with antimicrobial activity against Gram-positive foodborne pathogenic bacteria: UV-MALDI-TOF MS analysis of its bioactive compounds.

    PubMed

    Torres, M J; Petroselli, G; Daz, M; Erra-Balsells, R; Audisio, M C

    2015-06-01

    In this work a new Bacillus sp. strain, isolated from honey, was characterized phylogenetically. Its antibacterial activity against three relevant foodborne pathogenic bacteria was studied; the main bioactive metabolites were analyzed using ultraviolet matrix assisted laser desorption-ionization mass spectrometry (UV-MALDI MS). Bacillus CBMDC3f was phylogenetically characterized as Bacillus subtilis subsp. subtilis after rRNA analysis of the 16S subunit and the gyrA gene (access codes Genbank JX120508 and JX120516, respectively). Its antibacterial potential was evaluated against Listeria monocytogenes (9 strains), B. cereus (3 strains) and Staphylococcus aureus ATCC29213. Its cell suspension and cell-free supernatant (CFS) exerted significant anti-Listeria and anti-S. aureus activities, while the lipopeptides fraction (LF) also showed anti-B. cereus effect. The UV-MALDI-MS analysis revealed surfactin, iturin and fengycin in the CFS, whereas surfactin predominated in the LF. The CFS from CBMDC3f contained surfactin, iturin and fengycin with four, two and four homologues per family, respectively, whereas four surfactin, one iturin and one fengycin homologues were identified in the LF. For some surfactin homologues, their UV-MALDI-TOF/TOF (MS/MS; Laser Induced Decomposition method, LID) spectra were also obtained. Mass spectrometry analysis contributed with relevant information about the type of lipopeptides that Bacillus strains can synthesize. From our results, surfactin would be the main metabolite responsible for the antibacterial effect. PMID:25820813

  3. Reevaluation and Classification of Duodenal Lesions in B6C3F1 Mice and F344 Rats from 4 Studies of Hexavalent Chromium in Drinking Water.

    PubMed

    Cullen, John M; Ward, Jerrold M; Thompson, Chad M

    2016-02-01

    Thirteen-week and 2-year drinking water studies conducted by the National Toxicology Program (NTP) reported that hexavalent chromium (Cr(VI)) induced diffuse epithelial hyperplasia in the duodenum of B6C3F1 mice but not F344 rats. In the 2-year study, Cr(VI) exposure was additionally associated with duodenal adenomas and carcinomas in mice only. Subsequent 13-week Cr(VI) studies conducted by another group demonstrated non-neoplastic duodenal lesions in B6C3F1 mice similar to those of the NTP study as well as mild duodenal hyperplasia in F344 rats. Because intestinal lesions in mice are the basis for proposed safety standards for Cr(VI), and the histopathology data are relevant to the mode of action, consistency (an important Hill criterion for causality) was assessed across the aforementioned studies. Two veterinary pathologists applied uniform diagnostic criteria to the duodenal lesions in rats and mice from the 4 repeated-dose studies. Comparable non-neoplastic intestinal lesions were evident in mice and rats from all 4 studies; however, the incidence and severity of intestinal lesions were greater in mice than rats. These findings demonstrate consistency across studies and species and highlight the importance of standardized nomenclature for intestinal pathology. The differences in the severity of non-neoplastic lesions also likely contribute to the differential tumor response.

  4. Optical transitions, absorption intensities, and intermanifold emission cross sections of Pr3+(4f2) in Ca5(PO4)3F crystal host

    NASA Astrophysics Data System (ADS)

    Sardar, Dhiraj K.; Russell, Charles C.

    2004-05-01

    A spectroscopic Judd-Ofelt investigation has been performed on Pr3+ ions doped in calcium fluorapatite, Ca5(PO4)3F, belonging to the apatite structure family. The standard Judd-Ofelt analysis was applied to the room temperature absorption intensities of Pr3+ transitions to determine the phenomenological intensity parameters: Ω2, Ω4, and Ω6. Values of the intensity parameters were subsequently used to determine the decay rates (emission probabilities), radiative lifetimes, and branching ratios of the principal intermanifold transitions of Pr3+ from the 3P2, 1D2, and 3P0 manifold states to the lower-lying manifolds. In addition, the room temperature fluorescence lifetimes and emission cross sections of the 3P2→3H5, 1D2→3H4, and 3P0→3F2 transitions were measured; these values were compared with those of Nd3+:yttritium-aluminum-garnet and Pr3+:Sr5(PO4)3 (known as S-FAP).

  5. Inhalation toxicology of isoprene in F344 rats and B6C3F1 mice following two-week exposures.

    PubMed Central

    Melnick, R L; Roycroft, J H; Chou, B J; Ragan, H A; Miller, R A

    1990-01-01

    Isoprene (2-methyl-1,3-butadiene) was selected for toxicologic evaluations because of its structural similarity to 1,3-butadiene, a potent rodent carcinogen. Two-week inhalation toxicology studies of isoprene were conducted in F344 rats and B6C3F1 mice at exposure concentrations of 0, 438, 875, 1750, 3500, or 7000 ppm. For rats, there were no chemically related changes in survival, body weight gain, clinical signs, hematologic or clinical chemistry parameters, or gross or microscopic lesions. Exposure of mice to isoprene did not produce mortalities and only caused a decrease in body weight gain for male mice in the 7000 ppm exposure group; however, hematologic changes and microscopic lesions including testicular atrophy, olfactory epithelial degeneration, and forestomach epithelial hyperplasia were observed in isoprene-exposed mice. Similar toxicologic effects have been previously observed in B6C3F1 mice exposed to 1,3-butadiene. A species difference in susceptibility between rats and mice exposed to isoprene was evident in these short-term exposure studies. Images FIGURE 1. A FIGURE 1. B FIGURE 2. A FIGURE 2. B PMID:2401278

  6. A fast gas ionization calorimeter filled with C 3F 8 for operation at high counting rates and hard radiation environment

    NASA Astrophysics Data System (ADS)

    Denisov, S.; Dushkin, A.; Fedyakin, N.; Gilitsky, Yu.; Ljudmirsky, M.; Spiridonov, A.; Sytnik, V.

    1998-12-01

    The performance of a gas ionization EM calorimeter with planar electrodes and steel absorbers has been studied with a 26.6 GeV/ c electron beam at the 70 GeV IHEP accelerator. The design of the calorimeter is optimized for the operation at high counting rates by minimizing the coupling inductance and by choosing rather fast and heavy perfluoroalkane C 3F 8 ( vdr=0.07 mm/ns at a reduced field E/ N=1.0×10 -16 V cm 2). This gas has been used for the first time in calorimetry applications. The total calorimeter thickness is ≈21 X0. The signal readout has been done by remote 25 Ω low-noise preamplifiers coupled to towers via 25 Ω cable of 3 m length. The choice of a 25 Ω input impedance provides a complete matching between preamplifier, cable and tower. The studies of the calorimeter consisted in measuring the signal and noise spectra at different values of HV, ADC gate width and gas pressure. The electron attachment rate in C 3F 8 with a stated purity of 99.99% is quite low (at a given E/ N the mean free path of electrons is λ=2.2 cm at 1 atm). The intrinsic energy resolution of the calorimeter after noise subtraction is found to be independent of the gas pressure and equal to ≈7% at E=26.6 GeV/ c.

  7. Immunotoxicological profile of chloramine in female B6C3F1 mice when administered in the drinking water for 28 days.

    PubMed

    Guo, Tai L; Germolec, Dori R; Collins, Bradley J; Luebke, Robert W; Auttachoat, Wimolnut; Smith, Matthew J; White, Kimber L

    2011-01-01

    Monochloramine has been used to provide a disinfecting residual in water distribution systems where it is difficult to maintain an adequate free-chlorine residual or where disinfection by-product formation is of concern. The goal of this study was to characterize the immunotoxic effects of chloramine in female B(6)C(3)F(1) mice when administered via the drinking water. Mice were exposed to chloramine-containing deionized tap water at 2, 10, 20, 100, or 200 ppm for 28 days. No statistically significant differences in drinking water consumption, body weight, body weight gain, organ weights, or hematological parameters between the exposed and control animals were noted during the experimental period. There were no changes in the percentages and numbers of total B-lymphocytes, T-lymphocytes, CD4(+) and CD8(+) T-lymphocytes, natural killer (NK) cells, and macrophages in the spleen. Exposure to chloramine did not affect the IgM antibody-forming cell response to sheep red blood cells (SRBC) or anti-SRBC IgM antibody production. Minimal effects, judged to be biologically insignificant, were observed in the mixed-leukocyte response and NK activity. In conclusion, chloramine produced no toxicological and immunotoxic effects in female B(6)C(3)F(1) mice when administered for 28 days in the drinking water at concentrations ranging from 2-200 ppm.

  8. Reevaluation and Classification of Duodenal Lesions in B6C3F1 Mice and F344 Rats from 4 Studies of Hexavalent Chromium in Drinking Water

    PubMed Central

    Cullen, John M.; Ward, Jerrold M.

    2015-01-01

    Thirteen-week and 2-year drinking water studies conducted by the National Toxicology Program (NTP) reported that hexavalent chromium (Cr(VI)) induced diffuse epithelial hyperplasia in the duodenum of B6C3F1 mice but not F344 rats. In the 2-year study, Cr(VI) exposure was additionally associated with duodenal adenomas and carcinomas in mice only. Subsequent 13-week Cr(VI) studies conducted by another group demonstrated non-neoplastic duodenal lesions in B6C3F1 mice similar to those of the NTP study as well as mild duodenal hyperplasia in F344 rats. Because intestinal lesions in mice are the basis for proposed safety standards for Cr(VI), and the histopathology data are relevant to the mode of action, consistency (an important Hill criterion for causality) was assessed across the aforementioned studies. Two veterinary pathologists applied uniform diagnostic criteria to the duodenal lesions in rats and mice from the 4 repeated-dose studies. Comparable non-neoplastic intestinal lesions were evident in mice and rats from all 4 studies; however, the incidence and severity of intestinal lesions were greater in mice than rats. These findings demonstrate consistency across studies and species and highlight the importance of standardized nomenclature for intestinal pathology. The differences in the severity of non-neoplastic lesions also likely contribute to the differential tumor response. PMID:26538584

  9. Urethral carcinoma and hyperplasia in male and female B6C3F1 mice treated with 3,3′,4,4′- Tetrachloroazobenzene (TCAB)

    PubMed Central

    Singh, BP; Nyska, A; Kissling, GE; Lieuallen, W; Johansson, SL; Malarkey, DE; Hooth, MJ

    2010-01-01

    B6C3F1 mice chronically exposed to 3,3′,4,4′-tetrachloroazobenzene (TCAB), a contaminant of dichloroaniline-derived herbicides, developed a number of neoplastic and nonneoplastic lesions including carcinoma of the urinary tract. Groups of 50 male and 50 female B6C3F1 mice were exposed by gavage to TCAB at dose levels of 0, 3, 10 and 30 mg/kg 5 days a week for 2 years. Control animals received corn oil:acetone (99:1) vehicle. Decreased survival of male mice in the mid-dose group and of male and female mice in the high dose groups was mainly related to the occurrence of urethral transitional cell (urothelial) carcinoma and resulting urinary obstruction. Increased urethral transitional cell carcinomas were seen in all treated male groups in a dose-related manner as well as in the females treated with 30 mg/kg TCAB. Administration of TCAB was also associated with increased transitional cell hyperplasia of the urethra. Most nonneoplastic lesions of the urogenital tract were considered secondary to local invasion and urinary obstruction by the urethral transitional cell carcinomas. The mechanism of tumor induction is uncertain but the high frequency of tumors in the proximal urethra of male mice suggests that the neoplasms result from the exposure of a susceptible population of urothelial cells to a carcinogenic metabolite of TCAB. PMID:20233943

  10. Missense Mutation of POU Domain Class 3 Transcription Factor 3 in Pou3f3L423P Mice Causes Reduced Nephron Number and Impaired Development of the Thick Ascending Limb of the Loop of Henle.

