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Sample records for system ni kansuru

  1. Melting in the Fe-Ni system

    NASA Astrophysics Data System (ADS)

    Lord, O. T.; Walter, M. J.; Vocadlo, L.; Wood, I. G.; Dobson, D. P.

    2012-12-01

    The melting temperature of the Fe-rich core alloy at the inner core boundary (ICB) condition of 330 GPa is a key geophysical parameter because it represents an anchor point on the geotherm. An accurate knowledge of the melting curves of candidate alloys is therefore highly desirable. In spite of this, there is still considerable uncertainty in the melting point even of pure Fe at these conditions; estimates range from as low as 4850K based on one laser heated diamond anvil cell (LHDAC) study [1] to as high as 6900K based on recent quantum Monte Carlo calculations [2]. In reality we expect that the bulk core alloy may contain 5-10 wt% Ni (based on cosmochemical and meteoritic arguments) and up to 10 wt% of an as yet undetermined mix of light elements (with Si, S, C and O being the most likely candidates). While some recent studies have looked at the effects of light elements on the melting curve of Fe [e.g.: 3,4] with some of these studies including a small amount of Ni in their starting material, to date there has been no systematic study of melting temperatures in the Fe-Ni system. To address this issue, we have embarked upon just such a study. Using the LHDAC we have determined the melting curve of the pure Ni end-member to 180 GPa, and that of pure Fe to 50 GPa, using perturbations in the power vs. temperature function as the melting criterion [5]. Ar or NaCl were employed as pressure media while temperature was measured using standard spectroradiometric techniques [6]. In the case of Ni, perturbations were observed for both the sample and the Ar medium, allowing us to determine the melting curve of Ar and Ni simultaneously. Our results thus far for Ni and Ar agree closely with all of the available data, while extending the melting curves by a factor of two in pressure. In the case of Fe, our current dataset is also in good agreement with previous studies [2,7]. The agreement of all three melting curves with the literature data as well as other materials

  2. Oxygen potentials in Ni + NiO and Ni + Cr2O3 + NiCr2O4 systems

    NASA Astrophysics Data System (ADS)

    Kale, G. M.; Fray, D. J.

    1994-06-01

    The chemical potential of O for the coexistence of Ni + NiO and Ni + Cr2O3 + NiCr2O4 equilibria has been measured employing solid-state galvanic cells, (+) Pt, Cu + Cu2O // (Y2O3)ZrO2 // Ni + NiO, Pt (-) and (+) Pt, Ni + NiO // (Y2O3)ZrO2 // Ni + Cr2O3 + NiCr2O4, Pt (-) in the temperature range of 800 to 1300 K and 1100 to 1460 K, respectively. The electromotive force (emf) of both the cells was reversible, reproducible on thermal cycling, and varied linearly with temperature. For the coexistence of the two-phase mixture of Ni + NiO, δΜO 2(Ni + NiO) = -470,768 + 171.77T (±20) J mol-1 (800 ≤ T ≤ 1300 K) and for the coexistence of Ni + Cr2O3 + NiCr2O4, δΜO 2(Ni + Cr2O3 + NiCr2O4) = -523,190 + 191.07T (±100) J mol-1 (1100≤ T≤ 1460 K) The “third-law” analysis of the present results for Ni + NiO gives the value of ‡H{298/o} = -239.8 (±0.05) kJ mol-1, which is independent of temperature, for the formation of one mole of NiO from its elements. This is in excellent agreement with the calorimetric enthalpy of formation of NiO reported in the literature.

  3. Metal-semiconductor interfacial reactions - Ni/Si system

    NASA Technical Reports Server (NTRS)

    Cheung, N. W.; Grunthaner, P. J.; Grunthaner, F. J.; Mayer, J. W.; Ullrich, B. M.

    1981-01-01

    X-ray photoelectron spectroscopy and channeling measurements with MeV He-4(+) ions have been used to probe the structure of the interface in the Ni/Si system. It is found that reactions occur where Ni is deposited on Si at 10 to the -10th torr: Si atoms are displaced from lattice sites, the Ni atoms are in an Si-rich environment, and the Ni/Si interface is graded in composition. Composition gradients are present at both interfaces in the Si/Ni2/Si/Ni system. For the Ni-Si system, cooling the substrate to 100 K slows down the reaction rate. The temperature dependence of the interfacial reactivity indicates the kinetic nature of metal-semiconductor interfaces.

  4. Measured Activities of Al and Ni in gamma-(Ni) and gamma'-(Ni)3Al in the Ni-Al-Pt System

    NASA Technical Reports Server (NTRS)

    Copland, Evan

    2007-01-01

    Adding Pt to Ni-Al coatings is critical to achieving the required oxidation protection of Ni-based superalloys, but the nature of the Pt effect remains unresolved. This research provides a fundamental part of the answer by measuring the influence of Pt on the activities of Al and Ni in gamma-(Ni), gamma prime-(Ni)3Al and liquid in the Ni-Al-Pt system. Measurements have been made at 25 compositions in the Ni-rich corner over the temperature range, T = 1400-1750 K, by the vapor pressure technique with a multiple effusion-cell mass spectrometer (multi-cell KEMS). These measurements clearly show adding Pt (for X(sub Pt) less than 0.25) decreases a(Al) while increasing a(Ni). This solution behavior supports the idea that Pt increases Al transport to an alloy / Al2O3 interface and also limits the interaction between the coating and substrate alloys in the gamma-(Ni) + gamma prime-(Ni)3Al region. This presentation will review the progress of this study.

  5. A Thin Film of an Ni NiO Heterogeneous System for an Optical Recording Medium

    NASA Astrophysics Data System (ADS)

    Iida, Atsuko; Nishikawa, Reiji

    1994-07-01

    The authors have found a write once read many (WORM) type new optical recording medium of an Ni NiO heterogeneous system thin film. The structure of the recording medium is a single layer Ni NiO heterogeneous thin film on a transparent resin substrate. Irradiation of a converged laser diode beam causes a volume expansion of the film to form a swell. Information reading is done by using its reduction in reflectivity. The recordable composition region of this film is considered to be the transitive region from the metal to the oxide. The volume expansion is assumed to be induced by the oxidation of the Ni NiO heterogeneous thin film and the height of the swell is estimated. This value agrees well with the measured top height of the swell.

  6. Constitution of the Sr-Ni-O system

    SciTech Connect

    Zinkevich, M. . E-mail: zinkevich@mf.mpg.de

    2005-09-15

    The constitution of the Sr-Ni-O system was studied experimentally for the first time. Samples were prepared either from SrCO{sub 3} and NiO or from Sr(NO{sub 3}){sub 2} and Ni(NO{sub 3}){sub 2}.6H{sub 2}O and characterized by high-temperature X-ray powder diffraction, scanning electron microscopy, thermogravimetric and differential thermal analyses. In the SrO-NiO quasibinary system an eutectic reaction: liquid-bar SrO+NiO was found to occur at 1396+/-5{sup o}C, while the homogeneity range of terminal solid solutions is negligible. Thermodynamic calculations using the regular solution model for the liquid and rocksalt-type phases were employed to predict liquidus and solidus curves. Three ternary compounds, SrNiO{sub 2.5}, Sr{sub 5}Ni{sub 4}O{sub 11}, and Sr{sub 9}Ni{sub 7}O{sub 21} were observed in the samples prepared from nitrate solutions, but only Sr{sub 9}Ni{sub 7}O{sub 21} was proved to be thermodynamically stable in air up to 1030+/-6{sup o}C. When heating in air, SrNiO{sub 2.5} and Sr{sub 5}Ni{sub 4}O{sub 11} were found to transform irreversibly into a mixture of Sr{sub 9}Ni{sub 7}O{sub 21} and NiO. Isothermal section of the SrO-NiO-O subsystem, which represents phase equilibria at 950-1030{sup o}C as well as an isobaric section of the Sr-Ni-O system in air were constructed.

  7. Effect of Ni precursor solution concentration on the magnetic properties and exchange bias of Ni-NiO nanoparticulate systems

    NASA Astrophysics Data System (ADS)

    Roy, Aparna; De Toro, J. A.; Amaral, V. S.; Marques, D. P.; Ferreira, J. M. F.

    2014-09-01

    We report on a comparative study of the exchange bias effect and magnetic properties of Ni-NiO nanoparticulate systems synthesized by the chemical reduction of NiCl2 solution of two different molar concentrations—1 M (high) and 0.05 M (low)—followed by annealing of the dried precipitate in the temperature range 400-600 °C in air. Interestingly, the samples derived from the low molarity solution have higher Ni content and larger crystallite size than those prepared from their high molarity counterparts. These molarity dependent features subsequently modulate the magnitude of the exchange bias field in the samples, which is found to be absent or small in the 0.05 M series, but of moderate value in the 1 M samples. The different physical attributes of the particles derived from different concentrations of Ni-precursor solution are explained by invoking different nucleation kinetics and supersaturation degrees surrounding the viable growing nucleus. Furthermore, an observed increase of exchange bias with increasing annealing temperature, in contrast to the reported agglomeration of particles on annealing and subsequent reduction in bias magnitude, has been explained in correlation to the Ni-NiO interface density.

  8. Peculiarities of thermoelectric half-Heusler phase formation in Gd-Ni-Sb and Lu-Ni-Sb ternary systems

    NASA Astrophysics Data System (ADS)

    Romaka, V. V.; Romaka, L.; Horyn, A.; Rogl, P.; Stadnyk, Yu; Melnychenko, N.; Orlovskyy, M.; Krayovskyy, V.

    2016-07-01

    The phase equilibria in the Gd-Ni-Sb and Lu-Ni-Sb ternary systems were studied at 873 K by X-ray and metallographic analyses in the whole concentration range. The interaction of the elements in the Gd-Ni-Sb system results the formation of five ternary compounds at investigated temperature: Gd5Ni2Sb (Mo5SiB2-type), Gd5NiSb2 (Yb5Sb3-type), GdNiSb (MgAgAs-type), Gd3Ni6Sb5 (Y3Ni6Sb5-type), and GdNi0.72Sb2 (HfCuSi2-type). At investigated temperature the Lu-Ni-Sb system is characterized by formation of the LuNiSb (MgAgAs-type), Lu5Ni2Sb (Mo5SiB2-type), and Lu5Ni0.56Sb2.44 (Yb5Sb3-type) compounds. The disordering in the crystal structure of half-Heusler GdNiSb and LuNiSb was revealed by EPMA and studied by means of Rietveld refinement and DFT modeling. The performed electronic structure calculations are in good agreement with electrical transport property studies.

  9. Phase competition in ternary Ti-Ni-Al system

    NASA Astrophysics Data System (ADS)

    Wierzba, Bartek

    2016-07-01

    In this paper the reactive diffusion in Ti-Ni-Al system is discussed at 1173 K. The calculation method based on the binary approach is presented. The key kinetic parameter is Wagner integral diffusion coefficient. The experimental and simulation results of reactive diffusion between pure Ti and β-NiAl are compared at 1173 K after 100 h.

  10. The isothermal section of Gd-Ni-Si system at 1070 K

    NASA Astrophysics Data System (ADS)

    Morozkin, A. V.; Knotko, A. V.; Yapaskurt, V. O.; Manfrinetti, P.; Pani, M.; Provino, A.; Nirmala, R.; Quezado, S.; Malik, S. K.

    2016-03-01

    The Gd-Ni-Si system has been investigated at 1070 K by X-ray and microprobe analyses. The existence of the known compounds, i.e.: GdNi10Si2, GdNi8Si3, GdNi5Si3, GdNi7Si6, GdNi6Si6, GdNi4Si, GdNi2Si2, GdNiSi3, Gd3Ni6Si2, GdNiSi, GdNiSi2, GdNi0.4Si1.6, Gd2Ni2.35Si0.65, Gd3NiSi2, Gd3NiSi3 and Gd6Ni1.67Si3, has been confirmed. Moreover, five new phases have been identified in this system. The crystal structure for four of them has been determined: Gd2Ni16-12.8Si1-4.2 (Th2Zn17-type), GdNi6.6Si6 (GdNi7Si6-type), Gd3Ni8Si (Y3Co8Si-type) and Gd3Ni11.5Si4.2(Gd3Ru4Ga12-type). The compound with composition ~Gd2Ni4Si3 still remains with unknown structure. Quasi-binary phases, solid solutions, were detected at 1070 K to be formed by the binaries GdNi5, GdNi3, GdNi2, GdNi, GdSi2 and GdSi1.67; while no appreciable solubility was observed for the other binary compounds of the Gd-Ni-Si system. Magnetic properties of the GdNi6Si6, GdNi6.6Si6 and Gd3Ni11.5Si4.2 compounds have also been investigated and are here reported.

  11. Phase Equilibria of the Sn-Ni-Si Ternary System and Interfacial Reactions in Sn-(Cu)/Ni-Si Couples

    NASA Astrophysics Data System (ADS)

    Fang, Gu; Chen, Chih-chi

    2015-07-01

    Interfacial reactions in Sn/Ni-4.5 wt.%Si and Sn-Cu/Ni-4.5 wt.%Si couples at 250°C, and Sn-Ni-Si ternary phase equilibria at 250°C were investigated in this study. Ni-Si alloys, which are nonmagnetic, can be regarded as a diffusion barrier layer material in flip chip packaging. Solder/Ni-4.5 wt.%Si interfacial reactions are crucial to the reliability of soldered joints. Phase equilibria information is essential for development of solder/Ni-Si materials. No ternary compound is present in the Sn-Ni-Si ternary system at 250°C. Extended solubility of Si in the phases Ni3Sn2 and Ni3Sn is 3.8 and 6.1 at.%, respectively. As more Si dissolves in these phases their lattice constants decrease. No noticeable ternary solubility is observed for the other intermetallics. Interfacial reactions in solder/Ni-4.5 wt.%Si are similar to those for solder/Ni. Si does not alter the reaction phases. No Si solubility in the reaction phases was detected, although rates of growth of the reaction phases were reduced. Because the alloy Ni-4.5 wt.%Si reacts more slowly with solders than pure Ni, the Ni-4.5 wt.%Si alloy could be a potential new diffusion barrier layer material for flip chip packaging.

  12. Characteristics of Reactive Ni3Sn4 Formation and Growth in Ni-Sn Interlayer Systems

    NASA Astrophysics Data System (ADS)

    Lis, Adrian; Kenel, Christoph; Leinenbach, Christian

    2016-06-01

    The near-isothermal growth and formation of Ni3Sn4 intermetallic compounds (IMC) in Ni-Sn interlayer systems was studied in the solid state at 473 K (200 °C) and under solid-liquid conditions at 523 and 573 K (250 °C and 300 °C) from an initial state of a few seconds. Scalloped solid-state IMC formation was mainly driven by grain boundary diffusion of Ni through the IMC layer combined with the grain coarsening of the IMC layer. Under solid-liquid conditions, the formation of faceted and needle-shaped Ni3Sn4 grains as well as an atypical IMC growth behavior with similar parabolic growth constants for 523 K and 573 K (250 °C and 300 °C) was observed within the first 180 seconds of the holding time, and IMC growth occurred as an isothermal solidification from the Ni-saturated Sn melt. Due to the progressive densification of the IMC layer and the diffusion-controlled growth, the kinetics slowed down by approximately one order of magnitude after 180 seconds of annealing. The final stage was characterized by the formation of IMC islands ahead of the interfacial Ni3Sn4 layer. Needle-like IMC growth was effectively suppressed under combined solid-state and solid-liquid conditions. Textured Ni3Sn4 IMC formation at the Ni-Sn interface was approved with pole figure measurements. The activation energy Q for solid-liquid IMC formation was calculated as 43.3 kJ/mol, and processing maps for IMC growth and Sn consumption were derived as functions of temperature and time, respectively.