    PubMed

    Rieger, Alexandra; Kemter, Elisabeth; Kumar, Sudhir; Popper, Bastian; Aigner, Bernhard; Wolf, Eckhard; Wanke, Rüdiger; Blutke, Andreas

    2016-01-01

    During nephrogenesis, POU domain class 3 transcription factor 3 (POU3F3 aka BRN1) is critically involved in development of distinct nephron segments, including the thick ascending limb of the loop of Henle (TAL). Deficiency of POU3F3 in knock-out mice leads to underdevelopment of the TAL, lack of differentiation of TAL cells, and perinatal death due to renal failure. Pou3f3L423P mutant mice, which were established in the Munich ENU Mouse Mutagenesis Project, carry a recessive point mutation in the homeobox domain of POU3F3. Homozygous Pou3f3L423P mutants are viable and fertile. The present study used functional, as well as qualitative and quantitative morphological analyses to characterize the renal phenotype of juvenile (12 days) and aged (60 weeks) homo- and heterozygous Pou3f3L423P mutant mice and age-matched wild-type controls. In both age groups, homozygous mutants vs. control mice displayed significantly smaller kidney volumes, decreased nephron numbers and mean glomerular volumes, smaller TAL volumes, as well as lower volume densities of the TAL in the kidney. No histological or ultrastructural lesions of TAL cells or glomerular cells were observed in homozygous mutant mice. Aged homozygous mutants displayed increased serum urea concentrations and reduced specific urine gravity, but no evidence of glomerular dysfunction. These results confirm the role of POU3F3 in development and function of the TAL and provide new evidence for its involvement in regulation of the nephron number in the kidney. Therefore, Pou3f3L423P mutant mice represent a valuable research model for further analyses of POU3F3 functions, or for nephrological studies examining the role of congenital low nephron numbers. PMID:27420727

  11. Missense Mutation of POU Domain Class 3 Transcription Factor 3 in Pou3f3L423P Mice Causes Reduced Nephron Number and Impaired Development of the Thick Ascending Limb of the Loop of Henle

    PubMed Central

    Rieger, Alexandra; Kemter, Elisabeth; Kumar, Sudhir; Popper, Bastian; Aigner, Bernhard; Wolf, Eckhard; Wanke, Rüdiger; Blutke, Andreas

    2016-01-01

    During nephrogenesis, POU domain class 3 transcription factor 3 (POU3F3 aka BRN1) is critically involved in development of distinct nephron segments, including the thick ascending limb of the loop of Henle (TAL). Deficiency of POU3F3 in knock-out mice leads to underdevelopment of the TAL, lack of differentiation of TAL cells, and perinatal death due to renal failure. Pou3f3L423P mutant mice, which were established in the Munich ENU Mouse Mutagenesis Project, carry a recessive point mutation in the homeobox domain of POU3F3. Homozygous Pou3f3L423P mutants are viable and fertile. The present study used functional, as well as qualitative and quantitative morphological analyses to characterize the renal phenotype of juvenile (12 days) and aged (60 weeks) homo- and heterozygous Pou3f3L423P mutant mice and age-matched wild-type controls. In both age groups, homozygous mutants vs. control mice displayed significantly smaller kidney volumes, decreased nephron numbers and mean glomerular volumes, smaller TAL volumes, as well as lower volume densities of the TAL in the kidney. No histological or ultrastructural lesions of TAL cells or glomerular cells were observed in homozygous mutant mice. Aged homozygous mutants displayed increased serum urea concentrations and reduced specific urine gravity, but no evidence of glomerular dysfunction. These results confirm the role of POU3F3 in development and function of the TAL and provide new evidence for its involvement in regulation of the nephron number in the kidney. Therefore, Pou3f3L423P mutant mice represent a valuable research model for further analyses of POU3F3 functions, or for nephrological studies examining the role of congenital low nephron numbers. PMID:27420727

  12. A study of room-temperature LixMn1.5Ni0.5O4sub> solid solutions

    SciTech Connect

    Saravanan, Kuppan; Jarry, Angelique; Kostecki, Robert; Chen, Guoying

    2015-01-26

    Understanding the kinetic implication of solid-solution vs. biphasic reaction pathways is critical for the development of advanced intercalation electrode materials. Yet this has been a long-standing challenge in materials science due to the elusive metastable nature of solid solution phases. The present study reports the synthesis, isolation, and characterization of room-temperature LixMn1.5Ni0.5O4sub> solid solutions. In situ XRD studies performed on pristine and chemically-delithiated, micron-sized single crystals reveal the thermal behavior of LixMn1.5Ni0.5O4sub> (0 ≤ x ≤ 1) cathode material consisting of three cubic phases: LiMn1.5Ni0.5O4sub> (Phase I), Li0.5Mn1.5Ni0.5O4sub> (Phase II) and Mn1.5Ni0.5O4sub> (Phase III). A phase diagram capturing the structural changes as functions of both temperature and Li content was established. In conclusion, the work not only demonstrates the possibility of synthesizing alternative electrode materials that are metastable in nature, but also enables in-depth evaluation on the physical, electrochemical and kinetic properties of transient intermediate phases and their role in battery electrode performance.

  13. NMR relaxation study of the phase transitions and relaxation mechanisms of the alums MCr(SO{sub 4}){sub 2}.12H{sub 2}O (M=Rb and Cs) single crystals

    SciTech Connect

    Lim, Ae Ran; Paik, Younkee; Lim, Kye-Young

    2011-06-15

    The physical properties and phase transition mechanisms of MCr(SO{sub 4}){sub 2}.12H{sub 2}O (M=Rb and Cs) single crystals have been investigated. The phase transition temperatures, NMR spectra, and the spin-lattice relaxation times T{sub 1} of the {sup 87}Rb and {sup 133}Cs nuclei in the two crystals were determined using DSC and FT NMR spectroscopy. The resonance lines and relaxation times of the {sup 87}Rb and {sup 133}Cs nuclei undergo significant changes at the phase transition temperatures. The sudden changes in the splitting of the Rb and Cs resonance lines are attributed to changes in the local symmetry of their sites, and the changes in the temperature dependences of T{sub 1} are related to variations in the symmetry of the octahedra of water molecules surrounding Rb{sup +} and Cs{sup +}. We also compared these {sup 87}Rb and {sup 133}Cs NMR results with those obtained for the trivalent cations Cr and Al in MCr(SO{sub 4}){sub 2}.12H{sub 2}O and MAl(SO{sub 4}){sub 2}.12H{sub 2}O crystals. - Graphical Abstract: The physical properties and phase transition mechanisms of MCr(SO{sub 4}){sub 2}.12H{sub 2}O (M=Rb, Cs, and NH{sub 4}) single crystals have been investigated. Highlights: > The physical properties and phase transition mechanisms of MCr(SO{sub 4}){sub 2}.12H{sub 2}O (M=Rb and Cs) crystals {yields} The NMR spectra and the spin-lattice relaxation times T{sub 1} of the {sup 87}Rb and {sup 133}Cs nuclei in the two crystals {yields} The variations in the symmetry of the octahedra of water molecules surrounding Rb{sup +} and Cs{sup +}.

  14. Thermal expansion of phosphates with the NaZr{sub 2}(PO{sub 4}){sub 3} structure containing lanthanides and zirconium: R{sub 0.33}Zr{sub 2}(PO{sub 4}){sub 3} (R = Nd, Eu, Er) and Er{sub 0.33(1–x)} Zr{sub 0.25x}Zr{sub 2}(PO{sub 4}){sup 3}

    SciTech Connect

    Volgutov, V. Yu. Orlova, A. I.

    2015-09-15

    Phosphates R{sub 0.33}Zr{sub 2}(PO{sub 4}){sub 3} (R = Nd, Eu, or Er) and Er{sub 0.33(1–x)}Zr{sub 0.25}Zr{sub 2}(PO{sub 4}){sub 3} (x = 0, 0.25, 0.5, 0.75, 1.0) of the NaZr{sub 2}(PO{sub 4}){sub 3} family have been synthesized and investigated by high-temperature X-ray diffraction. The crystallochemical approach is used to obtain compounds with expected small and controllable thermal-expansion parameters. Phosphates with close-to-zero thermal-expansion parameters, including those with low thermal-expansion anisotropy, have been obtained: Nd{sub 0.33}Zr{sub 2}(PO{sub 4}){sub 3} with α{sub a} =–2.21 × 10{sup −6} °C{sup −1}, α{sub c} = 0.81 × 10{sup −6} °C{sup −1}, and Δα = 3.02 × 10{sup −6} °C{sup –1} and Er{sub 0.08}Zr{sub 0.19}Zr{sub 2}(PO{sub 4}){sub 3} with α{sub a} =–1.86 × 10{sup −6} °C{sup −1}, α{sub c} = 1.73 × 10{sup −6} °C{sup −1}, and Δα = 3.58 × 10{sup −6} °C{sup −1}.

  15. From {sub {infinity}}{sup 1}[(UO{sub 2}){sub 2}O(MoO{sub 4}){sub 4}]{sup 6-} to {sub {infinity}}{sup 1}[(UO{sub 2}){sub 2}(MoO{sub 4}){sub 3}(MoO{sub 5})]{sup 6-} infinite chains in A{sub 6}U{sub 2}Mo{sub 4}O{sub 21} (A=Na, K, Rb, Cs) compounds: Synthesis and crystal structure of Cs{sub 6}[(UO{sub 2}){sub 2}(MoO{sub 4}){sub 3}(MoO{sub 5})

    SciTech Connect

    Yagoubi, S.; Obbade, S.; Saad, S.; Abraham, F.

    2011-05-15

    A new caesium uranyl molybdate belonging to the M{sub 6}U{sub 2}Mo{sub 4}O{sub 21} family has been synthesized by solid-state reaction and its structure determined from single-crystal X-ray diffraction data. Contrary to the other alkali uranyl molybdates of this family (A=Na, K, Rb) where molybdenum atoms adopt only tetrahedral coordination and which can be formulated A{sub 6}[(UO{sub 2}){sub 2}O(MoO{sub 4}){sub 4}], the caesium compound Cs{sub 6}U{sub 2}Mo{sub 4}O{sub 21} should be written Cs{sub 6}[(UO{sub 2}){sub 2}(MoO{sub 4}){sub 3}(MoO{sub 5})] with molybdenum atoms in tetrahedral and square pyramidal environments. Cs{sub 6}[(UO{sub 2}){sub 2}(MoO{sub 4}){sub 3}(MoO{sub 5})] crystallizes in the triclinic symmetry with space group P1-bar and a=10.4275(14) A, b=15.075(2) A, c=17.806(2) A, {alpha}=70.72(1){sup o}, {beta}=80.38(1){sup o} and {gamma}=86.39(1){sup o}, V=2604.7(6) A{sup 3}, Z=4, {rho}{sub mes}=5.02(2) g/cm{sup 3} and {rho}{sub cal}=5.08(3) g/cm{sup 3}. A full-matrix least-squares refinement on the basis of F{sup 2} yielded R{sub 1}=0.0464 and wR{sub 2}=0.0950 for 596 parameters with 6964 independent reflections with I{>=}2{sigma}(I) collected on a BRUKER AXS diffractometer with Mo(K{alpha}) radiation and a CCD detector. The crystal structure of Cs compound is characterized by {sub {infinity}}{sup 1}[(UO{sub 2}){sub 2}(MoO{sub 4}){sub 3}(MoO{sub 5})]{sup 6-} parallels chains built from U{sub 2}O{sub 13} dimeric units, MoO{sub 4} tetrahedra and MoO{sub 5} square pyramids, whereas, Na, K and Rb compounds are characterized by {sub {infinity}}{sup 1}[(UO{sub 2}){sub 2}O(MoO{sub 4}){sub 4}]{sup 6-} parallel chains formulated simply of U{sub 2}O{sub 13} units and MoO{sub 4} tetrahedra. Infrared spectroscopy measurements using powdered samples synthesized by solid-state reaction, confirm the structural results. The thermal stability and the electrical conductivity are also studied. The four compounds decompose at low temperature (between 540 and 610 {sup o

  16. Dual Phase Li4sub>Ti5O12–TiO2 Nanowire Arrays As Integrated Anodes For High-rate Lithium-ion Batteries

    SciTech Connect

    Liao, Jin; Chabot, Victor; Gu, Meng; Wang, Chong M.; Xiao, Xingcheng; Chen, Zhongwei

    2014-08-19

    Lithium titanate (Li4sub>Ti5O12) is well known as a zero strain material inherently, which provides excellent long cycle stability as a negative electrode for lithium ion batteries. However, the low specific capacity (175 mA h g-1) limits it to power batteries although the low electrical conductivity is another intrinsic issue need to be solved. In this work, we developed a facile hydrothermal and ion-exchange route to synthesize the self-supported dual-phase Li4sub>Ti5O12–TiO2 nanowire arrays to further improve its capacity as well as rate capability. The ratio of Li4sub>Ti5O12 to TiO2 in the dual phase Li4sub>Ti5O12–TiO2 nanowire is around 2:1. The introduction of TiO2 into Li4sub>Ti5O12 increases the specific capacity. More importantly, by interface design, it creates a dual-phase nanostructure with high grain boundary density that facilitates both electron and Li ion transport. Compared with phase-pure nanowire Li4sub>Ti5O12 and TiO2 nanaowire arrays, the dual-phase nanowire electrode yielded superior rate capability (135.5 at 5 C, 129.4 at 10 C, 120.2 at 20 C and 115.5 mA h g-1 at 30 C). In-situ transmission electron microscope clearly shows the near zero deformation of the dual phase structure, which explains its excellent cycle stability.

  17. Selective Metal Exsolution in BaFe2-yMy(PO4sub>)2 (M = Co2+, Ni2+) Solid Solutions

    SciTech Connect

    Alcover, Ignacio Blazquez; Daviero-Minaud, Sylvie; David, Rénald; Filimonov, Dmitry; Huvé, Marielle; Attfield, J. Paul; Kabbour, Houria; Mentré, Olivier

    2015-08-19

    The 2D-Ising ferromagnetic phase BaFe2+2(PO4sub>)2 shows exsolution of up to one-third of its iron content (giving BaFe3+1.33(PO4sub>)2) under mild oxidation conditions, leading to nanosized Fe2O3 exsolved clusters. Here we have prepared BaFe2–yMy(PO4sub>)2 (M = Co2+, Ni2+; y = 0, 0.5, 1, 1.5) solid solutions to investigate the feasibility and selectivity of metal exsolution in these mixed metallic systems. For all the compounds, after 600 °C thermal treatment in air, a complete oxidation of Fe2+ to Fe3+ leaves stable M2+ ions, as verified by 57Fe Mössbauer spectroscopy, TGA, TEM, microprobe, and XANES. Furthermore, the size of the nanometric α-Fe2O3clusters coating the main phase strongly depends on the yM metal concentration. For M-rich phases the iron diffusion is hampered so that a significant fraction of superparamagnetic α-Fe2O3 particles (100% for BaFe0.5–xCo1.5(PO4sub>)2) was detected even at 78 K. Although Ni2+and Co2+ ions tend to block Fe diffusion, the crystal structure of BaFe0.67Co1(PO4sub>)2demonstrates a fully ordered rearrangement of Fe3+ and Co2+ ions after Fe exsolution. We found that the magnetic behaviors of the Fe-depleted materials are mostly dominated by antiferromagnetic exchange, while Co2+-rich compounds show metamagnetic transitions reminiscent of the BaCo2(PO4sub>)2 soft helicoidal magnet.

  18. Near-infrared-to-near-infrared down-shifting and upconversion luminescence of KY3F10 with single dopant of Nd3+ ion

    NASA Astrophysics Data System (ADS)

    Lin, Huihong; Yu, Ting; Tsang, Ming-Kiu; Bai, Gongxun; Zhang, Qinyuan; Hao, Jianhua

    2016-01-01

    We have studied the structural and near-infrared (NIR) luminescent properties of KY3F10 phosphors, singly doped with Nd3+ serving as both sensitizer and activator. With a single laser diode at the wavelength of 808 nm as a pump source, simultaneous NIR-to-NIR upconversion (UC) and down-shifting (DS) emissions are effectively achieved, due to the specific energy levels of Nd3+ dopant and the low phonon energy of the host. The luminescence mechanism related to energy transfer is discussed. The luminescence can be modulated through controlling the population of Nd3+:4F3/2 state in our experiment. Interestingly, both UC and DS emissions of the material fall within the dual biological window, suggesting that the prepared phosphors have potential applications in the bioimaging field.

  19. Enhanced NIR downconversion luminescence by precipitating nano Ca5(PO4)3F crystals in Eu2+-Yb3+ co-doped glass.

    PubMed

    Li, Chen; Song, Zhiguo; Li, Yongjin; Lou, Kai; Qiu, Jianbei; Yang, Zhengwen; Yin, Zhaoyi; Wang, Xue; Wang, Qi; Wan, Ronghua

    2013-10-01

    Eu(2+)-Yb(3+) co-doped transparent glass-ceramic containing nano-Ca5(PO4)3F (FAP) was prepared in reducing atmosphere. XRD and TEM analysis indicated that nano-FAP about 40 nm precipitated homogeneously in glass matrix after heat treatment. Confirmed by spectroscopy measurements, the crystal-like absorption and emission of Eu(2+) indicated the partition of Eu(2+) into FAP nanocrystals in glass ceramic. NIR emission due to the transition (2)F5/2→(2)F7/2 of Yb(3+) ions (about 980-1100 nm) was observed from glasses under ultraviolet excitation, ascribed to downconversion from Eu(2+) to Yb(3+), which can be enhanced by precipitating nano-FAP crystals. The results indicated that Eu(2+)-Yb(3+) co-doped glass-ceramic embedding with nano-FAP is a promising candidate as downconversion materials for enhancing conversion efficiency of solar cells.

  20. Frequency stabilization of an Er-doped fiber laser with a collinear 2f-to-3f self-referencing interferometer

    SciTech Connect

    Hitachi, K. Ishizawa, A.; Mashiko, H.; Sogawa, T.; Gotoh, H.; Tadanaga, O.; Nishikawa, T.

    2015-06-08

    We report the stabilization of the carrier-envelope offset (CEO) frequency of an Er-doped fiber laser with a collinear 2f-to-3f self-referencing interferometer. The interferometer is implemented by a dual-pitch periodically poled lithium niobate ridge waveguide with two different quasi-phase matching pitch sizes. We obtain a 52-dB signal-to-noise ratio in the 100-kHz resolution bandwidth of a heterodyne beat signal, which is sufficient for frequency stabilization. We also demonstrate that the collinear geometry is robust against environmental perturbation by comparing in-loop and out-of-loop Allan deviations when the in-loop CEO frequency is stabilized with a phase-locked loop circuit.

  1. Generation of high power 200 mW laser radiation at 177.3 nm in KBe2BO3F2 crystal

    NASA Astrophysics Data System (ADS)

    Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Chen, Chuangtian; Zhang, Xin; Lin, Shujie

    2015-12-01

    With a newly developed diffusion-bonded KBe2BO3F2 prism-coupled device and by temperature stabilization of the device, we have achieved an average power of 200 mW at 177.3 nm through the sixth harmonic generation of a picosecond Nd:YAG laser. This is the highest power at 177.3 nm ever generated in any nonlinear optical crystals. A stable average power of 72.2 mW at 177.3 nm was also obtained with a small fluctuation of 3.2 % over a period of 30 min. Moreover, both the angle and temperature acceptances for the 177.3 nm generation were reported for the first time in this paper.

  2. Energy transfer and downconversion near-infrared material of Tb3+ and Yb3+ doped Ca5(BO3)3F

    NASA Astrophysics Data System (ADS)

    Hou, Dejian; Li, Jin-Yan; Lin, Huihong; Zhang, Jingxiang

    2016-11-01

    Yb3+ and Tb3+ singly doped and Tb3+-Yb3+ co-doped Ca5(BO3)3F phosphors were prepared by a solid state reaction method. The luminescence emission and excitation spectra as well as the luminescence decay curves were investigated. The emission bands of Yb3+ ion are located around 1000 nm, matching well with the optimal response of Si-based solar cells. Tb3+ can be a sensitizer for Yb3+ in the host. The energy transfer from Tb3+ to Yb3+ was investigated, the energy transfer mechanism was proposed as cooperative energy transfer. Tb3+ concentration dependent quantum efficiency was calculated and the maximum efficiency approached 115.5%.

  3. Effect of pH in the photoluminescence of a ruthenium complex featuring a derivative of the ligand pyrazine[2,3-f][1,10]-phenanthroline.

    PubMed

    Pizarro, Sebastián; Gallardo, Miguel; Leyton, Constanza; Castro, Eileen; Gajardo, Francisco; Delgadillo, Alvaro

    2015-07-01

    A new ruthenium complex, [Ru(bpy)2(dbe-ppl)](PF6)2 (bpy=2,2'-bipyridine and dbe-ppl=dimethyl 4,4'-(pyrazino[2,3-f][1,10]phenanthroline-2,3-diyl)dibenzoate, has been synthesized and characterized by (1)H NMR spectroscopy, UV-Vis, IR, and cyclic voltammetry. Irradiation on the MLCT band results in photoluminescence in both protic and aprotic solvents. The photoluminescence in water is pH dependent, it shows a behavior which can be described by the Henderson-Hasselbalch assuming the protonation/deprotonation of the excited state with a pKa of 2.40±0.01.

  4. Effect of pH in the photoluminescence of a ruthenium complex featuring a derivative of the ligand pyrazine[2,3-f][1,10]-phenanthroline

    NASA Astrophysics Data System (ADS)

    Pizarro, Sebastián; Gallardo, Miguel; Leyton, Constanza; Castro, Eileen; Gajardo, Francisco; Delgadillo, Alvaro

    2015-07-01

    A new ruthenium complex, [Ru(bpy)2(dbe-ppl)](PF6)2 (bpy = 2,2‧-bipyridine and dbe-ppl = dimethyl 4,4‧-(pyrazino[2,3-f][1,10]phenanthroline-2,3-diyl)dibenzoate, has been synthesized and characterized by 1H NMR spectroscopy, UV-Vis, IR, and cyclic voltammetry. Irradiation on the MLCT band results in photoluminescence in both protic and aprotic solvents. The photoluminescence in water is pH dependent, it shows a behavior which can be described by the Henderson-Hasselbalch assuming the protonation/deprotonation of the excited state with a pKa of 2.40 ± 0.01.

  5. Benzene metabolite levels in blood and bone marrow of B6C3F{sub 1} mice after low-level exposure

    SciTech Connect

    Bechtold, W.E.; Strunk, M.R.; Thornton-Manning, J.R.