  13. Microstructure of the Al-La-Ni-Fe system

    SciTech Connect

    Vasil’ev, A. L.; Ivanova, A. G.; Bakhteeva, N. D.; Kolobylina, N. N.; Orekhov, A. S.; Presnyakov, M. Yu.; Todorova, E. V.

    2015-01-15

    The microstructure of alloys based on the Al-La-Ni-Fe system, which are characterized by a unique ability to form metal glasses and nanoscale composites in a wide range of compositions, has been investigated. Al{sub 85}Ni{sub 7}Fe{sub 4}La{sub 4} and Al{sub 85}Ni{sub 9}Fe{sub 2}La{sub 4} alloys have been analyzed by electron microscopy (including high-resolution scanning transmission electron microscopy), energy-dispersive X-ray microanalysis, electron diffraction (ED), and X-ray diffraction (XRD). It is found that, along with fcc Al and Al{sub 4}La (Al{sub 11}La{sub 3}) particles, these alloys contain a ternary phase Al{sub 3}Ni{sub 1−x}Fe{sub x} (sp. gr. Pnma) isostructural to the Al{sub 3}Ni phase and a quaternary phase Al{sub 8}Fe{sub 2−x}Ni{sub x}La isostructural to the Al{sub 8}Fe{sub 2}Eu phase (sp. gr. Pbam). The unit-cell parameters of the Al{sub 3}Ni{sub 1−x}Fe{sub x} and Al{sub 8}Fe{sub 2−x}Ni{sub x}La compounds, determined by ED and refined by XRD, are a = 0.664(1) nm, b = 0.734(1) nm, and c = 0.490(1) nm for Al{sub 3}Ni{sub 1−x}Fe{sub x} and a = 1.258(3) nm, b = 1.448(3) nm, and c = 0.405(8) nm for Al{sub 8}Fe{sub 2−x}Ni{sub x}La. In both cases Ni and Fe atoms are statistically arranged, and no ordering is found. Al{sub 8}Fe{sub 2−x}Ni{sub x}La particles contain inclusions in the form of Al{sub 3}Fe δ layers.

  14. Phase equilibria in the Ni-Al-Ti system at 1173 k

    NASA Astrophysics Data System (ADS)

    Nash, P.; Liang, W. W.

    1985-03-01

    The phase equilibria at 1173 K have been determined in the Ni-AI-Ti system for Al contents less than 50 at. pct. The extent of the H (Ni2AlTi) phase field has been established as well as the extent of solubility in the binary compounds γ (Ni3Al), ν(Ni3Ti), β2(NiTi), NiTi2, and ζ(AlTi3). Substantial differences were found between the phase equilibria determined in this study and previous studies, in part due to the large solubility of Al in NiTi2.

  15. Interdiffusion and intrinsic diffusion in the NiAl /delta/ phase of the Al-Ni system

    NASA Technical Reports Server (NTRS)

    Shankar, S.; Seigle, L. L.

    1978-01-01

    Interdiffusion coefficients at 950 to 1150 C and the ratio of intrinsic diffusion coefficients at 1100 C were measured as functions of composition in the NiAl (delta) phase of the Al-Ni system, using a vapor-solid technique. Diffusivity values were also obtained for the Ni3Al (epsilon) and Ni (Al) solid solution (zeta) phases from 950 to 1150 C. The interdiffusion coefficient in NiAl (delta) varies several orders of magnitude over the delta phase field with a deep minimum in the diffusivity-composition curve at 48 to 49 at% Al. The ratio of intrinsic diffusion coefficients DNi/DAl, in the delta phase also varies with composition from a value of 3 to 3.5 below 50 at% Al to 0.1 or less above 50 at% Al.

  16. The Ce-Ni-Si system as a representative of the rare earth-Ni-Si family: Isothermal section and new rare-earth nickel silicides

    NASA Astrophysics Data System (ADS)

    Morozkin, A. V.; Knotko, A. V.; Garshev, A. V.; Yapaskurt, V. O.; Nirmala, R.; Quezado, S.; Malik, S. K.

    2016-11-01

    The Ce-Ni-Si system has been investigated at 870/1070 K by X-ray and microprobe analyses. The existence of the known compounds, i.e.: Ce2Ni15.8Si1.2 (Th2Ni17-type), Ce2Ni15-14Si2-3 (Th2Zn17-type), CeNi8.6Si2.4 (BaCd11-type), CeNi8.8Si4.2 (LaCo9Si4-type), CeNi6Si6 (CeNi6Si6-type), CeNi5Si1-0.3 (TbCu7-type), CeNi4Si (YNi4Si-type), CeNi2Si2 (CeGa2Al2-type), Ce2Ni3Si5 (U2Co3Si5-type), Ce3Ni6Si2 (Ce3Ni6Si2-type), Ce3Ni4Si4 (U3Ni4Si4-type), CeNiSi2 (CeNiSi2-type), CeNi1.3Si0.7 (unknown type structure), Ce6Ni7Si4 (Pr6Ni7Si4-type), CeNiSi (LaPtSi-type), CeNi0.8-0.3Si1.2-1.7 (AlB2-type), Ce2Ni2Si (unknown type structure), Ce4.5Ni3.5Si2 (unknown type structure), Ce15Ni7Si10 (Pr15Ni7Si10-type), Ce5Ni1.85Si3 (Ce5Ni1.85Si3-type), Ce6Ni1.4Si3.4 (Ce6Ni1.67Si3-type), Ce7Ni2Si5 (Ce7Ni2Si5-type) and Ce3NiSi3 (Y3NiSi3-type) has been confirmed in this section. Moreover, the type structure has been determined for Ce2Ni2Si (Mo2NiB2-type Ce2Ni2.5Si0.5) and Ce4.5Ni3.5Si2 (W3CoB3-type Ce3Ni3-2.7Si1-1.3) and new ternary phases Ce2Ni6.25Si0.75 (Gd2Co7-type), CeNi7-7.6Si6-5.4 (GdNi7Si6-type) and Ce27Ni42Si31 (unknown type structure) have been identified in this system. Quasi-binary phases, solid solutions, were detected at 870/1070 K for CeNi5, CeNi3 and CeSi2; while no appreciable solubility was observed for the other binary compounds of the Ce-Ni-Si system. As a prolongation of Rare Earth-Ni-Si system's isostructural rows, LaNi7Si6 and YNi6.6Si6.1 (GdNi7Si6-type), ScNi6Si6 (YCo6Ge6-type), NdNi6Si6 (YNi6Si6-type), {Tb, Ho}2Ni15Si2 (Th2Zn17-type), Nd2Ni2.3Si0.7 and Sm2Ni2.2Si0.8 (Mo2NiB2-type), Nd3Ni2.55Si1.45 (W3CoB3-type) and {Tb, Dy}7Ni50Si19 (Y7Ni49Si20-type) compounds were synthesized and investigated. Magnetic properties of the CeNi6Si6, CeNi7Si6, CeNi8.8Si4.2, Ce6Ni7Si4, CeNi5Si, Ce2Ni2.5Si0.5, Nd2Ni2.3Si0.7 and Dy7Ni50Si19 compounds have also been investigated and are presented here.

  17. Oxygen potentials in Ni + NiO and Ni + Cr[sub 2]O[sub 3] + NiCr[sub 2]O[sub 4] systems

    SciTech Connect

    Kale, G.M.; Fray, D.J. . Dept. of Mining and Mineral Engineering)

    1994-06-01

    The chemical potential of O for the coexistence of Ni + NiO and Ni + Cr[sub 2]O[sub 3] + NiCr[sub 2]O[sub 4] equilibria has been measured employing solid-state galvanic cells, (+) Pt, Cu + Cu[sub 2]O [vert bar][vert bar] (Y[sub 2]O[sub 3])ZrO[sub 2] [vert bar][vert bar] Ni + NiO, Pt (-) and (+) Pt, Ni + NiO [vert bar][vert bar] (Y[sub 2]O[sub 3])ZrO[sub 2] [vert bar][vert bar] Ni + Cr[sub 2]O[sub 3] + NiCr[sub 2]O[sub 4], Pt (-) in the temperature range of 800 to 1,300 K and 1,100 to 1,460 K, respectively. The electromotive force (emf) of both he cells was reversible, reproducible on thermal cycling, and varied linearly with temperature. for the coexistence of the two-phase mixture of Ni + NiO, [Delta][mu][sub O[sub 2

  18. Phase equilibria, formation, crystal and electronic structure of ternary compounds in Ti-Ni-Sn and Ti-Ni-Sb ternary systems

    SciTech Connect

    Romaka, V.V.; Rogl, P.; Romaka, L.; Stadnyk, Yu.; Melnychenko, N.; Grytsiv, A.; Falmbigl, M.; Skryabina, N.

    2013-01-15

    The phase equilibria of the Ti-Ni-Sn and Ti-Ni-Sb ternary systems have been studied in the whole concentration range by means of X-ray and EPM analyses at 1073 K and 873 K, respectively. Four ternary intermetallic compounds TiNiSn (MgAgAs-type), TiNi{sub 2-x}Sn (MnCu{sub 2}Al-type), Ti{sub 2}Ni{sub 2}Sn (U{sub 2}Pt{sub 2}Sn-type), and Ti{sub 5}NiSn{sub 3} (Hf{sub 5}CuSn{sub 3}-type) are formed in Ti-Ni-Sn system at 1073 K. The TiNi{sub 2}Sn stannide is characterized by homogeneity in the range of 50-47 at% of Ni. The Ti-Ni-Sb ternary system at 873 K is characterized by formation of three ternary intermetallic compounds, Ti{sub 0.8}NiSb (MgAgAs-type), Ti{sub 5}Ni{sub 0.45}Sb{sub 2.55} (W{sub 5}Si{sub 3}-type), and Ti{sub 5}NiSb{sub 3} (Hf{sub 5}CuSn{sub 3}-type). The solubility of Ni in Ti{sub 0.8}NiSb decreases number of vacancies in Ti site up to Ti{sub 0.91}Ni{sub 1.1}Sb composition. - Graphical abstract: Isothermal section of the Ti-Ni-Sn phase diagram and DOS distribution in hypothetical TiNi{sub 1+x}Sn solid solution. Highlights: Black-Right-Pointing-Pointer Ti-Ni-Sn phase diagram was constructed at 1073 K. Black-Right-Pointing-Pointer Four ternary compounds are formed: TiNiSn, TiNi{sub 2-x}Sn, Ti{sub 2}Ni{sub 2}Sn, and Ti{sub 5}NiSn{sub 3}. Black-Right-Pointing-Pointer Three ternary compounds exist in Ti-Ni-Sb system at 873 K. Black-Right-Pointing-Pointer The TiNi{sub 2}Sb compound is absent.

  19. An X-ray diffraction study of the NpNi system

    NASA Astrophysics Data System (ADS)

    Akabori, M.; Haire, R. G.; Gibson, J. K.; Okamoto, Y.; Ogawa, T.

    1997-08-01

    The neptunium-nickel binary system has been studied by means of powder X-ray diffraction. The previously reported NpNi 2 Laves phase was confirmed and a previously unknown intermetallic compound, Np 2Ni 17, was identified. The crystal symmetry of Np 2Ni 17 was determined to be the Th 2Ni 17 type hexagonal structure which is the same as that of Pu 2Ni 17 The lattice parameters of Np 2Ni 17 were calculated to be: a0 = 0.8333 ± 0.0005 and c0 = 0.8010 ± 0.0009 nm. The solubility limit of nickel in NpNi solid solutions and the composition range of NpNi 2 compound were also discussed.

  20. Study of phase stability in NiPt systems

    NASA Astrophysics Data System (ADS)

    Paudyal, Durga; Saha-Dasgupta, Tanusri; Mookerjee, Abhijit

    2003-02-01

    We have studied the problem of phase stability in NiPt alloy systems. We have used the augmented space recursion based on the tight binding-linearized muffin-tin orbital as the method for studying the electronic structure of the alloys. In particular, we have used the relativistic generalization of our earlier technique. We note that, in order to predict the proper ground state structures and energetics, in addition to relativistic effects, we have to take into account charge transfer effects with precision.

  1. Diffusion, phase equilibria and partitioning experiments in the Ni-Fe-Ru system

    NASA Technical Reports Server (NTRS)

    Blum, Joel D.; Wasserburg, G. J.; Hutcheon, I. D.; Beckett, J. R.; Stolper, E. M.

    1989-01-01

    Results are presented on thin-film diffusion experiments designed to investigate phase equilibria in systems containing high concentrations of Pt-group elements, such as Ni-Fe-Ru-rich systems containing Pt, at temperatures of 1273, 1073, and 873 K. The rate of Ru diffusion in Ni was determined as a function of temperature, and, in addition, the degree of Pt and Ir partitioning between phases in a Ni-Fe-Ru-rich system and of V between phases in a Ni-Fe-O-rich system at 873 were determined. It was found that Pt preferentially partitions into the (gamma)Ni-Fe phase, whereas Ir prefers the (epsilon)Ru-Fe phase. V partitions strongly into Fe oxides relative to (gamma)Ni-Fe. These results have direct application to the origin and thermal history of the alloys rich in Pt-group elements in meteorites.

  2. Phase Equilibria of the Fe-Ni-Sn Ternary System at 270°C

    NASA Astrophysics Data System (ADS)

    Huang, Tzu-Ting; Lin, Shih-Wei; Chen, Chih-Ming; Chen, Pei Yu; Yen, Yee-Wen

    2016-07-01

    The Fe-42 wt.% Ni alloy, also known as a 42 invar alloy (Alloy 42), is used as a lead-frame material because its thermal expansion coefficient is much closer to Si substrate than Cu or Ni substrates. In order to enhance the wettability between the substrate and solder, the Sn layer was commonly electroplated onto the Alloy 42 surface. A clear understanding of the phase equilibria of the Fe-Ni-Sn ternary system is necessary to ensure solder-joint reliability between Sn and Fe-Ni alloys. To determine the isothermal section of the Fe-Ni-Sn ternary system at 270°C, 26 Fe-Ni-Sn alloys with different compositions were prepared. The experimental results confirmed the presence of the Fe3Ni and FeNi phases at 270°C. Meanwhile, it observed that the isothermal section of the Fe-Ni-Sn ternary system was composed of 11 single-phase regions, 19 two-phase regions and nine tie-triangles. Moreover, no ternary compounds were found in the Fe-Ni-Sn system at 270°C.

  3. A Review of TiNiPdCu Alloy System for High Temperature Shape Memory Applications

    NASA Astrophysics Data System (ADS)

    Khan, M. Imran; Kim, Hee Young; Miyazaki, Shuichi

    2015-06-01

    High temperature shape memory alloys (HTSMAs) are important smart materials and possess a significant potential to improve many engineering systems. Many TiNi-based high temperature ternary alloy systems have been reported in literature including TiNiPd, TiNiPt, TiNiZr, TiNiAu, TiNiHf, etc. Some quaternary additions of certain elements in the above systems have been successful to further improve many important shape memory and mechanical properties. The success criteria for an HTSMA become strict in terms of its cyclic stability, maximum recoverable strain, creep resistance, and corrosion resistance at high temperatures. TiNiPdCu alloy system has been recently proposed as a promising HTSMA. Unique nanoscaled precipitates formed in TiNiPdCu-based HTSMAs are found to be stable at temperatures above 773 K, while keeping the benefits of ease of fabrication. It is expected that this alloy system possesses significant potential especially for the high temperature shape memory applications. Till now many research reports have been published on this alloy system. In the present work, a comprehensive review of the TiNiPdCu system is presented in terms of thermomechanical behavior, nanoscale precipitation mechanism, microstructural features, high temperature shape memory and mechanical properties, and the important parameters to control the high temperature performance of these alloys.

  4. Realization of magnetostructural coupling by modifying structural transitions in MnNiSi-CoNiGe system with a wide Curie-temperature window

    PubMed Central

    Liu, Jun; Gong, Yuanyuan; Xu, Guizhou; Peng, Guo; Shah, Ishfaq Ahmad; ul Hassan, Najam; Xu, Feng

    2016-01-01

    The magnetostructural coupling between structural and magnetic transitions leads to magneto-multifunctionalities of phase-transition alloys. Due to the increasing demands of multifunctional applications, to search for the new materials with tunable magnetostructural transformations in a large operating temperature range is important. In this work, we demonstrate that by chemically alloying MnNiSi with CoNiGe, the structural transformation temperature of MnNiSi (1200 K) is remarkably decreased by almost 1000 K. A tunable magnetostructural transformation between the paramagnetic hexagonal and ferromagnetic orthorhombic phase over a wide temperature window from 425 to 125 K is realized in (MnNiSi)1−x(CoNiGe)x system. The magnetic-field-induced magnetostructural transformation is accompanied by the high-performance magnetocaloric effect, proving that MnNiSi-CoNiGe system is a promising candidate for magnetic cooling refrigerant. PMID:26979284

  5. Realization of magnetostructural coupling by modifying structural transitions in MnNiSi-CoNiGe system with a wide Curie-temperature window.

    PubMed

    Liu, Jun; Gong, Yuanyuan; Xu, Guizhou; Peng, Guo; Shah, Ishfaq Ahmad; Ul Hassan, Najam; Xu, Feng

    2016-03-16

    The magnetostructural coupling between structural and magnetic transitions leads to magneto-multifunctionalities of phase-transition alloys. Due to the increasing demands of multifunctional applications, to search for the new materials with tunable magnetostructural transformations in a large operating temperature range is important. In this work, we demonstrate that by chemically alloying MnNiSi with CoNiGe, the structural transformation temperature of MnNiSi (1200 K) is remarkably decreased by almost 1000 K. A tunable magnetostructural transformation between the paramagnetic hexagonal and ferromagnetic orthorhombic phase over a wide temperature window from 425 to 125 K is realized in (MnNiSi)1-x(CoNiGe)x system. The magnetic-field-induced magnetostructural transformation is accompanied by the high-performance magnetocaloric effect, proving that MnNiSi-CoNiGe system is a promising candidate for magnetic cooling refrigerant.

  6. Thermodynamic properties of complex oxides in the La-Ni-O system

    SciTech Connect

    Bannikov, D.O. . E-mail: Dmitry.Bannikov@usu.ru; Cherepanov, V.A.

    2006-08-15

    Complex oxides La{sub 2}NiO{sub 4+} {sub {delta}} , La{sub 3}Ni{sub 2}O{sub 7-} {sub {delta}} , La{sub 4}Ni{sub 3}O{sub 10-} {sub {delta}} and LaNiO{sub 3-} {sub {delta}} , the members of Ruddlesden-Popper series La {sub n} {sub +1}Ni {sub n} O{sub 3} {sub n} {sub +1}, were prepared using citrate precursors. The stability range of LaNiO{sub 3-} {sub {delta}} in air as well as the oxygen nonstoichiometry of La{sub 3}Ni{sub 2}O{sub 7-} {sub {delta}} and La{sub 4}Ni{sub 3}O{sub 10-} {sub {delta}} as a function of temperature and oxygen partial pressure was determined by means of thermogravimetric technique. Decomposition temperatures of La{sub 3}Ni{sub 2}O{sub 7-} {sub {delta}} , La{sub 4}Ni{sub 3}O{sub 10-} {sub {delta}} and LaNiO{sub 3-} {sub {delta}} in air were determined by conductivity measurement method. The boundary of stability for La{sub 4}Ni{sub 3}O{sub 10-} {sub {delta}} was determined by EMF measurements of galvanic cell with oxygen conducting solid electrolyte. The isothermal (1400 K) projection of La-Ni-O system phase diagram to the plane 'log(PO{sub 2})-relative mole fraction of metal components' was suggested. - Graphical abstract: The crystal structure of La{sub 4}Ni{sub 3}O{sub 10}.

  7. The ? electronic band system of nickel acetylide, NiCCH

    NASA Astrophysics Data System (ADS)

    Johnson, Eric L.; Morse, Michael D.

    2015-08-01

    Optical spectra of the supersonically cooled NiCCH radical have been recorded in the 530-650 nm region using the resonant two-photon ionisation method, and five of the observed bands have been rotationally resolved. The rotationally resolved studies demonstrate that the ground state of NiCCH is of ? symmetry, corresponding to a 3d9 configuration on the nickel atom, with the hole located in a 3dδ orbital. Most of the observed bands are assigned to the ? electronic transition, which shows a progression in the Ni-C stretching mode, ν3. In addition, single excitations of the modes ν2 (C≡C stretch), ν4 (C≡C-H bend), and ν5 (Ni-C≡C bend) are observed, allowing these vibrational intervals to be determined for the ? state. Hot bands also allow the determination of ν5 in the ground ? state. Quantum chemical computations have also been performed, confirming that the ground state is of 2Δ symmetry. The results are placed in context via comparison to other monovalent, monoligated Ni complexes, particularly NiCu, NiH, and NiCN.

  8. Threshold behavior of interaction potential for the system 7Li + 64Ni: Comparison with 6Li + 64Ni

    NASA Astrophysics Data System (ADS)

    Shaikh, Md. Moin; Das, Mili; Roy, Subinit; Sinha, M.; Pradhan, M. K.; Basu, P.; Datta, U.; Ramachandran, K.; Shrivastava, A.

    2016-09-01

    The elastic scattering angular distributions for the system 7Li + 64Ni were measured in the bombarding energy range of 12 MeV ≤Elab ≤ 26.4 MeV. A phenomenological optical model analysis was performed for the measured data. The strengths of the fitted potential components at the surface were estimated to extract their variation with energy. Further analyses of the measured angular distributions were performed with a hybrid potential composed of a renormalized folded real and a phenomenological imaginary potential. Both the model potentials predict similar energy dependent behavior for the effective interaction potential around the barrier. Unlike the heavy targets, 7Li + 64Ni does not show a normal threshold behavior. It also does not clearly exhibit a behavior similar to 6Li + 64Ni. The real potential for 7Li + 64Ni does not exhibit any significant energy dependence and the imaginary potential strength remains almost independent of energy above the Coulomb barrier (∼ 14 MeV). However, at energies below the barrier, a sudden drop in the imaginary potential strength is observed.

  9. Ferromagnetic shape memory in the NiMnGa system

    SciTech Connect

    Tickle, R.; James, R.D.; Shield, T.; Wuttig, M.; Kokorin, V.V.

    1999-09-01

    Strain versus field measurements for a ferromagnetic shape memory alloy in the NiMnGa system demonstrate the largest magnetostrictive strains to date of nearly 1.3%. These strains are achieved in the martensitic state through field-induced variant rearrangement. An experimental apparatus is described that provides biaxial magnetic fields and uniaxial compressive prestress with temperature control while recording microstructural changes with optical microscopy. The magnetostrictive response is found to be sensitive to the initial state induced by stress-biasing the martensitic variant structure, and exhibits rate effects related to twin boundary mobility. Experiments performed with constant stress demonstrate work output capacity. Experimental results are interpreted by using a theory based on minimization of a micromagnetic energy functional that includes applied field, stress, and demagnetization energies. It is found that the theory provides a good qualitative description of material behavior, but significantly overpredicts the amount of strain produced. Issues concerning the martensitic magnetic anisotropy and variant nucleation are discussed with regard to this discrepancy.

  10. Metal/silicon interface formation - The Ni/Si and Pd/Si systems

    NASA Technical Reports Server (NTRS)

    Grunthaner, P. J.; Grunthaner, F. J.; Madhukar, A.; Mayer, J. W.

    1981-01-01

    The valence level spectra of the Ni/Si and Pd/Si systems have been investigated using high resolution X-ray photoelectron spectroscopy. Temperature dependence studies for Ni deposited on thin thermal SiO2 demonstrate the importance of metal aggregation effects in the interpretation of binding energies as chemical shifts. Temperature studies for the Ni/Si system indicate that substantial chemical interaction occurs at the interface at temperatures as low as 100 K. These studies also show the presence of Ni in interstitial voids in the Si near the interface. A comparative study of the core and valence band features for the Ni and Pd silicides provides many valuable insights and a self-consistent picture of the attendent valence charge redistribution and its influence on the observed chemical shifts.

  11. Sub-barrier fusion and transfers in the 40Ca + 58,64Ni systems

    NASA Astrophysics Data System (ADS)

    Bourgin, D.; Courtin, S.; Haas, F.; Goasduff, A.; Stefanini, A. M.; Montagnoli, G.; Montanari, D.; Corradi, L.; Huiming, J.; Scarlassara, F.; Fioretto, E.; Simenel, C.; Rowley, N.; Szilner, S.; Mijatović, T.

    2016-05-01

    Fusion cross sections have been measured in the 40Ca + 58Ni and 40Ca + 64Ni systems at energies around and below the Coulomb barrier. The 40Ca beam was delivered by the XTU Tandem accelerator of the Laboratori Nazionali di Legnaro and evaporation residues were measured at very forward angles with the LNL electrostatic beam deflector. Coupled-channels calculations were performed which highlight possible strong effects of neutron transfers on the fusion below the barrier in the 40Ca + 64Ni system. Microscopic time-dependent Hartree-Fock calculations have also been performed for both systems. Preliminary results are shown.

  12. Interface alloying due to Kr-irradiation on Ni/Si system

    NASA Astrophysics Data System (ADS)

    Datta, D.; Bhattacharyya, S. R.

    2007-03-01

    This study deals with an investigation of silicide formation at the interface of Ni thin film and Si substrate induced by 300 keV 84Kr2+ ions at a number of doses under ambient condition. The implanted samples were subsequently annealed using a rapid thermal annealing system (RTA) in vacuum environment. The modification of the interface and surface properties has been analyzed using various methods like scanning electron microscope with energy dispersive X-ray analysis (SEM/EDAX), X-ray diffraction (XRD), etc. The energy dispersive X-ray spectra (EDS) show a decrease of Ni content in the samples with increasing dose, which indicates the sputter erosion due to ion irradiation. The SEM micrographs show no considerable surface modification under ion bombardment but the XRD spectra clearly reveal the formation of different phases of Ni2Si and NiSi at lower doses which transforms to NiSi as dose increases.

  13. Experimental determination and thermodynamic modeling of the Ni-Re binary system

    NASA Astrophysics Data System (ADS)

    Yaqoob, Khurram; Joubert, Jean-Marc

    2012-12-01

    The phase diagram of the Ni-Re binary system has been partially reinvestigated by chemical, structural and thermal characterization of the arc melted alloys. The experimental results obtained during the present investigation were combined with the literature data and a new phase diagram of the Ni-Re binary system is proposed. In comparison with the Ni-Re phase diagram proposed by Nash et al. in 1985 [1], significant differences in the homogeneity domains, freezing ranges and peritectic reaction temperature were evidenced. On the other hand, thermodynamic modeling of the studied system by using the new experimental information has also been carried out with the help of the CALPHAD method. The calculated Ni-Re phase diagram showed a good agreement with the selected experimental information.

  14. Evidence for ferromagnetic strain glass in Ni-Co-Mn-Ga Heusler alloy system

    NASA Astrophysics Data System (ADS)

    Wang, Yu; Huang, Chonghui; Gao, Jinghui; Yang, Sen; Ding, Xiangdong; Song, Xiaoping; Ren, Xiaobing

    2012-09-01

    We report that both a strain glass transition and a ferromagnetic transition take place in a Ni43Co12Mn20Ga25 Heusler alloy. This results in a ferromagnetic strain glass with coexisting short range strain ordering and long range magnetic moment ordering. The phase diagram of the Ni-Co-Mn-Ga system shows that the substitutional point defect Co in the Ni-site plays the following roles: (i) suppressing the long range strain ordering of martensite, (ii) promoting local strain ordering of strain glass by producing random local stresses, and (iii) enhancing the ferromagnetic exchange interaction, which leads to the formation of ferromagnetic strain glass.

  15. Experimental determination and thermodynamic modeling of the Ni-Re binary system

    SciTech Connect

    Yaqoob, Khurram; Joubert, Jean-Marc

    2012-12-15

    The phase diagram of the Ni-Re binary system has been partially reinvestigated by chemical, structural and thermal characterization of the arc melted alloys. The experimental results obtained during the present investigation were combined with the literature data and a new phase diagram of the Ni-Re binary system is proposed. In comparison with the Ni-Re phase diagram proposed by Nash et al. in 1985 [1], significant differences in the homogeneity domains, freezing ranges and peritectic reaction temperature were evidenced. On the other hand, thermodynamic modeling of the studied system by using the new experimental information has also been carried out with the help of the CALPHAD method. The calculated Ni-Re phase diagram showed a good agreement with the selected experimental information. - Graphical abstract: Ni-Re phase diagram according to the present study. Highlights: Black-Right-Pointing-Pointer Re-investigation of the Ni-Re phase diagram. Black-Right-Pointing-Pointer Extended phase field of the hcp phase. Black-Right-Pointing-Pointer Different freezing ranges and peritectic reaction temperature. Black-Right-Pointing-Pointer Thermodynamic modeling of the studied system by using the CALPHAD method.

  16. Molecular dynamics simulation of surface segregation, diffusion and reaction phenomena in equiatomic Ni-Al systems

    NASA Astrophysics Data System (ADS)

    Evteev, A. V.; Levchenko, E. V.; Belova, I. V.; Murch, G. E.

    2012-12-01

    The molecular dynamics method is used to provide fundamental insights into surface segregation, bulk diffusion and alloying reaction phenomena in equiatomic Ni-Al systems. This knowledge can serve as a guide for the search and development of economic routes for controlling microstructure and properties of the intermetallic compound NiAl. This paper gives an overview of recent molecular dynamics simulations in the area along with other theoretical calculations and experimental measurements.

  17. Hydrogen evolution in [NiFe] hydrogenases and related biomimetic systems: similarities and differences.

    PubMed

    Das, Ranjita; Neese, Frank; van Gastel, Maurice

    2016-09-21

    In this work, a detailed quantum chemical study of the mechanism of [Ni(bdt)(dppf)] (Ni(II)L) catalyzed hydrogen formation [A. Gan, T. L. Groy, P. Tarakeshwar, S. K. S. Mazinani, J. Shearer, V. Mujica and A. K. Jones, J. Am. Chem. Soc., 2015, 137, 1109-1115] following an electro-chemical-electro-chemical (ECEC) pathway is reported. The complex exclusively catalyzes the reduction of protons to molecular hydrogen. The calculations suggest that the first one-electron reduction of the [Ni(II)L] catalyst is the rate limiting step of the catalytic cycle and hence, the buildup of detectable reaction intermediates is not expected. The catalytic activity of the [Ni(II)L] complex is facilitated by the flexibility of the ligand system, which allows the ligand framework to adapt to changes in the Ni oxidation state over the course of the reaction. Additionally, a comparison is made with the catalytic activity of [NiFe] hydrogenase. It is argued that the directionality of the reversible hydrogen formation reaction is controlled by the ligand field of the nickel ion and the possibility for side-on (η(2)) binding of H2: if the ligand framework does not allow for η(2) binding of H2, as is the case for [Ni(II)L], the catalyst irreversibly reduces protons. If the ligand field allows η(2) binding of H2, the catalyst can in principle work reversibly. The conditions for η(2) binding are discussed. PMID:27545687

  18. Effects of Ni(2+) on aluminum hydroxide scale formation and transformation on a simulated drinking water distribution system.