    1995-12-01

    Studies at the Inhalation Toxicology Research Institute (ITRI) have explored the species-specific uptake and metabolism of benzene. Results have shown that metabolism is dependent on both dose and route of administration. Of particular interest were shifts in the major metabolic pathways as a function of exposure concentration. In these studies, B6C3F{sub 1} mice were exposed to increasing levels of benzene by either gavage or inhalation. As benzene internal dose increased, the relative amounts of muconic acid and hydroquinone decreased. In contrast, the relative amount of catechol increased with increasing exposure. These results show that the relative levels of toxic metabolites are a function of exposure level. Based on these results and assuming a linear relationship between exposure concentration and levels of bone marrow metabolites, it would be difficult to detect an elevation of any phenolic metabolites above background after occupational exposures to the OSHA Permissible Exposure Limit of 1 ppm benzene.

  6. Off-resonance photoemission dynamics studied by recoil frame F1s and C1s photoelectron angular distributions of CH{sub 3}F

    SciTech Connect

    Stener, M. Decleva, P.; Mizuno, T.; Yagishita, A.; Yoshida, H.

    2014-01-28

    F1s and C1s photoelectron angular distributions are considered for CH{sub 3}F, a molecule which does not support any shape resonance. In spite of the absence of features in the photoionization cross section profile, the recoil frame photoelectron angular distributions (RFPADs) exhibits dramatic changes depending on both the photoelectron energy and polarization geometry. Time-dependent density functional theory calculations are also given to rationalize the photoionization dynamics. The RFPADs have been compared with the theoretical calculations, in order to assess the accuracy of the theoretical method and rationalize the experimental findings. The effect of finite acceptance angles for both ionic fragments and photoelectrons has been included in the calculations, as well as the effect of rotational averaging around the fragmentation axis. Excellent agreement between theory and experiment is obtained, confirming the good quality of the calculated dynamical quantities (dipole moments and phase shifts)

  7. Reddish Orange Long-Lasting Phosphorescence in KY3F10:Sm3+ for X-Ray or Cathode Ray Tubes

    NASA Astrophysics Data System (ADS)

    Zhang, Jin-Su; Zhong, Hai-Yang; Sun, Jia-Shi; Cheng, Li-Hong; Li, Xiang-Ping; Chen, Bao-Jiu

    2012-01-01

    We report a reddish orange long-lasting phosphor of KY3F10:Sm3+ synthesized by a solid-state reaction for applications in x-ray or cathode-ray tubes. The spectrum contains a group of reddish orange emission lines originating from 4G5/2 → 6HJ transitions of Sm3+. The Judd—Ofelt theory is introduced to analyze the optical transitions of the Sm3+ ions. Moreover, phosphorescence characteristics are discussed. The energy charging and release processes of the phosphor are measured and the phosphorescence decay time with 10% of initial intensity is about 40.7 seconds. The order of kinetics and the activation energy are obtained according to the thermoluminescence curve. The phosphorescence mechanism is proposed based on structural analysis and thermoluminescence glow curve measurement.

  8. Subcutaneous microchip-associated tumours in B6C3F1 mice: a retrospective study to attempt to determine their histogenesis.

    PubMed

    Le Calvez, Sophie; Perron-Lepage, Marie-France; Burnett, Roger

    2006-03-01

    Fifty-two subcutaneous tumours associated with microchip were collected from three carcinogenicity B6C3F1 mice studies. Two of these 52 tumours were adenocarcinoma of the mammary gland located on the dorsal region forming around the chip. All the other 50 were mesenchymal in origin and were difficult to classify on morphological grounds with haematoxylin-eosin. These sarcomas were investigated using a panel of immunohistochemistry and special stains consisting of desmin, smooth muscle actin (SMA), myogenin, S100, mouse macrophages, phosphotungstic acid haematoxylin (PTAH) and Masson's trichrome (MT). All the sarcomas displayed the same histochemical characteristics and a close immunophenotype, characterized by desmin +/-, SMA+, myogenin--, S100--, mouse macrophages + and PTAH-. These tumours thus appear to have similar histologic-type lineage and designation as sarcomas not otherwise specified (NOS) with a large myofibroblastic component appears today to be more appropriate and it is likely to clarify them in the future with the emergence of new markers.

  9. Toxicology studies of a chemical mixture of 25 groundwater contaminants. III. Male reproduction study in B6C3F1 mice

    SciTech Connect

    Chapin, R.E.; Phelps, J.L.; Schwetz, B.A.; Yang, R.S. )

    1989-10-01

    A mixture of chemicals has been developed that models contaminated groundwater around hazardous waste sites. We investigated the effects of this mixture on spermatogenesis in B6C3F1 mice. The animals consumed three different concentrations of this mixture for 90 days, after which time they were euthanatized. Although there was a concentration-related decrease in the amount of fluid consumed at the higher two concentrations, there were no differences in body weight among the groups. Similarly, there was no effect of mixture consumption upon the histology of liver, kidney, testis, epididymis, or seminal vesicles or upon the absolute organ weights of these organs. Kidney weight relative to body weight was increased in the high dose group. Epididymal sperm number and testicular spermatid count were not affected by treatment. These studies show that, at exposure levels that decrease fluid intake and increase adjusted kidney weight, there were no effects of this mixture on gametogenesis in male mice.

  10. First results from the Goddard High-Resolution Spectrograph - Spectroscopic determination of stellar parameters of Melnick 42, an O3f star in the Large Magellanic Cloud

    NASA Technical Reports Server (NTRS)

    Heap, S. R.; Altner, B.; Ebbets, D.; Hubeny, I.; Hutchings, J. B.

    1991-01-01

    GHRS and optical (ESO 3.6 m) observations of the O3f star Melnick 42 in the 30 Doradus complex are reported. A first analysis reveals that with a luminosity of 2.3 million L(solar) and a present mass of 100 M(solar), Melnick 42 is one of the most luminous and massive stars known. An estimate of abundances indicates that iron and oxygen are very likely reduced by a factor of four relative to the sun, whereas carbon is more strongly depleted and nitrogen is approximately solar. The terminal velocity of the stellar wind is 3000 km/s. The mass-loss rate is 4 x 10 to the -6th M(solar)/yr, with a large uncertainty. The excellent quality GHRS spectrum taken in a crowded region of the LMC demonstrates the superiority of the HST for quantitative ultraviolet spectroscopy of hot stars in other galaxies.

  11. Theoretical temperature-dependent branching ratios and laser thresholds of the 3F4 to 3H6 levels of Tm(3+) in ten garnets

    NASA Technical Reports Server (NTRS)

    Filer, Elizabeth D.; Barnes, Norman P.; Morrison, Clyde A.

    1991-01-01

    The calculated energy levels, the branching ratios, and the estimated thresholds for thulium operating on the 3F4 to 3H6 transitions are reported. Garnet materials with the general formula A3B2C3O12 are evaluated. Calculations are performed for the A side under the assumption of D2 symmetry. X-ray data available in the literature are used to evaluate the crystal-field components, A sub nm. Even-n components are employed to calculate the crystal-field splittings within the manifold. Thermal occupation factors are determined in a straightforward manner using a Boltzmann distribution for the respective manifolds. Odd-n components are applied to calculate the transition probabilities for electric field transitions. It is determined that the magnetic dipole contributions to the transition probability are comparable to the electric dipole contributions in some cases. Thresholds as a function of the density of thulium atoms are calculated.

  12. [H{sub 3}N(CH{sub 2}){sub 4}NH{sub 3}]{sub 2}[Al{sub 4}(C{sub 2}O{sub 4})(H{sub 2}PO{sub 4}){sub 2}(PO{sub 4}){sub 4}].4[H{sub 2}O]: A new layered aluminum phosphate-oxalate

    SciTech Connect

    Peng Li; Li Jiyang; Yu Jihong . E-mail: jihong@mail.jlu.edu.cn; Li Guanghua; Fang Qianrong; Xu Ruren . E-mail: rrxu@mail.jlu.edu.cn

    2005-09-15

    A new layered inorganic-organic hybrid aluminum phosphate-oxalate [H{sub 3}N(CH{sub 2}){sub 4}NH{sub 3}]{sub 2}[Al{sub 4}(C{sub 2}O{sub 4})(H{sub 2}PO{sub 4}){sub 2}(PO{sub 4}){sub 4}].4[H{sub 2}O](AlPO-CJ25) has been synthesized hydrothermally, by using 1,4-diaminobutane (DAB) as structure-directing agent. The structure has been solved by single-crystal X-ray diffraction analysis and further characterized by IR, {sup 31}P MAS NMR, TG-DTA as well as compositional analyses. Crystal data: the triclinic space group P-1, a=8.0484(7) A, b=8.8608(8) A, c=13.2224(11) A, {alpha}=80.830(6) deg. , {beta}=74.965(5) deg. , {gamma}=78.782(6) deg. , Z=2, R {sub 1[} {sub I} {sub >2} {sub {sigma}} {sub (} {sub I} {sub )]}=0.0511 and wR {sub 2(alldata)}=0.1423. The alternation of AlO{sub 4} tetrahedra and PO{sub 4} tetrahedra gives rise to the four-membered corner-sharing chains, which are interconnected through AlO{sub 6} octahedra to form the layered structure with 4,6-net sheet. Interestingly, oxalate ions are bis-bidentately bonded by participating in the coordination of AlO{sub 6}, and bridging the adjacent AlO{sub 6} octahedra. The layers are held with each other through strong H-bondings between the terminal oxygens. The organic ammonium cations and water molecules are located in the large cavities between the interlayer regions. -- Graphical abstract: The alternation of AlO{sub 4} tetrahedra and PO{sub 4} tetrahedra gives rise to the four-membered corner-sharing chains, which are interconnected through AlO{sub 6} octahedra to form the layered structure with 4,6-net sheet. Oxalate ions are bis-bidentately boned by participating in the coordination of AlO{sub 6}, and bridging the adjacent AlO{sub 6} octahedra.

  13. alpha2-Adrenoceptor stimulation promotes actin polymerization and focal adhesion in 3T3F442A and BFC-1beta preadipocytes.

    PubMed

    Bétuing, S; Daviaud, D; Valet, P; Bouloumié, A; Lafontan, M; Saulnier-Blache, J S

    1996-12-01

    We previously demonstrated that in white fat cell precursors alpha2-adrenoceptor stimulation lead to the phosphorylation of p44 and p42 mitogen-activated protein kinases and an increase in cell number. Regulation of cell adhesion and cell cytoskeleton plays a crucial role in the control of cell growth by various growth factors. Here, we report that in mouse 3T3F442A preadipocytes expressing 2500 fmol/mg protein of the human alpha2C10-adrenoceptor (alpha2AF2 cells), alpha2-adrenergic stimulation rapidly restored the spreading of cells previously retracted by serum withdrawal. This effect was pertussis toxin sensitive and was blocked by pretreatment of the cells with dihydrocytochalasin B (a blocker of actin polymerization), genistein (a tyrosine kinase inhibitor), or agents that increase cell cAMP content. Spreading was accompanied by cell membrane ruffling, formation of lamelipodia and filipodia, appearance of focal adhesion plaques, and induction of actin stress fibers. alpha2-Adrenergic stimulation also lead to a rapid Gi- and actin-dependent tyrosine phosphorylation of the pp125 focal adhesion kinase (FAK) as well as of the p42 and p44 mitogen-activated protein kinases. alpha2-Adrenergic-dependent spreading and FAK and mitogen-activated protein kinase phosphorylation were also observed in 3T3F442A preadipocytes permanently expressing 20 fmol/mg protein of the human alpha2C10-adrenoceptor (alpha2AF3 cells) as well as in BFC-1beta preadipocytes, which constitutively express 25 fmol/mg protein of mouse alpha2A-adrenoceptors. In BFC-1beta preadipocytes, alpha2-adrenergic-dependent spreading and pp125FAK phosphorylation were counteracted by beta-adrenergic stimulation. Our results suggest that alpha2-adrenergic control of actin polymerization and focal adhesion assembly could play a crucial role in the regulation of preadipocyte growth by the sympathetic nervous system.