    PubMed

    Wang, Wendong; Song, Shan; Zhang, Xiaoni; Mitchell Spear, J; Wang, Xiaochang; Wang, Wen; Ding, Zhenzhen; Qiao, Zixia

    2014-07-01

    Observations of aluminum containing sediments/scales formed within the distribution pipes have been reported for several decades. In this study, the effect of Ni(2+) on the formation and transformation processes of aluminum hydroxide sediment in a simulated drinking water distribution system were investigated using X-ray diffraction spectrum (XRD), Fourier transform infrared spectrum (FT-IR), scanning electron microscope (SEM), and thermodynamic calculation methods. It was determined that the existence of Ni(2+) had notable effects on the formation of bayerite. In the system without Ni(2+) addition, there was no X-ray diffraction signal observed after 400 d of aging. The presence of Ni(2+), however, even when present in small amounts (Ni/Al=1:100) the formation of bayerite would occur in as little as 3d at pH 8.5. As the molar ratio of Ni/Al increase from 1:100 to 1:10, the amount of bayerite formed on the pipeline increased further; meanwhile, the specific area of the pipe scale decreased from 160 to 122 m(2)g(-1). In the system with Ni/Al molar ratio at 1:3, the diffraction spectrum strength of bayerite became weaker, and disappeared when Ni/Al molar ratios increased above 1:1. At these highs Ni/Al molar ratios, Ni5Al4O11⋅18H2O was determined to be the major component of the pipe scale. Further study indicated that the presence of Ni(2+) promoted the formation of bayerite and Ni5Al4O11⋅18H2O under basic conditions. At lower pH (6.5) however, the existence of Ni(2+) had little effect on the formation of bayerite and Ni5Al4O11⋅18H2O, rather the adsorption of amorphous Al(OH)3 for Ni(2+) promoted the formation of crystal Ni(OH)2.

  19. Antiferromagnetic proximity effect in epitaxial CoO/NiO/MgO(001) systems.

    PubMed

    Li, Q; Liang, J H; Luo, Y M; Ding, Z; Gu, T; Hu, Z; Hua, C Y; Lin, H-J; Pi, T W; Kang, S P; Won, C; Wu, Y Z

    2016-01-01

    Magnetic proximity effect between two magnetic layers is an important focus of research for discovering new physical properties of magnetic systems. Antiferromagnets (AFMs) are fundamental systems with magnetic ordering and promising candidate materials in the emerging field of antiferromagnetic spintronics. However, the magnetic proximity effect between antiferromagnetic bilayers is rarely studied because detecting the spin orientation of AFMs is challenging. Using X-ray linear dichroism and magneto-optical Kerr effect measurements, we investigated antiferromagnetic proximity effects in epitaxial CoO/NiO/MgO(001) systems. We found the antiferromagnetic spin of the NiO underwent a spin reorientation transition from in-plane to out-of-plane with increasing NiO thickness, with the existence of vertical exchange spring spin alignment in thick NiO. More interestingly, the Néel temperature of the CoO layer was greatly enhanced by the adjacent NiO layer, with the extent of the enhancement closely dependent on the spin orientation of NiO layer. This phenomenon was attributed to different exchange coupling strengths at the AFM/AFM interface depending on the relative spin directions. Our results indicate a new route for modifying the spin configuration and ordering temperature of AFMs through the magnetic proximity effect near room temperature, which should further benefit the design of AFM spintronic devices. PMID:26932164

  20. Antiferromagnetic proximity effect in epitaxial CoO/NiO/MgO(001) systems.

    PubMed

    Li, Q; Liang, J H; Luo, Y M; Ding, Z; Gu, T; Hu, Z; Hua, C Y; Lin, H-J; Pi, T W; Kang, S P; Won, C; Wu, Y Z

    2016-01-01

    Magnetic proximity effect between two magnetic layers is an important focus of research for discovering new physical properties of magnetic systems. Antiferromagnets (AFMs) are fundamental systems with magnetic ordering and promising candidate materials in the emerging field of antiferromagnetic spintronics. However, the magnetic proximity effect between antiferromagnetic bilayers is rarely studied because detecting the spin orientation of AFMs is challenging. Using X-ray linear dichroism and magneto-optical Kerr effect measurements, we investigated antiferromagnetic proximity effects in epitaxial CoO/NiO/MgO(001) systems. We found the antiferromagnetic spin of the NiO underwent a spin reorientation transition from in-plane to out-of-plane with increasing NiO thickness, with the existence of vertical exchange spring spin alignment in thick NiO. More interestingly, the Néel temperature of the CoO layer was greatly enhanced by the adjacent NiO layer, with the extent of the enhancement closely dependent on the spin orientation of NiO layer. This phenomenon was attributed to different exchange coupling strengths at the AFM/AFM interface depending on the relative spin directions. Our results indicate a new route for modifying the spin configuration and ordering temperature of AFMs through the magnetic proximity effect near room temperature, which should further benefit the design of AFM spintronic devices.

  1. Antiferromagnetic proximity effect in epitaxial CoO/NiO/MgO(001) systems

    PubMed Central

    Li, Q.; Liang, J. H.; Luo, Y. M.; Ding, Z.; Gu, T.; Hu, Z.; Hua, C. Y.; Lin, H.-J.; Pi, T. W.; Kang, S. P.; Won, C.; Wu, Y. Z.

    2016-01-01

    Magnetic proximity effect between two magnetic layers is an important focus of research for discovering new physical properties of magnetic systems. Antiferromagnets (AFMs) are fundamental systems with magnetic ordering and promising candidate materials in the emerging field of antiferromagnetic spintronics. However, the magnetic proximity effect between antiferromagnetic bilayers is rarely studied because detecting the spin orientation of AFMs is challenging. Using X-ray linear dichroism and magneto-optical Kerr effect measurements, we investigated antiferromagnetic proximity effects in epitaxial CoO/NiO/MgO(001) systems. We found the antiferromagnetic spin of the NiO underwent a spin reorientation transition from in-plane to out-of-plane with increasing NiO thickness, with the existence of vertical exchange spring spin alignment in thick NiO. More interestingly, the Néel temperature of the CoO layer was greatly enhanced by the adjacent NiO layer, with the extent of the enhancement closely dependent on the spin orientation of NiO layer. This phenomenon was attributed to different exchange coupling strengths at the AFM/AFM interface depending on the relative spin directions. Our results indicate a new route for modifying the spin configuration and ordering temperature of AFMs through the magnetic proximity effect near room temperature, which should further benefit the design of AFM spintronic devices. PMID:26932164

  2. Antiferromagnetic proximity effect in epitaxial CoO/NiO/MgO(001) systems

    NASA Astrophysics Data System (ADS)

    Li, Q.; Liang, J. H.; Luo, Y. M.; Ding, Z.; Gu, T.; Hu, Z.; Hua, C. Y.; Lin, H.-J.; Pi, T. W.; Kang, S. P.; Won, C.; Wu, Y. Z.

    2016-03-01

    Magnetic proximity effect between two magnetic layers is an important focus of research for discovering new physical properties of magnetic systems. Antiferromagnets (AFMs) are fundamental systems with magnetic ordering and promising candidate materials in the emerging field of antiferromagnetic spintronics. However, the magnetic proximity effect between antiferromagnetic bilayers is rarely studied because detecting the spin orientation of AFMs is challenging. Using X-ray linear dichroism and magneto-optical Kerr effect measurements, we investigated antiferromagnetic proximity effects in epitaxial CoO/NiO/MgO(001) systems. We found the antiferromagnetic spin of the NiO underwent a spin reorientation transition from in-plane to out-of-plane with increasing NiO thickness, with the existence of vertical exchange spring spin alignment in thick NiO. More interestingly, the Néel temperature of the CoO layer was greatly enhanced by the adjacent NiO layer, with the extent of the enhancement closely dependent on the spin orientation of NiO layer. This phenomenon was attributed to different exchange coupling strengths at the AFM/AFM interface depending on the relative spin directions. Our results indicate a new route for modifying the spin configuration and ordering temperature of AFMs through the magnetic proximity effect near room temperature, which should further benefit the design of AFM spintronic devices.

  3. Phase relations and structural features in the system Ni-Zn-B

    SciTech Connect

    Malik, Z.; Grytsiv, A.; Rogl, P.; Giester, G.; Bursik, J.

    2013-02-15

    Phase relations for the system Ni-Zn-B have been established in the isothermal section at 800 Degree-Sign C based on X-ray powder diffraction and electron microprobe analyses of about 60 samples, which have been prepared by hot pressing of pre-annealed powder compacts of arc-melted master alloys Ni{sub x}B{sub y} and Zn-filings. Six ternary compounds (labeled {tau}{sub 1} to {tau}{sub 6}) were found to exist, which in some cases exhibit considerable mutual solid solubilities mostly as an exchange of Ni-Zn at constant B-content, but in the case of the so-called {tau}-phase {tau}{sub 1}-(Ni{sub 1-x}Zn{sub x}){sub 21}[Zn{sub 1-y-z}{open_square}{sub y}(B{sub 4}){sub z}]{sub 2}B{sub 6} (0.07{<=}x{<=}0.11, 0.07{<=}y{<=}0.53, 0{<=}z{<=}0.3) also with Zn/B substitution. Single crystal X-ray data analysis for the composition x=0.07, y=0.125, z=0.30, and a=1.05800(3) nm confirmed the Cr{sub 23}C{sub 6} type with space group Fm3{sup Macron }m, but revealed partial replacement of Zn-atoms by B{sub 4}-tetrahedra (R{sub F}=0.014). Whereas Ni/Zn exchange (at constant B-content) ranges at about 4-5 at% for {tau}{sub 4}-Ni{sub 3}ZnB{sub 2} and {tau}{sub 5}-Ni{sub 48}Zn{sub 32}B{sub 20}, it is below 3 at% for {tau}{sub 2}-Ni{sub 12}ZnB{sub 8-x} (x=0.43), {tau}{sub 3}-Ni{sub 21}Zn{sub 2}B{sub 20} and {tau}{sub 6}-Ni{sub 47}Zn{sub 23}B{sub 30}. The crystal structures of {tau}{sub 2}-Ni{sub 12}ZnB{sub 8-x} (x=0.43; Ni{sub 12}AlB{sub 8} type), {tau}{sub 3}-Ni{sub 21}Zn{sub 2}B{sub 20} (own type) and {tau}{sub 4}-Ni{sub 3}ZnB{sub 2} (own type) have been determined in our foregoing paper [8]. Due to the non-availability of suitable single crystals, the crystal structures of {tau}{sub 5}-Ni{sub 48}Zn{sub 32}B{sub 20} (body-centered orthorhombic; a=1.6(2) nm, b=0.63(7) nm, and c=0.27(0) nm, determined from TEM) and of {tau}{sub 6}-Ni{sub 47}Zn{sub 23}B{sub 30} have not been elucidated yet. Phase equilibria at 800 Degree-Sign C are dominated by a large three-phase field ({beta}B)+Ni{sub 2}Zn

  4. The As-Cu-Ni System: A Chemical Thermodynamic Model for Ancient Recycling

    NASA Astrophysics Data System (ADS)

    Sabatini, Benjamin J.

    2015-12-01

    This article is the first thermodynamically reasoned ancient metal system assessment intended for use by archaeologists and archaeometallurgists to aid in the interpretation of remelted/recycled copper alloys composed of arsenic and copper, and arsenic, copper, and nickel. These models are meant to fulfill two main purposes: first, to be applied toward the identification of progressive and regressive temporal changes in artifact chemistry that would have occurred due to recycling, and second, to provide thermodynamic insight into why such metal combinations existed in antiquity. Built on well-established thermodynamics, these models were created using a combination of custom-written software and published binary thermodynamic systems data adjusted to within the boundary conditions of 1200°C and 1 atm. Using these parameters, the behavior of each element and their likelihood of loss in the binaries As-Cu, As-Ni, Cu-Ni, and ternary As-Cu-Ni, systems, under assumed ancient furnace conditions, was determined.

  5. Highly efficient removal of chromium(VI) by Fe/Ni bimetallic nanoparticles in an ultrasound-assisted system.

    PubMed

    Zhou, Xiaobin; Jing, Guohua; Lv, Bihong; Zhou, Zuoming; Zhu, Runliang

    2016-10-01

    Highly active Fe/Ni bimetallic nanocomposites were prepared by using the liquid-phase reduction method, and they were proven to be effective for Cr(VI) removal coupled with US irradiation. The US-assisted Fe/Ni bimetallic system could maintain a good performance for Cr(VI) removal at a wide pH range of 3-9. Based on the characterization of the Fe/Ni nanoparticles before and after reaction, the high efficiency of the mixed system could attribute to the synergistic effects of the catalysis of Ni(0) and US cavitation. Ni(0) could facilitate the Cr(VI) reduction through electron transfer and catalytic hydrogenation. Meanwhile, US could fluidize the Fe/Ni nanoparticles to increase the actual reactive surface area and clean off the co-precipitated Fe(III)-Cr(III) hydroxides to maintain the active sites on the surface of the Fe/Ni nanoparticles. Thus, compared with shaking, the US-assisted Fe/Ni system was more efficient on Cr(VI) removal, which achieved 94.7% removal efficiency of Cr(VI) within 10 min. The pseudo-first-order rate constant (kobs) in US-assisted Fe/Ni system (0.5075 min(-1)) was over 5 times higher than that under shaking (0.0972 min(-1)). Moreover, the Fe/Ni nanoparticles still have a good performance under US irradiation after 26 days aging as well as regeneration. PMID:27393969

  6. Advanced thermal barrier system bond coatings for use on Ni, Co-, and Fe-base alloy substrates

    NASA Technical Reports Server (NTRS)

    Stecura, S.

    1985-01-01

    New and improved Ni-, Co-, and Fe-base bond coatings have been identified for the ZrO2-Y2O3 thermal barrier coatings to be used on NI-, Co-, and Fe-base alloy substrates. These bond coatings were evaluated in a cyclic furnace between 1120 and 1175 C. It was found that MCrAlYb (where M = Ni, Co, or Fe) bond coating thermal barrier systems. The longest life was obtained with the FeCrAlYb thermal barrier system followed by NiCrAlYb and CoCrAlYb thermal barrier systems in that order.

  7. Low temperature diffusion coefficients in the Fe-Ni and FeNiP systems: Application to meteorite cooling rates

    NASA Technical Reports Server (NTRS)

    Dean, D. C.; Goldstein, J. I.

    1984-01-01

    The interdiffusion coefficient of FeNi in fcc taenite (gamma) of Fe-Ni and Fe-Ni-0.2 P alloys was measured as a function of temperature between 600 and 900 C. This temperature range is directly applicable to the nucleation and growth of the Widmanstatten pattern in iron meteorites and metal regions of stony and stony-iron meteorites. Diffusion couples were made from FeNi or FeNiP alloys which ensured that the couples were in the taenite phase at the diffusion temperature. The presence or absence of grain boundary diffusion was determined by measuring the Ni profile normal to the existing grain boundaries with the AEM. Ignoring any variation of interdiffusion coefficient with composition, the measured data was plotted versus the reciprocal of the diffusion temperature. The FeNi data generally follow the extrapolated Goldstein, et al. (1965) data from high temperatures. The FeNiP data indicates that small additions of P (0.2 wt%) cause a 3 to 10 fold increase in the FeNi interdifussion coefficient increasing with decreasing temperature. This increase is about the same as that predicted by Narayan and Goldstein (1983) at the Widmanstatten growth temperature.

  8. Phase relations in Fe-Ni-C system at high pressures and temperatures

    SciTech Connect

    Narygina, O; Dubrovinsky, L S; Miyajima, N; McCammon, C A; Kantor, I Yu; Mezouar, M; Prakapenka, V B; Dubrovinskaia, N A; Dmitriev, V

    2012-10-23

    We performed comparative study of phase relations in Fe1-x Nix (0.10 ≤ x ≤ 0.22 atomic fraction) and Fe0.90Ni0.10-x Cx (0.1 ≤ x ≤ 0.5 atomic fraction) systems at pressures to 45 GPa and temperatures to 2,600 K using laser-heated diamond anvil cell and large-volume press (LVP) techniques. We show that laser heating of Fe,Ni alloys in DAC even to relatively low temperatures can lead to the contamination of the sample with the carbon coming from diamond anvils, which results in the decomposition of the alloy into iron- and nickel-rich phases. Based on the results of LVP experiments with Fe-Ni-C system (at pressures up to 20 GPa and temperatures to 2,300 K) we demonstrate decrease of carbon solubility in Fe,Ni alloy with pressure.

  9. Atomic-scale study of in situ metal nanoparticle synthesis in a Ni/TiO2 system.

    PubMed

    Li, Peng; Liu, Jingyue; Nag, Nabin; Crozier, Peter A

    2005-07-28

    The nucleation and evolution of Ni nanoparticles during reduction of a Ni(NO3)2.6H2O precursor supported on a commercial titania substrate have been studied in situ at atomic resolution using environmental transmission electron microscopy. An incipient wetness technique was used to prepare the starting unreduced material (10 wt % Ni precursor on titania). The Ni precursor, before reduction, shows a nonuniform distribution over the titania support. It is observed that upon reduction, the initial Ni "seed" crystal nucleates within the precursor patch. The distribution and size of the Ni nanoparticles thus generated are influenced by the distribution and size of the precursor patches. In this system, we see no evidence of preferential nucleation of Ni particles on anatase or rutile. At 350 degrees C with CO as the reducing agent, the {111} surface facets of the Ni nanoparticles are predominant during the initial stage of nucleation and growth. However, the {111} facets are partially consumed with time, indicating that they are not thermodynamically favored in the CO atmosphere. In CO and H2 atmospheres, Ni particles show a nonwetting morphology on titania, while in a mild oxidizing environment, a thin layer of NiOx is formed, thus giving rise to a morphology that is indicative of wetting of the support. This work provides fundamental information on understanding and controlling the important parameters involved in the preparation of a well-designed supported Ni catalyst using the incipient wetness technique.

  10. The Pd2Si - /Pd/ - Ni - solder plated metallization system for silicon solar cells

    NASA Technical Reports Server (NTRS)

    Coleman, M. G.; Pryor, R. A.; Sparks, T. G.

    1978-01-01

    The rationale and application of a plated metal system, Pd2Si Pd - Ni - solder, is presented. This metallization system is particularly useful on shallow p-n junction solar cells. The advantages of such plated solar cell contacts are discussed. A process sequence for applying the metallization system is outlined. A specific example is presented, including chemical plating solution formulations and detailed process step descriptions. Electrical test data for solar cells metallized with the palladium-nickel-solder system are provided.

  11. NiSi formation at the silicide/Si interface on the NiPt/Si system

    NASA Astrophysics Data System (ADS)

    Ottaviani, G.; Tu, K. N.; Chu, W. K.; Hung, L. S.; Mayer, J. W.

    1982-07-01

    Alloy films of NiPt were e-beam codeposited on n-type Si and annealed up to 700 °C in a purified- He ambient furnace. Silicide formation was monitored using MeV4 He Rutherford backscattering and glancing-angle x-ray diffraction. At low temperatures (300-350 °C), Ni segregates at the Si/ silicide interface and the first phases detected are NiSi and PtSi. At intermediate temperatures (400- 500 °C), there is further accumulation of Ni at the Si/silicide interface, and at later stages an incursion of Pt to the interface. The barrier height increase reflects the presence of Pt. At 700 °C, the Ni and Pt redistribute to form a uniform ternary.

  12. Functionally gradient material of the system Ni-MgO, Ni-NiO, Ni-Si3N4 or Al-AlN, by pressureless sintering

    SciTech Connect

    Atarashiya, Koji; Kurokawa, Kazuya; Nagai, Tadao; Uda, Masahiro

    1992-08-01

    Generally speaking, the preparation of FGM-blocks, especially in the metal-nitride systems, by the method of powder metallurgy needs an extremely high temperature and high pressure. But, in this work using a ductile nickel metal powder or an ultrafine particle, the FGM-blocks were easily prepared using a powder metallurgy at a lower temperature. A mixture of a metallic powder and a non-metallic powder whose contents were gradually changed was pressed in a steel die under pressure of 20-32 MPa. These green compacts were heated at 900-1573 K in controlled atmosphere under null pressure. The FGM-blocks prepared by this method were characterized by their properties and were used in joinings. The joinings of metal/FGM/ceramics, metal/FGM and ceramics/FGM were completely accomplished at 900-1573 K. 6 refs.

  13. Phase transitions in coprecipitated NiO-WO/sub 3/ system in calcination, reduction, and sulfiding

    SciTech Connect

    Agievskii, D.A.; Pavlova, L.I.; Landau, M.V.; Kvashonkin, V.I.; Chukin, G.D.

    1986-04-01

    X-ray diffraction and electron microscopy have been used in an investigation of the shaping of phase composition and structure of a coprecipitated NiO-WO/sub 3/ system in calcination, reduction, and sulfiding. It has been shown that calcination, when it leads to the formation of crystalline NiWO/sub 4/, lowers the efficiency of reduction and sulfiding to a considerable degree. A step-temperature sulfiding operation, in comparison with isothermal sulfiding, gives a less ordered structure of the WS/sub 2/, with loose packing of the particles into agglomerates.

  14. Direct Metal Deposition by Laser in TiNi-Al System for Graded Structure Fabrication

    NASA Astrophysics Data System (ADS)

    Shishkovsky, I.; Kakovkina, N.; Missemer, F.

    2016-07-01

    Intermetallic phase formation was studied in powdered TiNi-Al system under layerwise laser cladding with the aim of forming a gradient of properties due to a change in the concentration relation of Al in the NiTi powder mixture from one layer to another. The relationship between the laser cladding parameters and the intermetallic phase structures in consecutively cladded layers were determined. The structure of intermetallic compounds formed by laser synthesis was studied by optical microscopy, measurement of microhardness, SEM with EDX analysis. Microhardness doubling from 500 HV to 1000 HV was achieved due to nitinol matrix enrichment by Al, which is promising for aerospace applications.

  15. Magnetic transition in NiPt alloy systems: experiment and theory

    NASA Astrophysics Data System (ADS)

    Kumar, Uday; Padmalekha, K. G.; Mukhopadhyay, P. K.; Paudyal, Durga; Mookerjee, Abhijit

    2005-04-01

    We report here the preparation and measurements on the susceptibility, sound velocity and internal friction for NiPt systems. We then compare these experimental results with the first principle theoretical predictions and show that there is reasonable agreement with experiment and theory.

  16. Reaction diffusion in the NiCrAl and CoCrAl systems

    NASA Technical Reports Server (NTRS)

    Levine, S. R.

    1978-01-01

    The paper assesses the effect of overlay coating and substrate composition on the kinetics of coating depletion by interdiffusion. This is accomplished by examining the constitution, kinetics and activation energies for a series of diffusion couples primarily of the NiCrAl/Ni-10Cr or CoCrAl/Ni-10Cr type annealed at temperatures in the range 1000-1205 C for times up to 500 hr. A general procedure is developed for analyzing diffusion in multicomponent multiphase systems. It is shown that by introducing the concept of beta-source strength, which can be determined from appropriate phase diagrams, the Wagner solution for consumption of a second phase in a semiinfinite couple is successfully applied to the analysis of MCrAl couples. Thus, correlation of beta-recession rate constants with couple composition, total and diffusional activation energies, and interdiffusion coefficients are determined.

  17. Experimental study and thermodynamic modeling of the Al-Co-Cr-Ni system

    NASA Astrophysics Data System (ADS)

    Gheno, Thomas; Liu, Xuan L.; Lindwall, Greta; Liu, Zi-Kui; Gleeson, Brian

    2015-10-01

    A thermodynamic database for the Al-Co-Cr-Ni system is built via the Calphad method by extrapolating re-assessed ternary subsystems. A minimum number of quaternary parameters are included, which are optimized using experimental phase equilibrium data obtained by electron probe micro-analysis and x-ray diffraction analysis of NiCoCrAlY alloys spanning a wide compositional range, after annealing at 900 °C, 1100 °C and 1200 °C, and water quenching. These temperatures are relevant to oxidation and corrosion resistant MCrAlY coatings, where M corresponds to some combination of nickel and cobalt. Comparisons of calculated and measured phase compositions show excellent agreement for the β-γ equilibrium, and good agreement for three-phase β-γ-σ and β-γ-α equilibria. An extensive comparison with existing Ni-base databases (TCNI6, TTNI8, NIST) is presented in terms of phase compositions.

  18. Thermodynamic Modeling of Poorly Complexing Metals in Concentrated Electrolyte Solutions: An X-Ray Absorption and UV-Vis Spectroscopic Study of Ni(II) in the NiCl2-MgCl2-H2O System

    PubMed Central

    Zhang, Ning; Brugger, Joël; Etschmann, Barbara; Ngothai, Yung; Zeng, Dewen

    2015-01-01

    Knowledge of the structure and speciation of aqueous Ni(II)-chloride complexes is important for understanding Ni behavior in hydrometallurgical extraction. The effect of concentration on the first-shell structure of Ni(II) in aqueous NiCl2 and NiCl2-MgCl2 solutions was investigated by Ni K edge X-ray absorption (XAS) and UV-Vis spectroscopy at ambient conditions. Both techniques show that no large structural change (e.g., transition from octahedral to tetrahedral-like configuration) occurs. Both methods confirm that the Ni(II) aqua ion (with six coordinated water molecules at RNi-O = 2.07(2) Å) is the dominant species over the whole NiCl2 concentration range. However, XANES, EXAFS and UV-Vis data show subtle changes at high salinity (> 2 mol∙kg-1 NiCl2), which are consistent with the formation of small amounts of the NiCl+ complex (up to 0.44(23) Cl at a Ni-Cl distance of 2.35(2) Å in 5.05 mol∙kg-1 NiCl2) in the pure NiCl2 solutions. At high Cl:Ni ratio in the NiCl2-MgCl2-H2O solutions, small amounts of [NiCl2]0 are also present. We developed a speciation-based mixed-solvent electrolyte (MSE) model to describe activity-composition relationships in NiCl2-MgCl2-H2O solutions, and at the same time predict Ni(II) speciation that is consistent with our XAS and UV-Vis data and with existing literature data up to the solubility limit, resolving a long-standing uncertainty about the role of chloride complexing in this system. PMID:25885410

  19. Thermodynamic modeling of poorly complexing metals in concentrated electrolyte solutions: an X-ray absorption and UV-Vis spectroscopic study of Ni(II) in the NiCl2-MgCl2-H2O system.

    PubMed

    Zhang, Ning; Brugger, Joël; Etschmann, Barbara; Ngothai, Yung; Zeng, Dewen

    2015-01-01

    Knowledge of the structure and speciation of aqueous Ni(II)-chloride complexes is important for understanding Ni behavior in hydrometallurgical extraction. The effect of concentration on the first-shell structure of Ni(II) in aqueous NiCl2 and NiCl2-MgCl2 solutions was investigated by Ni K edge X-ray absorption (XAS) and UV-Vis spectroscopy at ambient conditions. Both techniques show that no large structural change (e.g., transition from octahedral to tetrahedral-like configuration) occurs. Both methods confirm that the Ni(II) aqua ion (with six coordinated water molecules at RNi-O = 2.07(2) Å) is the dominant species over the whole NiCl2 concentration range. However, XANES, EXAFS and UV-Vis data show subtle changes at high salinity (> 2 mol∙kg(-1) NiCl2), which are consistent with the formation of small amounts of the NiCl+ complex (up to 0.44(23) Cl at a Ni-Cl distance of 2.35(2) Å in 5.05 mol∙kg(-1) NiCl2) in the pure NiCl2 solutions. At high Cl:Ni ratio in the NiCl2-MgCl2-H2O solutions, small amounts of [NiCl2]0 are also present. We developed a speciation-based mixed-solvent electrolyte (MSE) model to describe activity-composition relationships in NiCl2-MgCl2-H2O solutions, and at the same time predict Ni(II) speciation that is consistent with our XAS and UV-Vis data and with existing literature data up to the solubility limit, resolving a long-standing uncertainty about the role of chloride complexing in this system.

  20. Thermodynamic modeling of poorly complexing metals in concentrated electrolyte solutions: an X-ray absorption and UV-Vis spectroscopic study of Ni(II) in the NiCl2-MgCl2-H2O system.

    PubMed

    Zhang, Ning; Brugger, Joël; Etschmann, Barbara; Ngothai, Yung; Zeng, Dewen

    2015-01-01

    Knowledge of the structure and speciation of aqueous Ni(II)-chloride complexes is important for understanding Ni behavior in hydrometallurgical extraction. The effect of concentration on the first-shell structure of Ni(II) in aqueous NiCl2 and NiCl2-MgCl2 solutions was investigated by Ni K edge X-ray absorption (XAS) and UV-Vis spectroscopy at ambient conditions. Both techniques show that no large structural change (e.g., transition from octahedral to tetrahedral-like configuration) occurs. Both methods confirm that the Ni(II) aqua ion (with six coordinated water molecules at RNi-O = 2.07(2) Å) is the dominant species over the whole NiCl2 concentration range. However, XANES, EXAFS and UV-Vis data show subtle changes at high salinity (> 2 mol∙kg(-1) NiCl2), which are consistent with the formation of small amounts of the NiCl+ complex (up to 0.44(23) Cl at a Ni-Cl distance of 2.35(2) Å in 5.05 mol∙kg(-1) NiCl2) in the pure NiCl2 solutions. At high Cl:Ni ratio in the NiCl2-MgCl2-H2O solutions, small amounts of [NiCl2]0 are also present. We developed a speciation-based mixed-solvent electrolyte (MSE) model to describe activity-composition relationships in NiCl2-MgCl2-H2O solutions, and at the same time predict Ni(II) speciation that is consistent with our XAS and UV-Vis data and with existing literature data up to the solubility limit, resolving a long-standing uncertainty about the role of chloride complexing in this system. PMID:25885410

  1. Reaction dynamics studies for the system 7Be+58Ni

    NASA Astrophysics Data System (ADS)

    Torresi, D.; Mazzocco, M.; Acosta, L.; Boiano, A.; Boiano, C.; Diaz-Torres, A.; Fierro, N.; Glodariu, T.; Grilj, L.; Guglielmetti, A.; Keeley, N.; La Commara, M.; Martel, I.; Mazzocchi, C.; Molini, P.; Pakou, A.; Parascandolo, C.; Parkar, V. V.; Patronis, N.; Pierroutsakou, D.; Romoli, M.; Rusek, K.; Sanchez-Benitez, A. M.; Sandoli, M.; Signorini, C.; Silvestri, R.; Soramel, F.; Stiliaris, E.; Strano, E.; Stroe, L.; Zerva, K.

    2015-04-01

    The study of reactions induced by exotic weakly bound nuclei at energies around the Coulomb barrier had attracted a large interest in the last decade, since the features of these nuclei can deeply affect the reaction dynamics. The discrimination between different reaction mechanisms is, in general, a rather difficult task. It can be achieved by using detector arrays covering high solid angle and with high granularity that allow to measure the reaction products and, possibly, coincidences between them, as, for example, recently done for stable weakly bound nuclei [1, 2]. We investigated the collision of the weakly bound nucleus 7Be on a 58Ni target at the beam energy of 1.1 times the Coulomb barrier, measuring the elastic scattering angular distribution and the energy and angular distributions of 3He and 4He. The 7Be radioactive ion beam was produced by the facility EXOTIC at INFN-LNL with an energy of 22 MeV and an intensity of ~3×105 pps. Results showed that the 4He yeld is about 4 times larger than 3He yield, suggesting that reaction mechanisms other than the break-up mostly produce the He isotopes. Theoretical calculations for transfer channels and compound nucleus reactions suggest that complete fusion accounts for (41±5%) of the total reaction cross section extracted from optical model analysis of the elastic scattering data, and that 3He and 4He stripping are the most populated reaction channels among direct processes. Eventually estimation of incomplete fusion contributions to the 3,4He production cross sections was performed through semi-classical calculations with the code PLATYPUS [3].