  14. Fumonisin b1 carcinogenicity in a two-year feeding study using F344 rats and B6C3F1 mice.

    PubMed Central

    Howard, P C; Eppley, R M; Stack, M E; Warbritton, A; Voss, K A; Lorentzen, R J; Kovach, R M; Bucci, T J

    2001-01-01

    Fumonisin B1 (FB1) is a mycotoxin isolated from Fusarium fungi that contaminate crops worldwide. A previous study demonstrated that FB1 promoted preneoplastic foci in initiated rats and induced hepatocellular carcinomas in BD IX rats at 50 parts per million (ppm), but fundamental dose-response data were not available to assist in setting regulatory guidelines for this mycotoxin. To provide this information, female and male F344/N/Nctr BR rats and B6C3F1 Nctr BR mice were fed for two years a powdered NIH-31 diet containing the following concentrations of FB1: female rats, 0, 5, 15, 50, and 100 ppm; male rats, 0, 5, 15, 50, and 150 ppm; female mice, 0, 5, 15, 50, and 80 ppm; male mice, 0, 5, 15, 80, and 150 ppm. FB1 was not tumorigenic in female F344 rats with doses as high as 100 ppm. Including FB1 in the diets of male rats induced renal tubule adenomas and carcinomas in 0/48, 0/40, 9/48, and 15/48 rats at 0, 5, 15, 50, and 150 ppm, respectively. Including up to 150 ppm FB1 in the diet of male mice did not affect tumor incidence. Hepatocellular adenomas and carcinomas were induced by FB1 in the female mice, occurring in 5/47, 3/48, 1/48, 19/47, and 39/45 female mice that consumed diets containing 0, 5, 15, 50, and 80 ppm FB1, respectively. This study demonstrates that FB1 is a rodent carcinogen that induces renal tubule tumors in male F344 rats and hepatic tumors in female B6C3F1 mice. PMID:11359696

  15. Alteration of Electrostatic Surface Potential Enhances Affinity and Tumor Killing Properties of Anti-ganglioside GD2 Monoclonal Antibody hu3F8.

    PubMed

    Zhao, Qi; Ahmed, Mahiuddin; Guo, Hong-fen; Cheung, Irene Y; Cheung, Nai-Kong V

    2015-05-22

    Ganglioside GD2 is highly expressed on neuroectodermal tumors and an attractive therapeutic target for antibodies that have already shown some clinical efficacy. To further improve the current antibodies, which have modest affinity, we sought to improve affinity by using a combined method of random mutagenesis and in silico assisted design to affinity-mature the anti-GD2 monoclonal antibody hu3F8. Using yeast display, mutants in the Fv with enhanced binding over the parental clone were FACS-sorted and cloned. In silico modeling identified the minimal key interacting residues involved in the important charged interactions with the sialic acid groups of GD2. Two mutations, D32H (L-CDR1) and E1K (L-FR1) altered the electrostatic surface potential of the antigen binding site, allowing for an increase in positive charge to enhance the interaction with the negatively charged GD2-pentasaccharide headgroup. Purified scFv and IgG mutant forms were then tested for antigen specificity by ELISA, for tissue specificity by immunohistochemistry, for affinity by BIACORE, for antibody-dependent cell-mediated cytotoxicity (ADCC) and complement-mediated cytotoxicity in vitro, and for anti-tumor efficacy in xenografted humanized mice. The nearly 7-fold improvement in affinity of hu3F8 with a single D32H (L-CDR1) mutation translated into a ∼12-fold improvement in NK92MI-transfected CD16-mediated ADCC, a 6-fold improvement in CD32-mediated ADCC, and a 2.5-fold improvement in complement-mediated cytotoxicity while maintaining restricted normal tissue cross-reactivity and achieving substantial improvement in tumor ablation in vivo. Despite increasing GD2 affinity, the double mutation D32H (L-CDR1) and E1K (L-FR1) did not further improve anti-tumor efficacy.

  16. Calculated and TLD-based absorbed dose estimates for I-131-labeled 3F8 monoclonal antibody in a human neuroblastoma xenograft nude mouse model.

    PubMed

    Ugur, O; Scott, A M; Kostakoglu, L; Hui, T E; Masterson, M E; Febo, R; Sgouros, G; Rosa, E; Mehta, B M; Fisher, D R

    1995-01-01

    Preclinical evaluation of the therapeutic potential of radiolabeled antibodies is commonly performed in a xenografted nude mouse model. To assess therapeutic efficacy it is important to estimate the absorbed dose to the tumor and normal tissues of the nude mouse. The current study was designed to accurately measure radiation does to human neuroblastoma xenografts and normal organs in nude mice treated with I-131-labeled 3F8 monoclonal antibody (MoAb) against disialoganglioside GD2 antigen. Absorbed dose estimates were obtained using two different approaches: (1) measurement with teflon-imbedded CaSO4:Dy mini-thermoluminescent dosimeters (TLDs) and (2) calculations using mouse S-factors. The calculated total dose to tumor one week after i.v. injection of the 50 microCi I-131-3F8 MoAb was 604 cGy. The corresponding decay corrected and not corrected TLD measurements were 109 +/- 9 and 48.7 +/- 3.4 cGy respectively. The calculated to TLD-derived dose ratios for tumor ranged from 6.1 at 24 h to 5.5 at 1 week. The light output fading rate was found to depend upon the tissue type within which the TLDs were implanted. The decay rate in tumor, muscle, subcutaneous tissue and in vitro, were 9.5, 5.0, 3.7 and 0.67% per day, respectively. We have demonstrated that the type of tissue in which the TLD was implanted strongly influenced the in vivo decay of light output. Even with decay correction, a significant discrepancy was observed between MIRD-based calculated and CaSO4:Dy mini-TLD measured absorbed doses. Batch dependence, pH of the tumor or other variables associated with TLDs which are not as yet well known may account for this discrepancy.

  17. Oral toxicity study of tragacanth gum in B6C3F1 mice: development of squamous-cell hyperplasia in the forestomach and its reversibility.

    PubMed

    Hagiwara, A; Tanaka, H; Tiwawech, D; Shirai, T; Ito, N

    1991-10-01

    Tragacanth gum was administered at dietary levels of 0 (control), 0.625, 1.25, 2.5, and 5.0% to groups of 10 male and 10 female B6C3F1 mice for 13 wk. There were no treatment-associated effects regarding clinical signs, body or organ weights, and urinalysis or hematology data. Significant dose-related, but slight, elevations of plasma gamma-glutamyl transpeptidase (GGT) level were observed in all treated animals except the 0.625% females. Single or small numbers of tiny nodules were observed on the luminal surface of the forestomach in 4 males of the 5.0% group, 2 males of the 2.5% group, and 1 male each from the 1.25 and 0.625% groups. Histopathologically, they were diagnosed as squamous-cell hyperplasia. To investigate the nature of these gross lesions, tragacanth gum was fed to groups of 30 male mice at the dietary level of 5.0% for periods of up to 48 wk; 20 males served as controls. There were no treatment-related increases of plasma GGT levels at wk 24 and 48. Although squamous-cell hyperplasias were seen in 2 out of 10 mice at wk 24, none of these proliferative lesions were apparent at wk 48, after either chronic exposure or 24 wk on basal diet. Furthermore, the levels of DNA synthesis in forestomach epithelium as measured by 5-bromo-2-deoxyuridine (BrdU) immunohistochemistry were comparable to control values at wk 24 and 48. Thus, the oral toxicity of tragacanth gum to B6C3F1 mice was concluded to be negligible.

  18. Alteration of Electrostatic Surface Potential Enhances Affinity and Tumor Killing Properties of Anti-ganglioside GD2 Monoclonal Antibody hu3F8.

    PubMed

    Zhao, Qi; Ahmed, Mahiuddin; Guo, Hong-fen; Cheung, Irene Y; Cheung, Nai-Kong V

    2015-05-22

    Ganglioside GD2 is highly expressed on neuroectodermal tumors and an attractive therapeutic target for antibodies that have already shown some clinical efficacy. To further improve the current antibodies, which have modest affinity, we sought to improve affinity by using a combined method of random mutagenesis and in silico assisted design to affinity-mature the anti-GD2 monoclonal antibody hu3F8. Using yeast display, mutants in the Fv with enhanced binding over the parental clone were FACS-sorted and cloned. In silico modeling identified the minimal key interacting residues involved in the important charged interactions with the sialic acid groups of GD2. Two mutations, D32H (L-CDR1) and E1K (L-FR1) altered the electrostatic surface potential of the antigen binding site, allowing for an increase in positive charge to enhance the interaction with the negatively charged GD2-pentasaccharide headgroup. Purified scFv and IgG mutant forms were then tested for antigen specificity by ELISA, for tissue specificity by immunohistochemistry, for affinity by BIACORE, for antibody-dependent cell-mediated cytotoxicity (ADCC) and complement-mediated cytotoxicity in vitro, and for anti-tumor efficacy in xenografted humanized mice. The nearly 7-fold improvement in affinity of hu3F8 with a single D32H (L-CDR1) mutation translated into a ∼12-fold improvement in NK92MI-transfected CD16-mediated ADCC, a 6-fold improvement in CD32-mediated ADCC, and a 2.5-fold improvement in complement-mediated cytotoxicity while maintaining restricted normal tissue cross-reactivity and achieving substantial improvement in tumor ablation in vivo. Despite increasing GD2 affinity, the double mutation D32H (L-CDR1) and E1K (L-FR1) did not further improve anti-tumor efficacy. PMID:25851904

  19. Serological and virological survey of hepatitis E virus in wild boar populations in northwestern Italy: detection of HEV subtypes 3e and 3f.

    PubMed

    Caruso, Claudio; Modesto, P; Bertolini, S; Peletto, S; Acutis, P L; Dondo, A; Robetto, S; Mignone, W; Orusa, R; Ru, G; Masoero, L

    2015-01-01

    Although rare in developed countries, most acquired human cases of hepatitis E virus (HEV) infection are associated with travel to developing countries where HEV is endemic. Increasingly, however, sporadic, non-travel-related HEV cases have been reported in developed countries. In Italy, only two studies to date have investigated the presence of HEV in wild boars. Here, we report a serological and virological survey of HEV in wild boar populations in northwestern Italy. During the hunting season, 594 serum and 320 liver samples were collected and screened for antibodies to HEV and HEV RNA. Overall, the seroprevalence was 4.9 %, and HEV RNA was detected in 12 liver samples (p = 3.7 %). No serum samples tested positive for HEV RNA. Phylogenetic analysis of the ORF2 region revealed that the isolates clustered within genotype 3, subtypes 3e and 3f, and were closely related to HEV strains previously detected in domestic pigs farmed in the same geographic area. Although the routes of viral transmission are still poorly understood, our data show that HEV genotypes 3e and 3f circulate in wild boars in northwestern Italy. Also, they provide evidence that autochthonous HEV infections in Italy could also be linked to wild boar populations, suggesting an increased risk for domestically acquired HEV infection in humans through wild animals. The HEV sequences determined in this study may be useful for comparing present and future human isolates to identify transmission events between wild boar, humans, and farmed pigs. Similarly to other more commonly known zoonotic agents, HEV should be included in national or regional disease surveillance programs for wild animals.

  20. Serological and virological survey of hepatitis E virus in wild boar populations in northwestern Italy: detection of HEV subtypes 3e and 3f.

    PubMed

    Caruso, Claudio; Modesto, P; Bertolini, S; Peletto, S; Acutis, P L; Dondo, A; Robetto, S; Mignone, W; Orusa, R; Ru, G; Masoero, L

    2015-01-01

    Although rare in developed countries, most acquired human cases of hepatitis E virus (HEV) infection are associated with travel to developing countries where HEV is endemic. Increasingly, however, sporadic, non-travel-related HEV cases have been reported in developed countries. In Italy, only two studies to date have investigated the presence of HEV in wild boars. Here, we report a serological and virological survey of HEV in wild boar populations in northwestern Italy. During the hunting season, 594 serum and 320 liver samples were collected and screened for antibodies to HEV and HEV RNA. Overall, the seroprevalence was 4.9 %, and HEV RNA was detected in 12 liver samples (p = 3.7 %). No serum samples tested positive for HEV RNA. Phylogenetic analysis of the ORF2 region revealed that the isolates clustered within genotype 3, subtypes 3e and 3f, and were closely related to HEV strains previously detected in domestic pigs farmed in the same geographic area. Although the routes of viral transmission are still poorly understood, our data show that HEV genotypes 3e and 3f circulate in wild boars in northwestern Italy. Also, they provide evidence that autochthonous HEV infections in Italy could also be linked to wild boar populations, suggesting an increased risk for domestically acquired HEV infection in humans through wild animals. The HEV sequences determined in this study may be useful for comparing present and future human isolates to identify transmission events between wild boar, humans, and farmed pigs. Similarly to other more commonly known zoonotic agents, HEV should be included in national or regional disease surveillance programs for wild animals. PMID:25283611

  1. Alteration of Electrostatic Surface Potential Enhances Affinity and Tumor Killing Properties of Anti-ganglioside GD2 Monoclonal Antibody hu3F8*

    PubMed Central

    Zhao, Qi; Ahmed, Mahiuddin; Guo, Hong-fen; Cheung, Irene Y.; Cheung, Nai-Kong V.

    2015-01-01

    Ganglioside GD2 is highly expressed on neuroectodermal tumors and an attractive therapeutic target for antibodies that have already shown some clinical efficacy. To further improve the current antibodies, which have modest affinity, we sought to improve affinity by using a combined method of random mutagenesis and in silico assisted design to affinity-mature the anti-GD2 monoclonal antibody hu3F8. Using yeast display, mutants in the Fv with enhanced binding over the parental clone were FACS-sorted and cloned. In silico modeling identified the minimal key interacting residues involved in the important charged interactions with the sialic acid groups of GD2. Two mutations, D32H (L-CDR1) and E1K (L-FR1) altered the electrostatic surface potential of the antigen binding site, allowing for an increase in positive charge to enhance the interaction with the negatively charged GD2-pentasaccharide headgroup. Purified scFv and IgG mutant forms were then tested for antigen specificity by ELISA, for tissue specificity by immunohistochemistry, for affinity by BIACORE, for antibody-dependent cell-mediated cytotoxicity (ADCC) and complement-mediated cytotoxicity in vitro, and for anti-tumor efficacy in xenografted humanized mice. The nearly 7-fold improvement in affinity of hu3F8 with a single D32H (L-CDR1) mutation translated into a ∼12-fold improvement in NK92MI-transfected CD16-mediated ADCC, a 6-fold improvement in CD32-mediated ADCC, and a 2.5-fold improvement in complement-mediated cytotoxicity while maintaining restricted normal tissue cross-reactivity and achieving substantial improvement in tumor ablation in vivo. Despite increasing GD2 affinity, the double mutation D32H (L-CDR1) and E1K (L-FR1) did not further improve anti-tumor efficacy. PMID:25851904

  2. Global Gene Profiling of Spontaneous Hepatocellular Carcinoma in B6C3F1 Mice: Similarities in the Molecular Landscape with Human Liver Cancer

    PubMed Central

    Hoenerhoff, Mark J.; Pandiri, Arun R.; Lahousse, Stephanie A.; Hong, Hu-Hua; Ton, Tai-Vu; Masinde, Tiwanda; Auerbach, Scott S.; Gerrish, Kevin; Bushel, Pierre R.; Shockley, Keith R.; Peddada, Shyamal D.; Sills, Robert C.

    2016-01-01

    Hepatocellular carcinoma (HCC) is an important cause of morbidity and mortality worldwide. Although the risk factors of human HCC are well known, the molecular pathogenesis of this disease is complex, and in general, treatment options remain poor. The use of rodent models to study human cancer has been extensively pursued, both through genetically engineered rodents and rodent models used in carcinogenicity and toxicology studies. In particular, the B6C3F1 mouse used in the National Toxicology Program (NTP) two-year bioassay has been used to evaluate the carcinogenic effects of environmental and occupational chemicals, and other compounds. The high incidence of spontaneous HCC in the B6C3F1 mouse has challenged its use as a model for chemically induced HCC in terms of relevance to the human disease. Using global gene expression profiling, we identify the dysregulation of several mediators similarly altered in human HCC, including re-expression of fetal oncogenes, upregulation of protooncogenes, downregulation of tumor suppressor genes, and abnormal expression of cell cycle mediators, growth factors, apoptosis regulators, and angiogenesis and extracellular matrix remodeling factors. Although major differences in etiology and pathogenesis remain between human and mouse HCC, there are important similarities in global gene expression and molecular pathways dysregulated in mouse and human HCC. These data provide further support for the use of this model in hazard identification of compounds with potential human carcinogenicity risk, and may help in better understanding the mechanisms of tumorigenesis resulting from chemical exposure in the NTP two-year carcinogenicity bioassay. PMID:21571946

  3. Growth of the (In{sub 2}S{sub 3}){sub x}(FeIn{sub 2}S{sub 4}){sub 1-x} single crystals and properties of photoelectric structures on their basis

    SciTech Connect

    Bodnar, I. V.; Rud, V. Yu.; Rud, Yu. V.; Terukov, E. I.

    2010-01-15

    Complete mutual solubility in the (In{sub 2}S{sub 3}){sub x}(FeIn{sub 2}S{sub 4}){sub 1-x} system is established. The technology is developed, and single crystals of the continuous series of the (In{sub 2}S{sub 3}){sub x}(FeIn{sub 2}S{sub 4}){sub 1-x} solid solutions are grown for the first time. The linear dependence of the unit cell parameter of single crystals with a cubic spinel lattice on the solid solution composition is found. First, photosensitive Schottky barriers are fabricated, and then, based on studies of their photosensitivity, the character of band-to-band transition is discussed and the values of the band gap depending on the atomic composition are estimated. The possibility of using the obtained solid solutions as broadband photoconverters of optical radiation is revealed.

  4. Crystal structure of the binary complex of cobalt and zinc chlorides with carbamide [Co(OCN{sub 2}H{sub 4}){sub 5}(H{sub 2}O)][ZnCl{sub 4}

    SciTech Connect

    Furmanova, N. G. Chernaya, T. S.; Resnyanskii, V. F. Sulaimankulov, K. S.

    2010-03-15

    Mixed single crystals of [Co(OCN{sub 2}H{sub 4}){sub 5}(H{sub 2}O)][ZnCl{sub 4}] were grown by the isothermal evaporation of an aqueous solution. The crystal structure of this complex was established by X-ray diffraction (R = 0.052 based on 7003 reflections). The crystals consist of [Co(OCN{sub 2}H{sub 4}){sub 5}(H{sub 2}O)]{sup 2+} cations containing Co atoms in an octahedral coordination and [ZnCl{sub 4}]{sup 2-}] anions containing Zn atoms in a tetrahedral coordination. The carbamide molecules are involved in both intramolecular and interionic hydrogen bonds. The H{sub 2}O molecule forms hydrogen bonds with the anions.

  5. Neutron-scattering evidence for a periodically modulated superconducting phase in the underdoped cuprate La1.905Ba0.095CuO4sub>

    SciTech Connect

    Xu, Zhijun; Stock, C.; Chi, Songxue; Kolesnikov, A. I.; Xu, Guangyong I.; Gu, Genda; Tranquada, J. M.

    2014-10-01

    The role of antiferromagnetic spin correlations in high-temperature superconductors remains a matter of debate. We present inelastic neutron-scattering evidence that gapless spin fluctuations coexist with superconductivity in La1.905Ba0.095CuO4sub>. Furthermore, we observe that both the low-energy magnetic spectral weight and the spin incommensurability are enhanced with the onset of superconducting correlations. We propose that the coexistence occurs through intertwining of spatial modulations of the pair wave function and the antiferromagnetic correlations. This proposal is also directly relevant to sufficiently underdoped La2-xSrxCuO4sub> and YBa2Cu3O6+x.

  6. Synthesis of Ag{sub 9}(SiO{sub 4}){sub 2}NO{sub 3} through a reactive flux method and its visible-light photocatalytic performances

    SciTech Connect

    Zhu, Xianglin; Wang, Zeyan E-mail: bbhuang@sdu.edu.cn; Huang, Baibiao E-mail: bbhuang@sdu.edu.cn; Zhang, Xiaoyang; Qin, Xiaoyan; Wei, Wei; Dai, Ying

    2015-10-01

    Ag{sub 9}(SiO{sub 4}){sub 2}NO{sub 3} was prepared by a reactive flux method. The structures, morphologies, and light absorption properties were investigated. Owing to the polar crystal structure, an internal electric field can be formed inside the material, which can facilitate the photogenerated charge separation during the photocatalytic process. Based on both the wide light absorption spectra and high charge separation efficiency originated from the polarized internal electric field, Ag{sub 9}(SiO{sub 4}){sub 2}NO{sub 3} exhibit higher efficiency over Ag{sub 3}PO{sub 4} during the degradation of organic dyes under visible light irradiation, which is expected to be a potential material for solar energy harvest and conversion.

  7. Strain-relaxation and critical thickness of epitaxial La1.85Sr0.15CuO4sub> films

    SciTech Connect

    Meyer, Tricia L; Jiang, Lu; Park, Sungkyun; Egami, Takeshi; Lee, Ho Nyung

    2015-12-08

    We report the thickness-dependent strain-relaxation behavior and the associated impacts upon the superconductivity in epitaxial La1.85Sr0.15CuO4sub> films grown on different substrates, which provide a range of strain. We have found that the critical thickness for the onset of superconductivity in La1.85Sr0.15CuO4sub> films is associated with the finite thickness effect and epitaxial strain. In particular, thin films with tensile strain greater than ~0.25% revealed no superconductivity. We attribute this phenomenon to the inherent formation of oxygen vacancies that can be minimized via strain relaxation.

  8. Synthesis, spectroscopy, and structural characterization of six-coordinate bis(aryldiazenido)rhenium and bis(diarylhydrazido)rhenium complexes. X-ray structures of (Et{sub 4}N)[Re(NNPh){sub 2}(O{sub 2}C{sub 6}H{sub 4}){sub 2}], (Et{sub 4}N)[Re(NNPh{sub 2}){sub 2}(O{sub 2}C{sub 6}H{sub 4}){sub 2}], and Na[Re(NNPh){sub 2}(O{sub 2}C{sub 6}H{sub 4}){sub 2}]{center_dot}CH{sub 3}CN

    SciTech Connect

    Kettler, P.B.; Chang, Yuan-Da; Zubieta, J.