  2. Evolution of quantum criticality in the system CeNi9Ge4

    NASA Astrophysics Data System (ADS)

    Michor, H.; Adroja, D. T.; Hillier, A. D.; Koza, M. M.; Manalo, S.; Gold, C.; Peyker, L.; Scheidt, E.-W.

    2012-03-01

    The heavy fermion system CeNi9Ge4 exhibits a paramagnetic ground state with remarkable features such as: a record value of the electronic specific heat coefficient in systems with a paramagnetic ground state, γ = C/T simeq 5.5 J/molK2 at 80 mK, a temperature-dependent Sommerfeld-Wilson ratio, R = χ/γ, below 1 K and an approximate single ion scaling of the 4f-magnetic specific heat and susceptibility. These features are related to a rather small Kondo energy scale of a few Kelvin in combination with a quasi-quartet crystal field ground state. Tuning the system towards long range magnetic order is accomplished by replacing a few at.% of Ni by Cu or Co. Specific heat, susceptibility and resistivity studies reveal TN ~ 0.2 K for CeNi8CuGe4 and TN ~ 1K for CeNi8CoGe4. To gain insight whether the transition from the paramagnetic NFL state to the magnetically ordered ground state is connected with a heavy fermion quantum critical point we performed specific heat and ac susceptibility studies and utilized the μSR technique and quasi-elastic neutron scattering.

  3. Analysis of the proximity effect and the interface transparency with perpendicular current in Ni/Nb system

    NASA Astrophysics Data System (ADS)

    Huang, S. Y.; Chiu, Y. C.; Liang, J. J.; Lin, L. K.; Tsai, T. C.; Hsu, S. Y.; Lee, S. F.

    2009-04-01

    We quantitatively study the interface resistance in Ni/Nb multilayers fabricated by sputtering system. For a fixed Ni layer thickness in Ni/Nb/Ni trilayers, the superconducting temperature Tc decreases with decreasing Nb thickness. By analyzing the data with the proximity effect, the critical thickness below which superconductivity vanished was deduced. From current perpendicular to plane (CPP) measurement interpreted with a one-band series-resistor model, we obtained the CPP resistivities of Nb and Ni and the unit area resistances of 4.2±0.2 and 1.5±0.4 fΩ m2 for superconducting and normal Ni/Nb interfaces. The transparency parameter is directly calculated in terms of interface resistance.

  4. Orbital management and design considerations for NiCd satellite power systems

    NASA Technical Reports Server (NTRS)

    Tausch, Benjamin J., II

    1994-01-01

    Several recently manufactured 50 and 60 ampere hour aerospace NiCd battery cell lots, produced by Gates Aerospace Batteries, are prone to premature on orbit performance degradation. The failure mechanism is cadmium migration, and the consequent development of soft shorts. A Martin Marietta Astronautics satellite program instituted an orbital management strategy for a set of these batteries that reduced the rate of degradation and brought the system to stable operation. This strategy involves: (1) minimizing the accumulated battery overcharge; (2) regular discharge exercises; and (3) periodic battery reconditioning. Because of changes in the NiCd cell manufacturing process, the actual performance of subsequent lots of NiCd cells is open to question. Future NiCd based power system designs should therefore allow for fine control of charge parameters, and an on orbit battery reconditioning capability. To minimize risk, it is much better to perform a full life test to qualify the cells before launch, rather than in parallel with orbital operations. If there are any changes in the manufacturing process of cells, it is extremely important to maintain very strong cognizance of secondary subcontractors, recognizing that the cell and battery manufacturing discipline is easily atrophied.

  5. Preparation and electrical properties of Ni-Cu-Zn system doped with the magnesium oxide

    NASA Astrophysics Data System (ADS)

    Hemeda, O. M.; Tawfik, A.; Hemeda, D. M.; Elsheekh, A. M.

    2014-06-01

    A sery of ferrite samples, Ni0.1Cu0.2MgxZn0.7-xFe2O4, (x = 0.00, 0.15, 0.25, 0.35, 0.45, 0.55 and 0.70) have been prepared by the standard ceramic techniques, sintered at 1200°C for 2 h, and their crystalline structures were investigated by using X-ray diffraction, which confirmed the formation of Ni0.1Cu0.2MgxZn0.7-xFe2O4 phase. The presence of Mg content increases the crystallinity of the given ferrite which is considered as catalyst for the accomplishment of the solid state reaction. The lattice parameter and crystallite size were calculated from XRD. The cationic distribution was estimated from the theoretical values of lattice parameters. The IR spectra analysis has been studied. The dielectric constant for the ferrite system Ni-Cu-Zn gradually increases with temperature up to nearly Curie temperature and then increase sharply beyond the Tc. The Curie temperature obtained from the ´ ǎrepsilon versus T is in agreement with the Curie temperature obtained from other measurements. Dielectric loss tangent (tan δ) has the same behavior as dielectric constant (´ ǎrepsilon). A minimum value of dielectric loss tangent (tan δ) for the system "Ni-Cu-Zn" was observed at x = 0.45. Magnetic permeability has been studied. The dependence of initial permeability on temperature exhibit a peak which is called Hopkinson peak (HP) in the vicinity of Curie temperature and confirmed the phase purity of ferrite sample. The increasing of porosity and decreasing of grain size play an important role in decreasing μi. It is clear that the value of Tc is found to increase by increasing the concentration of diamagnetic substitution Mg for "Ni-Cu-Zn" system.

  6. Phase equilibria and structural investigations in the Ni-poor part of the system Al–Ge–Ni

    PubMed Central

    Reichmann, Thomas L.; Duarte, Liliana I.; Effenberger, Herta S.; Leinenbach, Christian; Richter, Klaus W.

    2012-01-01

    The ternary phase diagram Al–Ge–Ni was investigated between 0 and 50 at.% Ni by a combination of differential thermal analysis (DTA), powder- and single-crystal X-ray diffraction (XRD), metallography and electron probe microanalysis (EPMA). Ternary phase equilibria and accurate phase compositions of the equilibrium phases were determined within two partial isothermal sections at 400 and 700 °C, respectively. The two binary intermediate phases AlNi and Al3Ni2 were found to form extended solid solutions with Ge in the ternary. Three new ternary phases were found to exist in the Ni-poor part of the phase diagram which were designated as τ1 (oC24, CoGe2-type), τ2 (at approximately Al67.5Ge18.0Ni14.5) and τ3 (cF12, CaF2-type). The ternary phases show only small homogeneity ranges. While τ1 was investigated by single crystal X-ray diffraction, τ2 and τ3 were identified from their powder diffraction pattern. Ternary phase reactions and melting behaviour were studied by means of DTA. A total number of eleven invariant reactions could be derived from these data, which are one ternary eutectic reaction, six transition reactions, three ternary peritectic reactions and one maximum. Based on the measured DTA values three vertical sections at 10, 20 and 35 at.% Ni were constructed. Additionally, all experimental results were combined to a ternary reaction scheme (Scheil diagram) and a liquidus surface projection. PMID:27087753

  7. Graphene as a diffusion barrier for isomorphous systems: Cu-Ni system

    NASA Astrophysics Data System (ADS)

    Roy, Apurba; Punith Kumar, M. K.; Srivastava, Chandan

    2016-02-01

    Electrochemical exfoliation technique using the pyrophosphate anion derived from tetra sodium pyrophosphate was employed to produce graphene. As-synthesized graphene was then drop dried over a cold rolled Cu sheet. Ni coating was then electrodeposited over bare Cu and graphene-Cu substrates. Both substrates were then isothermally annealed at 800 °C for 3 h. WDS analysis showed substantial atomic diffusion in annealed Ni-Cu sample. Cu-graphene-Ni sample, on the other hand, showed negligible diffusion illustrating the diffusion barrier property of the graphene coating.

  8. Atomistic simulations of dislocation-interface interactions in the Cu-Ni multilayer system

    NASA Astrophysics Data System (ADS)

    Rao, S. I.; Hazzledine, P. M.

    2000-09-01

    Experimental results show that a nanolayered composite structure made of two kinds of metals strengthens dramatically as the layer thickness is reduced. In epitaxial systems, this strengthening has been attributed to the modulus, lattice parameter, gamma surface and slip-plane mismatches between adjacent layers. The modulus mismatch (the Koehler barrier) introduces a force between a dislocation and its image in the interface. The lattice parameter mismatch generates oscillating coherency stresses and van der Merwe misfit dislocations at or near the interfaces, which interact with mobile dislocations. The gamma surface (chemical) mismatch introduces a localized force on gliding dislocations due to core energy changes at or near the interfaces. Slip-plane misorientations across the interfaces require mobile screw dislocations to cross-slip for slip transmission and other dislocations to leave a difference dislocation at the interface. In this paper, atomistic simulations using the embedded-atom method are used to study the four components of dislocation-interface interactions in epitaxial Cu-Ni multilayers in a systematic fashion. The interaction of misfit dislocations with mobile dislocations is modelled using continuum theory. In thick Cu-Ni bilayers, the Koehler barrier is almost independent of interface orientation and dislocation character and is equal to 0.01mu 0.015mu but, when the layer thickness is comparable with the core width of a dislocation, the Koehler barrier falls rapidly (from 0.01mu at a wavelength of 10 nm to 0.004mu at 1.75 nm). This behaviour is in accordance with available experimental observations in the literature on the yield of epitaxial Cu-Ni multilayered systems. The gamma surface mismatch or chemical strengthening component of the blocking strength of Cu-Ni interfaces to (a/2)𘜎¢ screw dislocations is 0.003mu, a factor of three lower than the Koehler stress. Coherency stresses, apart from exerting direct forces on dislocations

  9. Influence of Ni/Mo ratio on structural and electrical properties of double perovskite system Sr2Ni1+ x Mo1- x O6- δ

    NASA Astrophysics Data System (ADS)

    Kumar, Pravin; Singh, Nitish Kumar; Singh, Rajesh Kumar; Singh, Prabhakar

    2015-11-01

    Technologically important double perovskite system Sr2Ni1+ x Mo1- x O6- δ with x = 0.00, 0.05, 0.10, and 0.15 was prepared by solution combustion method. The structural and the Rietveld analysis of compositions revealed the formation of double perovskite tetragonal phase Sr2NiMoO6 with space group I4/m as a major phase. SrMoO4 and NiO were also observed as minor phases. Microstructural studies depicted the formation of uniform grains for all the samples. The average grain size was found to lie between the ranges of 1-4 μm. XPS analysis of the synthesized compositions showed the decreasing ratio of Mo5+ to Mo6+ ions in the system with increasing Ni content, which played an important role in the conduction mechanism. The thermal expansion coefficient (TEC) of all compositions indicated that it is more compatible to the TEC of standard electrolytes. The electrical conductivity for all the compositions was studied using impedance spectroscopy in the temperature range 200-600 °C. Composition with x = 0.05 showed better electrical conductivity with good catalytic activity.

  10. Influence of Ni nanoparticle addition and spark plasma sintering on the TiNiSn–Ni system: Structure, microstructure, and thermoelectric properties

    SciTech Connect

    Birkel, Christina S.; Douglas, Jason E.; Lettiere, Bethany R.; Seward, Gareth; Zhang, Yichi; Pollock, Tresa M.; Seshadri, Ram; Stucky, Galen D.

    2013-12-01

    The electronic and thermal properties of thermoelectric materials are highly dependent on their microstructure and therefore on the preparation conditions, including the initial synthesis and, if applicable, densification of the obtained powders. Introduction of secondary phases on the nano- and/or microscale is widely used to improve the thermoelectric figure of merit by reduction of the thermal conductivity. In order to understand the effect of the preparation technique on structure and properties, we have studied the thermoelectric properties of the well-known half-Heusler TiNiSn with addition of a small amount of nickel nanoparticles. The different parameters are the initial synthesis (levitation melting and microwave heating), the amount of nickel nanoparticles added and the exact pressing profile using spark plasma sintering. The resulting materials have been characterized by synchrotron X-ray diffraction and microprobe measurements and their thermoelectric properties are investigated. We found the lowest (lattice) thermal conductivity in samples with full-Heusler TiNi2Sn and Ni3Sn4 as secondary phases.

  11. Monte Carlo calculation of backscattering factor for Ni C multilayer system

    NASA Astrophysics Data System (ADS)

    Zommer, Ludomir; Jablonski, Alexander; Kotis, László; Menyhárd, Miklós

    2008-08-01

    Auger electron spectroscopy (AES) depth profiles using the NiMVV (61 eV), CKLL (272 eV) and NiLMM (848 eV) lines were recorded for a 3 × (Ni(40 nm)/C(28 nm))/Si substrate sample. It was found that the Auger intensities corresponding to pure regions of the depth profile changed with depth. The behaviour of the change was different for the different layers and different Auger lines. The changes can be attributed to the change in the backscattering factor (BF) as the thickness of the sample changes due to the sputter removal. Zommer and Jablonski developed a Monte Carlo (MC) algorithm to calculate the BF for systems with a buried layer. This algorithm was applied to the present case; the intensities of the monitored Auger lines were calculated for the sample with decreasing thickness similarly to the Auger depth profiling. The agreement between the measured and calculated AES depth profiles is excellent. The MC calculation verifies that several layers contribute to the BF and thus the expressions developed for overlayer/substrate systems cannot be used.

  12. Electronic structure of Zr-Ni-Sn systems: role of clustering and nanostructures in half-Heusler and Heusler limits.

    PubMed

    Do, Dat T; Mahanti, S D; Pulikkoti, Jiji J

    2014-07-01

    Half-Heusler and Heusler compounds have been of great interest for several decades for thermoelectric, magnetic, half-metallic and many other interesting properties. Among these systems, Zr-Ni-Sn compounds are interesting thermoelectrics which can go from semiconducting half-Heusler (HH) limit, ZrNiSn, to metallic Heusler (FH) limit, ZrNi2Sn. Recently Makongo et al (2011 J. Am. Chem. Soc. 133 18843) found that dramatic improvement in the thermoelectric power factor of HH can be achieved by putting excess Ni into the system. This was attributed to an energy filtering mechanism due to the presence of FH nanostructures in the HH matrix. Using density functional theory we have investigated clustering and nanostructure formation in ZrNi1+xSn (0 ⩽ x ⩽ 1) systems near the HH (x = 0) and FH (x = 1) ends and have found that excess Ni atoms in HH tend to stay close to each other and form nanoclusters. On the other hand, there is competing interaction between Ni-vacancies occupying different sites in FH which prevents them from forming vacancy nanoclusters. Effects of nano-inclusions on the electronic structure near HH and FH ends are discussed.

  13. Reaction studies near the barrier for medium heavy systems: Ni + Sn

    SciTech Connect

    Henning, W.

    1985-01-01

    Cross sections for elastic and inelastic scattering, single- and multi-nucleon transfer, fusion followed by particle evaporation leaving an evaporation residue, and fusion followed by fission have been measured for /sup 58/ /sup 64/Ni beams incident on even Sn targets at energies from below to above the Coulomb barrier. The Ni beams were provided by the Argonne Superconducting Linac. The aim of these measurements is a comprehensive study of the reaction systematics in a medium-heavy collision system. At present, a small fraction of the data has been fully analyzed and published, a larger part is presently being compared to model calculations. Some of the data needs to be confirmed by additional measurements. This summary should be viewed as a status report and an attempt to formulate some of the open questions. 9 references.