    1994-12-07

    The reactions of the cis-dioxorhenium(VII)-catecholate complex [(CH{sub 3}CH{sub 2}){sub 4}N][ReO{sub 2}(O{sub 2}C{sub 6}H{sub 4}){sub 2}] (1) with either monosubstituted organohydrazines (C{sub 6}H{sub 5}NHNH{sub 2}; 4-BrC{sub 6}H{sub 4}NHNH{sub 2}) or 1,1 disubstituted organohydrazines (Ph{sub 2-}NNH{sub 2}) yield the cis-bis(diazenido) core complexes [(CH{sub 3}CH{sub 2}){sub 4}N][Re(NNR){sub 2}(O{sub 2}C{sub 6}H{sub 4}){sub 2}] (5, R = C{sub 6}H{sub 5}; 6, R = 4-BrC{sub 6}H{sub 4}) and the cis-bis(hydrazido) core species [(CH{sub 3}CH{sub 2}){sub 4}N][Re(NNPh{sub 2}){sub 2}(O{sub 2}C36H{sub 4}){sub 2}(O{sub 2}C36H{sub 4}){sub 2}] (7). Elution of 5 in a 3:1 mixture of toluene/methanol on a column of silica gel resulted in cation exchange to give Na[Re(NNPh){sub 2}-(O{sub 2}C{sub 6}H{sub 4}){sub 2}]{center_dot}CH{sub 3}CN (8) as a one-dimensional polymer ([Na(CH{sub 3}CN)]{sup +}[Re(NNPh){sub 2}(O{sub 2}C{sub 6}H{sub 4}){sub 2}]{sup {minus}}){sub 2}. Crystal data for C{sub 32}H{sub 38}N{sub 5}O{sub 4}Re (5): P2{sub 1}/c,a = 14.458(3) {angstrom}, b = 10.436(2) {angstrom}, c = 21.767(4) {angstrom}, {beta} = 107.04(3){degrees}, V = 3140(2) {angstrom}{sup 3}, Z = 4, D {sub calc} = 1.572 g cm{sup {minus}3}; structure solution and refinement based on 3256 reflections with I{sub o} {ge} 3{sigma}(I{sub o}) converged at R = 0.053. Crystal data for C{sub 44}H{sub 48}N{sub 5}O{sub 4}Re (7): P1, a = 11.660(2) {angstrom}, b = 11.864(2) {angstrom}, c = 15.400(2) {angstrom}, {alpha} = 107.12(3){degrees}, {beta} = 94.99(3){degrees}, {gamma} = 97.61(3){degrees}, V = 2000(1) {angstrom}{sup 3}, Z = 2, D{sub calc} = 1.490 g cm{sup {minus}3}; 3702 reflections, R = 0.0534. Crystal data for C{sub 26}H{sub 18}N{sub 5}NaO{sub 4}Re (8): P2/n, a = 5.785(1) {angstrom}, b = 9.670(2) {angstrom}, c = 23.142(5) {angstrom}. {beta} = 90.91(30)degrees, V = 1294.4(7) {angstrom}{sup 3}, Z = 2, D{sub calc} = 1.737 g cm{sup {minus}3}; 1517 reflections, R = 0.049.

  9. Structure electronic and ionic conductivity study versus Ca content in Ca{sub 10-x}Sr{sub x}(PO{sub 4}){sub 6}F{sub 2} apatites

    SciTech Connect

    Sghir, B.; Hlil, E.K.; Laghzizil, A.; Boujrhal, F.Z.; Cherkaoui El Moursli, R.; Fruchart, D.

    2009-07-01

    Substitution effect on the crystallographic structure in Ca{sub 10-x}Sr{sub x}(PO{sub 4}){sub 6}F{sub 2} solid solution are studied by X-ray diffraction patterns and Rietveld refinements. Full potential electronic structure calculations based on LCAO (linear combination atomic orbital) are also performed using the obtained crystallographic parameters. DOS modification and the charge transfer are estimated versus the calcium content. According to the complex impedance method, ionic conductivity changes are explained.

  10. Temperature dependence of the luminescence of calcium-magnesium phosphate Ca{sub 3}Mg{sub 3}(PO{sub 4}){sub 4}:Eu{sup 2+}, a blue-emitting material for white light-emitting diodes

    SciTech Connect

    Zhang, Xinmin; Pan, Qi; Kim, Sun Il; Yu, Young Moon; Seo, Hyo Jin

    2014-03-01

    Graphical abstract: - Highlights: • Emission spectrum at 20 K confirms that Eu{sup 2+} ions occupy three sites. • Decay curves of three types of Eu{sup 2+} reflect the characteristics of energy transfer. • The Eu(I) emission is thermally quenched at 323 K. • Ca{sub 3}Mg{sub 3}(PO{sub 4}){sub 4}:Eu{sup 2+} has good thermal stability. • Ca{sub 3}Mg{sub 3}(PO{sub 4}){sub 4}:Eu{sup 2+} is a promising phosphor for near UV excited white LEDs. - Abstract: A blue-emitting phosphor Ca{sub 3}Mg{sub 3}(PO{sub 4}){sub 4}:Eu{sup 2+} peaking at 450 nm was synthesized by a solid state reaction. The XRD patterns, luminescence properties, decay curves of samples as well as their thermal quenching and comparing the luminescence properties with that of commercial material were investigated. At 20 K, the emission spectrum exhibiting two distinct bands peaking at 437 and 473 nm with a shoulder peak at 510 nm can be attributed to the overlap of Eu(I), Eu(II) and Eu(III) emission bands. At 423 K the PL intensity decreases to 80% of the value at room temperature, and the emission wavelength shifts toward high energy. The derived activation energy indicates that the lowest energy level of the Eu{sup 2+} 4f{sup 6}5d{sup 1} state is well isolated from the host lattice conduction band. The PL spectra and chromaticity coordinates are close to those of BAM. Ca{sub 3}Mg{sub 3}(PO{sub 4}){sub 4}:Eu{sup 2+} could be a potential candidate for near-UV excited white LEDs.

  11. Synthetic and spectroscopic studies of vanadate glaserites II: Photoluminescence studies of Ln:K{sub 3}Y(VO{sub 4}){sub 2} (Ln=Eu, Er, Sm, Ho, or Tm)

    SciTech Connect

    Kimani, Martin M. McMillen, Colin D. Kolis, Joseph W.

    2015-03-15

    Glaserite-type potassium yttrium double vanadates (K{sub 3}Y(VO{sub 4}){sub 2}) doped with Eu{sup 3+}, Er{sup 3+}, Sm{sup 3+}, Ho{sup 3+}, or Tm{sup 3+} have been synthesized by solid state reactions at 1000 °C for 48 h and their photoluminescence properties investigated. Efficient energy transfer from the vanadate group to the rare earth ion has been established by photoluminescence investigation. Ultraviolet excitation into the metal to ligand charge transfer band of the vanadate groups results in orange-red, blue and green emissions from Eu{sup 3+} (592 nm), Sm{sup 3+} (602 nm), Tm{sup 3+} (475 nm), Er{sup 3+} (553 nm), and Ho{sup 3+} (541–551 nm) dopant ions. The emission intensities of the lanthanide-doped K{sub 3}Y(VO{sub 4}){sub 2} powders were studied as a function of dopant ion concentrations. Over the concentration ranges studied, no emission quenching was observed for Eu{sup 3+} or Ho{sup 3+} dopants, while Er{sup 3+}, Sm{sup 3+} and Tm{sup 3+} dopants did exhibit such effects for dopant ion concentrations greater than 5%, probably due to cross relaxation processes. - Graphical abstract: Synthesis and photoluminescence in vanadate glaserites. - Highlights: • K{sub 3}Y(VO{sub 4}){sub 2} doped with Eu, Er, Tm, Sm, or Ho were synthesized via solid-state reactions. • Photoluminescence properties are investigated. • The lanthanide doped K{sub 3}Y(VO{sub 4}){sub 2} compounds revealed efficient energy transfer from the vanadate group to the rare earth ions. • The presented compounds are promising materials for light display systems, lasers, and optoelectronic devices.

  12. Spectral--luminescent characteristics and stimulated emission of the ND/sup 3 +/ ion in GD/sub 2en-dashx/Nd/sub x/(WO/sub 4/)/sub 3/ crystals

    SciTech Connect

    Berenberg, V.A.; Ivanov, A.O.; Krutova, L.I.; Mochalov, I.V.; Terpugov, V.S.

    1984-09-01

    Highly concentrated Gd/sub 2en-dashx/Nd/sub x/(WO/sub 4/)/sub 3/ crystals of high optical quality with x> or =0.5 were synthesized. The Stark diagram of energy levels of the neodymium ion was constructed in these crystals, and lasing was obtained. Conclusions are drawn regarding the possibility of using crystals in microlaser systems with pulsed pumping.

  13. A limited role for carbonic anhydrase in C4sub> photosynthesis as revealed by a ca1ca2 double mutant in maize.

    SciTech Connect

    Studer, Anthony J.; Gandin, Anthony; Kolbe, Allison R.; Wang, Lin; Cousins, Asaph B.; Brutnell, Thomas P.

    2014-04-04

    Carbonic anhydrase (CA) catalyzes the first biochemical step of the carbon concentrating mechanism of C4sub> plants, and in C4sub> monocots, it has been suggested that CA activity is near limiting for photosynthesis. Here, we test this hypothesis through the characterization of transposon induced mutant alleles of Ca1 and Ca2 in Zea mays. In addition, these two isoforms account for more than 85% of the CA transcript pool. A significant change in isotopic discrimination is observed in mutant plants, which have as little as 3% of wild-type CA activity, but surprisingly, photosynthesis is not reduced under current or elevated pCO2. However, growth and rates of photosynthesis under sub-ambient pCO2 are significantly impaired in the mutants. These findings suggest, that while CA is not limiting for C4sub> photosynthesis in Z. mays at current pCO2, it likely maintains high rates of photosynthesis when CO2 availability is reduced. Current atmospheric CO2 levels now exceed 400 ppm (~40.53 Pa) and contrast the low CO2 partial pressure (pCO2) conditions under which C4sub> plants expanded their range ~10 million years ago when the global atmospheric CO2 was below 300 ppm (~30.40 Pa). Thus, as CO2 levels continue to rise, selective pressures for high levels of CA may be limited to arid climates where stomatal closure reduces CO2 availability to the leaf.

  14. Hydrothermal synthesis, structure, and characterization of a mixed-valent iron(II/III) phosphate, NaFe{sub 3.67}(PO{sub 4}){sub 3}: A new variation of the alluaudite structure type

    SciTech Connect

    Korzenski, M.B.; Schimek, G.L.; Kolis, J.W.; Long, G.J.

    1998-08-01

    A mixed-valent Fe(II/III) phosphate, NaFe{sub 3.67}(PO{sub 4}){sub 3}, has been synthesized by high-temperature/high-pressure hydrothermal methods and characterized by single-crystal X-ray diffraction, EDAX, magnetic susceptibility, Moessbauer, infrared, and diffuse reflectance spectroscopies, DTA, and bond valence sum calculations. The compound crystallizes in the monoclinic space group C2/c (No. 15) with a = 11.881(4) {angstrom}, b = 12.564(3) {angstrom}, c = 6.522(2) {angstrom}, {beta} = 115.09(2){degree}, V = 881.7(5) {angstrom}{sup 3}, and Z = 4 with R/R{sub w} = 0.029/0.033. It exhibits a three-dimensional channel-like structure with an open framework that is similar to the naturally occurring iron-containing mineral alluaudite, NaFe{sub 3}(PO{sub 4}){sub 3}. In alluaudite there are two distinct channels, one which contains the sodium cations and the second which remains empty. In the title phase, this second channel is partially occupied by a square-planar iron atom. The Moessbauer spectral parameters are consistent with the structure and indicate that the fully occupied iron sites are octahedral Fe(II) and the square-planar iron is Fe(III). Structural comparisons to a number of phosphates and arsenates that also possess the alluaudite-type structure, including NaCu{sub 4}(AsO{sub 4}){sub 3} and NaMn{sub 4}(AsO{sub 4}){sub 3} are discussed.

  15. Structural properties of mixed (NH{sub 4}){sub 2−x}Rb{sub x}ZnCl{sub 4} (x=0, 1, and 2) crystals studied by {sup 1}H and {sup 87}Rb nuclear magnetic resonance

    SciTech Connect

    Lim, Ae Ran; Lim, Kye-Young

    2013-04-15

    The structures of mixed (NH{sub 4}){sub 2−x}Rb{sub x}ZnCl{sub 4} (x=0, 1, and 2) single crystals were determined by x-ray diffraction. In addition, the nuclear magnetic resonance (NMR) spectra and spin–lattice relaxation times of the {sup 1}H and {sup 87}Rb nuclei in the three crystals were determined using NMR spectroscopy. We analyzed the crystallographic structures of these crystals by considering the occupation probabilities (NH{sub 4} or Rb) of the two cationic sites. Our NMR results confirm that there are two crystallographically inequivalent NH{sub 4} sites, NH{sub 4}(1) and NH{sub 4}(2), in (NH{sub 4}){sub 2}ZnCl{sub 4}, and two crystallographically inequivalent Rb sites, Rb(1) and Rb(2), in Rb{sub 2}ZnCl{sub 4}. However, only one NH{sub 4} site and two Rb sites were observed in NH{sub 4}RbZnCl{sub 4}. The NH{sub 4} and Rb occupation rates of each of the two available sites, A{sub 1} and A{sub 2}, were determined from the NMR signals. - Graphical abstract: The structures of mixed (NH{sub 4}){sub 2−x}Rb{sub x}ZnCl{sub 4} (x=0, 1, and 2) single crystals were determined by x-ray diffraction. In addition, the nuclear magnetic resonance (NMR) spectra and spin–lattice relaxation times of the {sup 1}H and {sup 87}Rb nuclei in the three crystals were determined using NMR spectroscopy. Highlights: ► Mixed (NH{sub 4}){sub 2−x}Rb{sub x}ZnCl{sub 4} (x=0, 1, and 2) crystals. ► The crystallographic structures by occupation probabilities. ► The NH{sub 4} and Rb occupation rates.

  16. Electrical and physical characterization of the Al{sub 2}O{sub 3}/p-GaSb interface for 1%, 5%, 10%, and 22% (NH{sub 4}){sub 2}S surface treatments

    SciTech Connect

    Peralagu, Uthayasankaran Thayne, Iain G.; Povey, Ian M.; Carolan, Patrick; Lin, Jun; Hurley, Paul K.; Contreras-Guerrero, Rocio; Droopad, Ravi

    2014-10-20

    In this work, the impact of ammonium sulfide ((NH{sub 4}){sub 2}S) surface treatment on the electrical passivation of the Al{sub 2}O{sub 3}/p-GaSb interface is studied for varying sulfide concentrations. Prior to atomic layer deposition of Al{sub 2}O{sub 3}, GaSb surfaces were treated in 1%, 5%, 10%, and 22% (NH{sub 4}){sub 2}S solutions for 10 min at 295 K. The smallest stretch-out and flatband voltage shifts coupled with the largest capacitance swing, as indicated by capacitance-voltage (CV) measurements, were obtained for the 1% treatment. The resulting interface defect trap density (D{sub it}) distribution showed a minimum value of 4 × 10{sup 12 }cm{sup −2}eV{sup −1} at E{sub v} + 0.27 eV. Transmission electron microscopy and atomic force microscopy examination revealed the formation of interfacial layers and increased roughness at the Al{sub 2}O{sub 3}/p-GaSb interface of samples treated with 10% and 22% (NH{sub 4}){sub 2}S. In combination, these effects degrade the interface quality as reflected in the CV characteristics.

  17. Consequences of Optimal Bond Valence on Structural Rigidity and Improved Luminescence Properties in SrxBa2-xSiO4sub>:Eu2+ Orthosilicate Phosphors

    SciTech Connect

    Denault, Kristin A.; Brgoch, Jakoah; Gaultois, Michael W.; Mikhailovsky, Alexander; Petry, Ralf; Winkler, Holger; DenBaars, Steven P.; Seshadri, Ram

    2014-08-19

    The orthosilicate phosphors SrxBa2–xSiO4sub>:Eu2+ have now been known for over four decades and have found extensive recent use in solid-state white lighting. It is well-recognized in the literature and in practice that intermediate compositions in the solid-solutions between the orthosilicates Sr2SiO4sub> and Ba2SiO4sub> yield the best phosphor hosts when the thermal stability of luminescence is considered. We employ a combination of synchrotron X-ray diffraction, total scattering measurements, density functional theory calculations, and low-temperature heat capacity measurements, in conjunction with detailed temperature- and time-resolved studies of luminescence properties to understand the origins of the improved luminescence properties. We observe that in the intermediate compositions, the two cation sites in the crystal structure are optimally bonded as determined from bond valence sum calculations. Optimal bonding results in a more rigid lattice, as established by the intermediate compositions possessing the highest Debye temperature, which are determined experimentally from low-temperature heat capacity measurements. Greater rigidity in turn results in the highest luminescence efficiency for intermediate compositions at elevated temperatures.

  18. Investigation of the structure and properties of K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O single crystals

    SciTech Connect

    Makarova, I. P. Chernaya, T. S.; Grebenev, V. V.; Dolbinina, V. V.; Verin, I. A.; Simonov, A. A.

    2011-11-15

    The features of the conductivity of K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O single-crystal samples in the temperature range of superprotonic phase transition have been investigated. The K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O crystal structure is determined and refined taking into account hydrogen atoms by X-ray diffraction analysis at a temperature of 295 K: monoclinic symmetry, sp. gr. P2{sub 1}/c, Z = 4, a = 7.059(1), b = 19.773(1), c = 23.449(1) Angstrom-Sign , {beta} = 95.33(1) Degree-Sign , R{sub 1}/wR{sub 2} = 2.71/1.71. The structural data obtained suggest that the occurrence of high conductivity in K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O crystals with an increase in temperature is related to the diffusion of crystallization water and motion of K ions, as well as to the transformation of the system of hydrogen bonds and protonic motion. The stabilization of the high-temperature superprotonic phase and its supercooling to low temperatures are due to the presence of channels for the motion of K ions and slow backward diffusion of water in the crystal.

  19. Temperature-induced changes in the single-crystal structure of K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O

    SciTech Connect

    Makarova, I. P. Grebenev, V. V.; Chernaya, T. S.; Verin, I. A.; Dolbinina, V. V.; Chernyshov, D. Yu.; Koval'chuk, M. V.

    2013-05-15

    Interest in superprotonic crystals of M{sub m}H{sub n}(XO{sub 4}){sub (m+n)/2} is associated with the solution to the fundamental problem of modern condensed matter physics: investigations of structural phase transitions and the stabilization of phases with high proton conductivity with the aim of designing new functional materials. The available data suggest that changes in the physical properties in these crystals can occur through different structural mechanisms. To reveal the structural conditionality for anomalies in the physical properties, the crystals of K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O were studied by X-ray diffraction in the temperature range of 25-463 K, and the crystal structure of the high-temperature phase was determined at 418 K (sp. gr. Pcan). The results of the study indicate that the occurrence of high conductivity in K{sub 9}H{sub 7}(SO{sub 4}){sub 8} {center_dot} H{sub 2}O crystals at high temperatures is associated with the diffusion of water of crystallization, the hydrogen-bond network rearrangement, and the motion of K ions. The hydrogen-bond rearrangement and the hindered back diffusion of water to the crystal stabilize the high-temperature phase and ensure its supercooling to low temperatures.

  20. Influence of Ga-concentration on the electrical and magnetic properties of magnetoelectric CoGaxFe2–xO4sub>/BaTiO3 composite

    SciTech Connect

    Ni, Yan; Zhang, Zhen; Nlebedim, Cajetan I.; Jiles, David C.

    2015-03-20

    Multiferroic materials exhibit magnetoelectric (ME) coupling and promise new device applications including magnetic sensors, generators, and filters. An effective method for developing ME materials with enhanced ME effect is achieved by the coupling through the interfacial strain between piezoelectric and magnetostrictive materials. In this study, the electrical and magnetic properties of Ga doped magnetoelectric CoGaxFe2–xO4sub>/BaTiO3 composite are studied systematically. It is found that Ga doping improves the sensitivity of magnetoelastic response and stabilizes the magnetic phase of the composites. More importantly, Ga doping reduces the electrical conductivity of composite, as well as the dielectric loss. An enhancement of the electrostrain with doping Ga is also observed. Quantitative estimation indicates that magnetoelectric coupling is enhanced for Ga-doped CoGaxFe2–xO4sub>/BaTiO3 composites. As a result, the present work is beneficial to the practical application of composite CoFe2O4sub>/BaTiO3-based multiferroic materials.

  1. Engineering of mixed pairing and non-Abelian Majorana states in chiral p-wave superconductor Sr2RuO4sub> and other materials

    SciTech Connect

    Liu, Ying

    2015-11-30

    This project deals with odd-parity superconductor Sr2RuO4sub> and related material systems, aiming at understanding the unconventional nature of superconductivity in this material. An odd-parity superconductor is expected to feature a novel topological object, the half-flux-quantum vortex that hosts a Majorana anyons. Majorana anyons carry non-Abelian statistics that can be used are the building block for constructing a fault-tolerated topological quantum computer. Half-flux-quantum vortices form in an odd-parity superconductor because of the availability of charge neutral spin supercurrent in addition to the normal supercurrent. Half-height magnetization steps were found in a cantilever magnetometry measurement of doubly connected mesoscopic samples of Sr2RuO4sub> in the presence of an in-plane magnetic field (J. Jang, D. G. Ferguson, V. Vakaryuk, R. Budakian, S. B. Chung, P. M. Goldbart, and Y. Maeno, Science 331, 186 (2011)), which suggests the presence of a half-flux-quantum (Φ0/2 = h/4e) state. Evidence for half flux quantum states, which can be viewed as coreless half vortices, was obtained in mesoscopic samples of Sr2RuO4sub> in the torque magnetomitry measurements. However, the existence of such an important property has not been confirmed by any other independent measurement.

  2. NTP Technical Report on the Toxicology and Carcinogenesis Studies of Chloral Hydrate (Cas No. 302-17-0) in B6C3F1 mice (Gavage Studies).

    PubMed

    2002-02-01

    Chloral hydrate is used medically as a sedative or hypnotic and as a rubefacient in topical preparations, and it is often given to children as a sedative during dental and other medical procedures. Chloral hydrate is used as a central nervous system depressant and sedative in veterinary medicine and as a general anesthetic in cattle and horses. It is a byproduct of the chlorination of water and has been detected in plant effluent after the bleaching of softwood pulp. Chloral, the anhydrous form of chloral hydrate, is used as a synthetic intermediate in the production of insecticides and herbicides. Chloral hydrate was nominated for study by the Food and Drug Administration based upon widespread human exposure and its potential hepatotoxicity and the toxicity of related chemicals. One goal of the study was to assess the effect of the animal’s age and the duration of dosing on the tumorigenicity of chloral hydrate. Beginning on postnatal day 28, female B6C3F1 mice received chloral hydrate (99.5% pure) in water by gavage for 3, 6, or 12 months, 2 years, or as a single dose; on postnatal day 15, male and female B6C3F1 mice received a single dose by gavage. Tumorigenicity was assessed for 2 years after the initial dose. Genetic toxicology studies were conducted in Salmonella typhimurium, cultured Chinese hamster ovary cells, Drosophila melanogaster, and mouse bone marrow cells. 2-YEAR STUDY Groups of female mice (regimens A, B, C, and D) and groups of male mice (regimen E) received chloral hydrate in distilled water by gavage; control groups received distilled water only. In regimen A, groups of 48 female mice received 0, 25, 50, or 100 mg chloral hydrate/kg body weight 5 days per week for 104 weeks beginning when they were 28 days old