  14. Paramagnons in the PrNi system with an induced magnetic moment

    SciTech Connect

    Tiden, N. N. Clement'ev, E. S.; Alekseev, P. A.; Gvasaliya, S. N.; Nefedova, E. V.; Lazukov, V. N.; Sadikov, I. P.

    2006-12-15

    The recent studies of the PrNi system have shown that, at a temperature slightly higher than the ferromagnetic ordering temperature (T{sub C} {approx} 21 K), softening of some part of magnetic excitations occurs near the {gamma} point of the Brillouin zone. The magnetic modes observed have been qualitatively described by a model taking into account the crystal field and the exchange interaction within the mean-field random-phase approximation. To refine the model parameters and obtain a complete set of excitation modes, inelastic neutron scattering measurements on PrNi single crystals and polycrystals have been performed at T = 23 K. An acoustic branch related to the level with high excitation energy has been observed for the first time. The character of its dispersion suggests that the low-energy acoustic mode is responsible for the magnetic phase transition.

  15. NiCoBP-doped carbon nanotube hybrid: a novel oxidase mimetic system for highly efficient electrochemical immunoassay.

    PubMed

    Zhang, Bing; He, Yu; Liu, Bingqian; Tang, Dianping

    2014-12-01

    NiCoBP-doped multi-walled carbon nanotube (NiCoBP-MWCNT) was first synthesized by using induced electroless-plating method and functionalized with the biomolecules for highly efficient electrochemical immunoassay of prostate-specific antigen (PSA, used as a model analyte). We discovered that the as-synthesized NiCoBP-MWCNT had the ability to catalyze the glucose oxidization with a stable and well-defined redox peak. The catalytic current increased with the increment of the immobilized NiCoBP-MWCNT on the electrode. Transmission electron microscope (TEM) and energy dispersive X-ray spectrometry (EDX) were employed to characterize the as-prepared NiCoBP-MWCNT. Using the NiCoBP-MWCNT-conjugated anti-PSA antibody as the signal-transduction tag, a new enzyme-free electrochemical immunoassay protocol could be designed for the detection of target PSA on the capture antibody-functionalized immunosensing interface. Experimental results revealed that the designed immunoassay system could exhibit good electrochemical responses toward target PSA, and allowed the detection of PSA at a concentration as low as 0.035ngmL(-1). More importantly, the NiCoBP-MWCNT-based oxidase mimetic system could be further extended for the monitoring of other low-abundance proteins or disease-related biomarkers by tuning the target antibody.

  16. Experimental study and thermodynamic modeling of the Al–Co–Cr–Ni system

    DOE PAGES

    Gheno, Thomas; Liu, Xuan L.; Lindwall, Greta; Liu, Zi -Kui; Gleeson, Brian

    2015-09-21

    In this study, a thermodynamic database for the Al–Co–Cr–Ni system is built via the Calphad method by extrapolating re-assessed ternary subsystems. A minimum number of quaternary parameters are included, which are optimized using experimental phase equilibrium data obtained by electron probe micro-analysis and x-ray diffraction analysis of NiCoCrAlY alloys spanning a wide compositional range, after annealing at 900 °C, 1100 °C and 1200 °C, and water quenching. These temperatures are relevant to oxidation and corrosion resistant MCrAlY coatings, where M corresponds to some combination of nickel and cobalt. Comparisons of calculated and measured phase compositions show excellent agreement for themore » β–γ equilibrium, and good agreement for three-phase β–γ–σ and β–γ–α equilibria. An extensive comparison with existing Ni-base databases (TCNI6, TTNI8, NIST) is presented in terms of phase compositions.« less

  17. Directional solidification processing of eutectic alloys in the Ni Al V system

    NASA Astrophysics Data System (ADS)

    Milenkovic, S.; Coelho, A. A.; Caram, R.

    2000-04-01

    Intermetallic matrix composites (IMCs) offer attractive properties, such as high toughness of the metal coupled with low density, high modulus and high strength of the intermetallics. Among a large number of the intermetallics, a particular interest has been shown in the NiAl intermetallic compound, since it exhibits several advantages over the currently used nickel-based superalloys. Recently, there has been a renewed interest in directional solidification of the eutectic alloys as a concept of reinforcing intermetallics with in situ refractory metals. The present study is related to the study of the eutectic alloys in the ternary NiAl-V system. The eutectic composition and temperature were accurately determined. It was concluded that the solidification behaviour of the Ni-Al-V eutectic is strongly dependent on the growth conditions, namely growth rate and orientation, and that it can be easily modified. Also, it was observed that the orientation of the grain, i.e., the direction of growth is the determining factor in the lamellar/rod transition as well as in the morphology of the degenerated structure.

  18. Experimental study and thermodynamic modeling of the Al–Co–Cr–Ni system

    SciTech Connect

    Gheno, Thomas; Liu, Xuan L.; Lindwall, Greta; Liu, Zi -Kui; Gleeson, Brian

    2015-09-21

    In this study, a thermodynamic database for the Al–Co–Cr–Ni system is built via the Calphad method by extrapolating re-assessed ternary subsystems. A minimum number of quaternary parameters are included, which are optimized using experimental phase equilibrium data obtained by electron probe micro-analysis and x-ray diffraction analysis of NiCoCrAlY alloys spanning a wide compositional range, after annealing at 900 °C, 1100 °C and 1200 °C, and water quenching. These temperatures are relevant to oxidation and corrosion resistant MCrAlY coatings, where M corresponds to some combination of nickel and cobalt. Comparisons of calculated and measured phase compositions show excellent agreement for the β–γ equilibrium, and good agreement for three-phase β–γ–σ and β–γ–α equilibria. An extensive comparison with existing Ni-base databases (TCNI6, TTNI8, NIST) is presented in terms of phase compositions.

  19. Solution-based thermodynamic modeling of the Ni-Al-Mo system using first-principles calculations

    SciTech Connect

    Zhou, S H; Wang, Y; Chen, L -Q; Liu, Z -K; Napolitano, R E

    2014-09-01

    A solution-based thermodynamic description of the ternary Ni–Al–Mo system is developed here, incorporating first-principles calculations and reported modeling of the binary Ni–Al, Ni–Mo and Al–Mo systems. To search for the configurations with the lowest energies of the N phase, the Alloy Theoretic Automated Toolkit (ATAT) was employed and combined with VASP. The liquid, bcc and γ-fcc phases are modeled as random atomic solutions, and the γ'-Ni3Al phase is modeled by describing the ordering within the fcc structure using two sublattices, summarized as (Al,Mo,Ni)0.75(Al,Mo,Ni)0.25. Thus, γ-fcc and γ'-Ni3Al are modeled with a single Gibbs free energy function with appropriate treatment of the chemical ordering contribution. In addition, notable improvements are the following: first, the ternary effects of Mo and Al in the B2-NiAl and D0a-Ni3Mo phases, respectively, are considered; second, the N-NiAl8Mo3 phase is described as a solid solution using a three-sublattice model; third, the X-Ni14Al75Mo11 phase is treated as a stoichiometric compound. Model parameters are evaluated using first-principles calculations of zero-Kelvin formation enthalpies and reported experimental data. In comparison with the enthalpies of formation for the compounds ψ-AlMo, θ-Al8Mo3 and B2-NiAl, the first-principles results indicate that the N-NiAl8Mo3 phase, which is stable at high temperatures, decomposes into other phases at low temperature. Resulting phase equilibria are summarized in the form of isothermal sections and liquidus projections. To clearly identify the relationship between the γ-fcc and γ'-Ni3Al phases in the ternary Ni–Al–Mo system, the specific γ-fcc and γ'-Ni3Al phase fields are plotted in x(Al)–x(Mo)–T space for a temperature range 1200–1800 K.

  20. A comprehensive study on photocatalytic activity of supported Ni/Pb sulfide and oxide systems onto natural zeolite nanoparticles.

    PubMed

    Babaahamdi-Milani, Majid; Nezamzadeh-Ejhieh, Alireza

    2016-11-15

    The Ni(II)-Pb(II) exchanged clinoptilolite nanoparticles (NCP) were transformed to corresponding oxides and sulfides via calcination and sulfiding processes, respectively. The obtained catalysts were characterized by XRD, FT-IR, TEM and DRS and used in photodegradation of p-nitrophenol (4-NP) aqueous solution under Hg-lamp irradiation. Results showed considerable increase in activity of the coupled semiconductors with respect to monocomponent one. In NiO-PbO-NCP system, conduction band (CB) of NiO is enough negative for easily migration of photogenerated electrons to CB-PbO level, while such phenomena take place from more negative CB-PbS level to CB-NiS level in NiS-PbS-NCP. These phenomena significantly prevented from electron-hole recombination which increased photocatalytic activity of the coupled semiconductors. Best photodegradation activities obtained by NiO1.3%-PbO14.7%-NCP and NiS2.1%-PbS10.0%-NCP, confirming semiconductors' mass-ratio dependence of the photocatalytic process. The supported coupled semiconductors showed blue shifts in band gap energies with respect to the bulk semiconductors which confirm formation of semiconductors nanoparticles inside the zeolite framework. The highest degradation percentage of 4-NP was obtained at: 0.5gL(-1) photocatalysts, 15mgL(-1) 4-NP at pH 7.5.

  1. A comprehensive study on photocatalytic activity of supported Ni/Pb sulfide and oxide systems onto natural zeolite nanoparticles.

    PubMed

    Babaahamdi-Milani, Majid; Nezamzadeh-Ejhieh, Alireza

    2016-11-15

    The Ni(II)-Pb(II) exchanged clinoptilolite nanoparticles (NCP) were transformed to corresponding oxides and sulfides via calcination and sulfiding processes, respectively. The obtained catalysts were characterized by XRD, FT-IR, TEM and DRS and used in photodegradation of p-nitrophenol (4-NP) aqueous solution under Hg-lamp irradiation. Results showed considerable increase in activity of the coupled semiconductors with respect to monocomponent one. In NiO-PbO-NCP system, conduction band (CB) of NiO is enough negative for easily migration of photogenerated electrons to CB-PbO level, while such phenomena take place from more negative CB-PbS level to CB-NiS level in NiS-PbS-NCP. These phenomena significantly prevented from electron-hole recombination which increased photocatalytic activity of the coupled semiconductors. Best photodegradation activities obtained by NiO1.3%-PbO14.7%-NCP and NiS2.1%-PbS10.0%-NCP, confirming semiconductors' mass-ratio dependence of the photocatalytic process. The supported coupled semiconductors showed blue shifts in band gap energies with respect to the bulk semiconductors which confirm formation of semiconductors nanoparticles inside the zeolite framework. The highest degradation percentage of 4-NP was obtained at: 0.5gL(-1) photocatalysts, 15mgL(-1) 4-NP at pH 7.5. PMID:27427895

  2. Hybrid Co-Cr/W-WC and Ni-W-Cr-B/W-WC Coating Systems

    NASA Astrophysics Data System (ADS)

    Vernhes, L.; Azzi, M.; Bousser, E.; Schmitt, T.; Lamarre, J. M.; Klemberg-Sapieha, J. E.

    2016-01-01

    The aim of this study was to investigate the effects of subsurface materials on the performance of a wear-resistant thin film. The mechanical, tribological, and corrosion properties were assessed for two hybrid coating systems: (1) W-WC thin film and a laser cladded Co-Cr interlayer applied to a 316 stainless steel substrate and (2) the same W-WC thin film and a spray-and-fused Ni-W-Cr-B interlayer applied to an Inconel® 718 substrate. They were then compared to the same systems without an interlayer. The microstructures were analyzed by XRD, EDS, and SEM. The hardness and surface load-carrying capacity of the coating systems were determined by micro- and macrohardness testing. Rockwell indentation was used to assess coating adhesion (CEN/TS 1071-8). Tribological properties were assessed with a reciprocating tribometer, and corrosion resistance was determined by potentiodynamic polarization and electrochemical impedance spectroscopy. The originality of this work lies in the finding that, except for the Inconel 718/Ni-W-Cr-B/W-WC system, the wear rate decreases with decreasing hardness of the subsurface materials carrying the thin film due to the decreasing contact pressure for a given load. Another novel finding is the stress-induced phase transformation of the Co-Cr interlayer, which occurs beneath the thin film under high load.

  3. Phase relations and crystal structures in the system Ce-Ni-Zn at 800 Degree-Sign C

    SciTech Connect

    Malik, Z.; Grytsiv, A.; Rogl, P.; Giester, G.

    2012-10-15

    Phase relations have been established for the system Ce-Ni-Zn in the isothermal section at 800 Degree-Sign C using electron microprobe analysis and X-ray powder diffraction. Phase equilibria at 800 Degree-Sign C are characterized by a large region for the liquid phase covering most of the Ce-rich part of the diagram, whereas a Zn-rich liquid is confined to a small region near the Zn-corner of the Gibbs triangle. Whereas solubility of Ce in the binary Ni-Zn phases is negligible, mutual solubilities of Ni and Zn at a constant Ce content are large at 800 Degree-Sign C for most Ce-Zn and Ce-Ni compounds. The solid solution Ce(Ni{sub 1-x}Zn{sub x}){sub 5} with the CaCu{sub 5}-type is continuous throughout the entire section and for the full temperature region from 400 to 800 Degree-Sign C. Substitution of Zn by Ni is found to stabilize the structure of CeZn{sub 11} to higher temperatures. At 800 Degree-Sign C Ce(Ni{sub x}Zn{sub 1-x}){sub 11} (0.03{<=}x{<=}0.22) appears as a ternary solution phase. Similarly, a rather extended solution forms for Ce{sub 2}(Ni{sub x}Zn{sub 1-x}){sub 17} (0{<=}x{<=}0.53). Detailed data on atom site occupation and atom parameters were derived from X-ray structure analyses for single crystals of Ce{sub 2+y}(Ni{sub x}Zn{sub 1-x}){sub 17}, y=0.02, x=0.49 (a=0.87541(3), c=1.25410(4) nm; Th{sub 2}Zn{sub 17} type with space group R3{sup Macron }m,R{sub F{sup 2}}=0.018) and Ce(Ni{sub 0.18}Zn{sub 0.82}){sub 11} (a=1.04302(2), c=0.67624(3)nm, BaCd{sub 11} type with space group I4{sub 1}/amd, R{sub F{sup 2}}=0.049). - Graphical abstract: Ce-Ni-Zn isothermal section at 800 Degree-Sign C. Highlights: Black-Right-Pointing-Pointer Phase relations were determined for the system Ce-Ni-Zn in the section at 800 Degree-Sign C. Black-Right-Pointing-Pointer A continuous solid solution Ce(Ni{sub 1-x}Zn{sub x}){sub 5}, 0{<=}x{<=}1, forms between 400 and 800 Degree-Sign C. Black-Right-Pointing-Pointer Zn/Ni substitution stabilizes the ternary phase Ce(Zn{sub 1-x}Ni

  4. Magmatic Conduit Metallogenic System in Jinchuan Cu-Ni (PGE) Sulfide Deposit

    NASA Astrophysics Data System (ADS)

    Su, S.; Tang, Z.; Zhou, M.; Song, C.

    2014-12-01

    The Jinchuan Cu-Ni (PGE) sulfide deposit is located in the southwestern margin of North China Craton. Jinchuan ultramafic intrusion hosts the third largest magmatic Cu-Ni deposit in the world. There are mainly four orebodies, namely, orebody-58, orebody-24, orebody-1, and orebody-2, respectively from west to east in the deposit. The primary characteristics of Jinchuan Cu-Ni sulfide deposit are the following: (1) There is an obvious boundary between orebodys and country rocks, usually orebodys intruded into country rocks. (2) "sulfide melts" migrate and settle in the later stage of magma evolution. (3) Fluid Minerals Assemblages are found in the sulfide ores, there is Phl+Cc+Pn+Ccp+Po in orebody-2; Phl+Dol+AP+Pn+Ccp+Po in orebody-24; Q+Mag+AP+Pn+Ccp+Po in orebody-58. (4) Massive sulfides mainly occur in orebody-2, and its PGE content is very rare. Pt-Pd enrichment zones mainly occur in orebody-1; orebody-24 and orebody-58. Ir vs. Ru, Rh, Pt, Pd show positive relationship in orebody-2, but Ir vs. Ru, Rh show positive relationship, Ir vs. Pt, Pd exhibit negative relationship in orebody-1, orebody-24 and orebody-58. The modeling of Ir-Pd shows that the massive sulfide in orebody-2 maybe the origin of MSS. Pt-Pd enrichment zones in orebody-1 orebody-24 and orebody-58 are the relic liquid of monosulfide solid solution segregation; (5) Cu/Ni value is 1.24 in orebody-58, 1.56 in orebody-24, 1.83 in orebody-1, and 2.06 in orebody-2. These features imply that (1) "ore magma" or "melt-fluid bearing metal" formed in the staging chamber in depth; (2) "ore magma" might contain a lot of fluids; (3) "melt-fluid bearing metal" flow moves as a whole; (4) The moving direction of melt-fluid bearing metal flow is form west to east. The ores are enriched in Ni in the front, and enriched in Cu, Pt, Pd in the back of Jinchuan Magmatic Conduit Metallogenic System.

  5. Electronic Structure and Ground State Properties of Non-Magnetic NiPt Systems

    NASA Astrophysics Data System (ADS)

    PAUDYAL, DURGA; MOOKERJEE, ABHIJIT

    We have studied the electronic properties like density of states and band structures and also the ground state properties like formation energy, cohesive energy, bulk modulus and structural energy of NiPt system using the linearized muffin-tin orbital method introduced by Andersen.1,2 In an earlier communication we had argued that both charge neutrality and scalar relativistic corrections are very important for the high concentration of Pt alloys. The calculations here, were, therefore, carried out with charge neutrality as well as with and without scalar relativistic correction for comparison.

  6. Long-Time Stability of Ni-Ti-Shape Memory Alloys for Automotive Safety Systems

    NASA Astrophysics Data System (ADS)

    Strittmatter, Joachim; Gümpel, Paul

    2011-07-01

    In automotive a lot of electromagnetically, pyrotechnically or mechanically driven actuators are integrated to run comfort systems and to control safety systems in modern passenger cars. Using shape memory alloys (SMA) the existing systems could be simplified, performing the same function through new mechanisms with reduced size, weight, and costs. A drawback for the use of SMA in safety systems is the lack of materials knowledge concerning the durability of the switching function (long-time stability of the shape memory effect). Pedestrian safety systems play a significant role to reduce injuries and fatal casualties caused by accidents. One automotive safety system for pedestrian protection is the bonnet lifting system. Based on such an application, this article gives an introduction to existing bonnet lifting systems for pedestrian protection, describes the use of quick changing shape memory actuators and the results of the study concerning the long-time stability of the tested NiTi-wires. These wires were trained, exposed up to 4 years at elevated temperatures (up to 140 °C) and tested regarding their phase change temperatures, times, and strokes. For example, it was found that A P-temperature is shifted toward higher temperatures with longer exposing periods and higher temperatures. However, in the functional testing plant a delay in the switching time could not be detected. This article gives some answers concerning the long-time stability of NiTi-wires that were missing till now. With this knowledge, the number of future automotive applications using SMA can be increased. It can be concluded, that the use of quick changing shape memory actuators in safety systems could simplify the mechanism, reduce maintenance and manufacturing costs and should be insertable also for other automotive applications.

  7. Nano-structured FGM of the system AlN-Ni

    SciTech Connect

    Atarashiya, Koji; Uda, Masahiro

    1993-12-31

    A nano-structured FGM block of the system AlN-Ni was prepared by the method of powder metallurgy. The raw material i.e. an ultrafine particle, whose size was 200 nm in average diameter, was prepared by means of the arc-plasma processing that a vaporized substance was collected in a bag filter. A compositionally gradient mixture of a nickel ultrafine particle and an aluminum-aluminum nitride ultrafine particle was pressed (200 MPa) in a steel die, followed by two-step sintering (873K and 1273K) in flowing nitrogen under null pressure. In this process, the aluminum ultrafine particle reacted with nitrogen into aluminum nitride, but the nickel ultrafine particle did not react with any species. Thus, FGM block of the system AlN-Ni was completely accomplished. The techniques of an ultrafine-particle mixing and sintering without crystal-grain growth were invented. Generally speaking the preparation of FGM block especially in the metal nitride systems, needs an extremely high temperature and high pressure. However, in this work using an ultrafine particle, the nano-structured FGM block was easily prepared. The nitriding reaction of aluminum is exothermic. Thus, it considerably progresses by self-propagating high temperature synthesis (SHS) when it has once begun. The structure and the compositional distributions of the FGM block were examined by SEM and EDX. The physical properties of the FGM block such as density, thermal expansion coefficient and micro harness were measured.

  8. Characterization of NiTi Shape Memory Damping Elements designed for Automotive Safety Systems

    NASA Astrophysics Data System (ADS)

    Strittmatter, Joachim; Clipa, Victor; Gheorghita, Viorel; Gümpel, Paul

    2014-07-01

    Actuator elements made of NiTi shape memory material are more and more known in industry because of their unique properties. Due to the martensitic phase change, they can revert to their original shape by heating when subjected to an appropriate treatment. This thermal shape memory effect (SME) can show a significant shape change combined with a considerable force. Therefore such elements can be used to solve many technical tasks in the field of actuating elements and mechatronics and will play an increasing role in the next years, especially within the automotive technology, energy management, power, and mechanical engineering as well as medical technology. Beside this thermal SME, these materials also show a mechanical SME, characterized by a superelastic plateau with reversible elongations in the range of 8%. This behavior is based on the building of stress-induced martensite of loaded austenite material at constant temperature and facilitates a lot of applications especially in the medical field. Both SMEs are attended by energy dissipation during the martensitic phase change. This paper describes the first results obtained on different actuator and superelastic NiTi wires concerning their use as damping elements in automotive safety systems. In a first step, the damping behavior of small NiTi wires up to 0.5 mm diameter was examined at testing speeds varying between 0.1 and 50 mm/s upon an adapted tensile testing machine. In order to realize higher testing speeds, a drop impact testing machine was designed, which allows testing speeds up to 4000 mm/s. After introducing this new type of testing machine, the first results of vertical-shock tests of superelastic and electrically activated actuator wires are presented. The characterization of these high dynamic phase change parameters represents the basis for new applications for shape memory damping elements, especially in automotive safety systems.

  9. Phase relations in the Fe-Ni-Cr-S system and the sulfidation of an austenitic stainless steel

    NASA Technical Reports Server (NTRS)

    Jacob, K. T.; Rao, D. B.; Nelson, H. G.

    1977-01-01

    The stability fields of various sulfide phases that form on Fe-Cr, Fe-Ni, Ni-Cr and Fe-Cr-Ni alloys were developed as a function of temperature and the partial pressure of sulfur. The calculated stability fields in the ternary system were displayed on plots of log P sub S sub 2 versus the conjugate extensive variable which provides a better framework for following the sulfidation of Fe-Cr-Ni alloys at high temperatures. Experimental and estimated thermodynamic data were used in developing the sulfur potential diagrams. Current models and correlations were employed to estimate the unknown thermodynamic behavior of solid solutions of sulfides and to supplement the incomplete phase diagram data of geophysical literature. These constructed stability field diagrams were in excellent agreement with the sulfide phases and compositions determined during a sulfidation experiment.

  10. Redistribution of concentration of components during interdiffusion in Cu-Fe-Ni system

    NASA Astrophysics Data System (ADS)

    Ugaste, Yu. E.; Kodentsov, A. A.; van Loo, F.

    2012-12-01

    Interdiffusion in a Cu-Ni-Fe system was studied at a temperature of 1000°C for three different diffusion couples. It has been shown that, in the studied diffusion couples, the distributions of some components of the system have a distinctly nonmonotonous character and, apart from the local extremes of the concentration curves, there are also zero flux planes in five diffusion zones. Special features of the behavior of the concentration curves and diffusion paths are discussed using thermodynamic data for the system. It has been found that diffusion fluxes of the components are unambiguously associated with a derivative of thermodynamic activity by the concentration taken along the diffusion path. There are experimental data in the appendix concerning the concentration profiles for all of the studied components of the diffusion couples.

  11. Structural and physical properties of Ni-Tb-Fe-O system

    SciTech Connect

    Khan, M. Azhar Islam, M.U.; Ishaque, M.; Rahman, I.Z.; Genson, A.; Hampshire, S.

    2009-01-15

    A series of soft ferrites in the system Ni{sub 1-x}Tb{sub x}Fe{sub 2}O{sub 4} (0 {<=} x {<=} 0.2), was prepared by a standard ceramic technique. The influence of terbium content was investigated by means of X-ray diffraction, Fourier Transform Infrared (FTIR) spectroscopy and scanning electron microscopy. The X-ray diffraction analysis reveals that the samples have a cubic spinel (single phase) structure for 0 {<=} x {<=} 0.08; for x > 0.08 a small peak of orthorhombic phase (TbFeO{sub 3}) appears and becomes more conspicuous with increased terbium substitution. The lattice parameter changes in a non-linear way as a function of terbium content which may be attributed to differences in the ionic radii of the cations involved and the solubility limit of terbium ions. A gradual increase in the bulk density was observed with the increase of terbium concentration, from 5.13 g/cm{sup 3} to 5.69 g/cm{sup 3}. FTIR absorption spectra of the Ni-Tb-Fe-O system were investigated in the wave number range 370-1500 cm{sup -1}. Each spectrum exhibited two main absorption bands, thereby confirming the spinel structure.

  12. Thermal-Structural Evaluation of TD Ni-20Cr Thermal Protection System Panels

    NASA Technical Reports Server (NTRS)

    Eidinoff, H. L.; Rose, L.

    1974-01-01

    The results of a thermal-structural test program to verify the performance of a metallic/radiative Thermal Protection System (TPS) under reentry conditions are presented. This TPS panel is suitable for multiple reentry, high L/D space vehicles, such as the NASA space shuttle, having surface temperatures up to 1200 C (2200 F). The TPS panel tested consists of a corrugation-stiffened, beaded-skin TD Ni-20Cr metallic heat shield backed by a flexible fibrous quartz and radiative shield insulative system. Test conditions simulated the critical heating and aerodynamic pressure environments expected during 100 repeated missions of a reentry vehicle. Temperatures were measured during each reentry cycle; heat-shield flatness surveys to measure permanent set of the metallic components were made every 10 cycles. The TPS panel, in spite of localized surface failures, performed its designated function.

  13. New Stable Crystal Structures for Cu-Au and Ni-Pt Alloy Systems

    NASA Astrophysics Data System (ADS)

    Sanati, Mahdi; Wang, L. G.; Zunger, A.

    2003-10-01

    Cu-Au and Ni-Pt are among the best studied fcc alloy systems, exhibiting the famous L10 (AB) and L12 (A_3B) phases. We were wondering if a complete configurational search of the T=0 LDA total energies would reveal any unexpected phases. Total-energy calculations of ˜ 30 arbitrarily chosen structures were used to construct a generalized (momentum-space) Ising Hamiltonian containing ˜ 20 pair-interactions, ˜ 5-10 many-body terms, as well as the long-range strain term. This Hamiltonian was tested carefully as to its ability to predict the LDA energies of other structures. We searched the energies of all fcc configurations with 20 or less atoms per primitive cell ( ˜ 2,700,000 structures), found known L1_0, L12 as well as new, unsuspected structures. The new ground state structures are NiPt_7, Cu_2Au, and Cu_2Au_3. We also found a composition range in which there is quasicontinuum of stable, ordered structures made of (001) repeat units of simple structural motifs. This structural adaptivity is explained in terms of anisotropic, long-range strain energy.

  14. Potential High-Temperature Shape-Memory Alloys Identified in the Ti(Ni,Pt) System

    NASA Technical Reports Server (NTRS)

    Noebe, Ronald D.; Biles, Tiffany A.; Garg, Anita; Nathal, Michael V.

    2004-01-01

    "Shape memory" is a unique property of certain alloys that, when deformed (within certain strain limits) at low temperatures, will remember and recover to their original predeformed shape upon heating. It occurs when an alloy is deformed in the low-temperature martensitic phase and is then heated above its transformation temperature back to an austenitic state. As the material passes through this solid-state phase transformation on heating, it also recovers its original shape. This behavior is widely exploited, near room temperature, in commercially available NiTi alloys for connectors, couplings, valves, actuators, stents, and other medical and dental devices. In addition, there are limitless applications in the aerospace, automotive, chemical processing, and many other industries for materials that exhibit this type of shape-memory behavior at higher temperatures. But for high temperatures, there are currently no commercial shape-memory alloys. Although there are significant challenges to the development of high-temperature shape-memory alloys, at the NASA Glenn Research Center we have identified a series of alloy compositions in the Ti-Ni-Pt system that show great promise as potential high-temperature shape-memory materials.

  15. Bridge Structure for the graphene/Ni(111) system: A first principles study

    SciTech Connect

    Fuentes-Cabrera, Miguel A; Baskes, Mike I.; Melechko, Anatoli Vasilievich; Simpson, Michael L

    2008-01-01

    The structure of graphene on Ni(111) is studied with density functional theory (DFT). Six different structures, i.e., top-fcc, top-hcp, hcp-fcc, bridge-top, bridge-fcc, and bridge-hcp, were investigated. Bridge-top, bridge-fcc, and bridge-hcp are studied here. Top-fcc and hcp-fcc have been considered before, experimentally and theoretically, and regarded as energetically stable structures. The calculations employed the local density approximation (LDA) and the Perdew, Burke, and Ernzerhof (PBE) generalized-gradient approximation to DFT. The results showed that with PBE, none of the structures is stable at the experimentally relevant temperatures; with LDA, only bridge-top and top-fcc are stable. These findings suggest that it will be worthwhile to carry on new experimental studies to revisit the structural determination of the graphene/Ni(111) system, with special emphasis on testing whether bridge-top could exist by itself or coexist with other structures.

  16. Stable Ni Isotope Fractionation In Systems Relevant To Banded Iron-Formations

    NASA Astrophysics Data System (ADS)

    Howe, H.; Spivak-Birndorf, L.; Newkirk, D.; Wasylenki, L. E.

    2013-12-01

    An important event in the evolution of life was the rise of atmospheric oxygen during the Proterozoic. Preceding the rise in O2 was a decline in atmospheric methane concentrations, likely due to decreased productivity of methanogenic Archaea. Based on Ni concentrations in banded iron formations (BIF), Konhauser et al. (2009) hypothesized that mantle cooling during the Archaean reduced the amount of Ni present in igneous rocks and in oceans, causing a Ni shortage for methanogens. Methanogens use Ni for cofactor F430, a catalyst during methanogenesis. To confirm Konhauser's hypothesis, a proxy for methanogen productivity in the rock record is necessary, in order to determine whether a decline in methanogen populations correlated with the observed decrease in maximum Ni contents in rocks from the Archaean. Ni isotope ratios recorded in BIF (oceanic sediments consisting of layered iron oxides and cherts) may provide evidence of a decline in methane production. Cameron et al. (2009) have shown that methanogens preferentially assimilate light Ni isotopes. Thus Ni isotopes in BIF have potential use as biomarkers for methanogenesis. Ferrihydrite was almost certainly the dominant Fe-oxide phase precipitating during BIF deposition. Ferrihydrite nanoparticles have large surface areas and are able to remove aqueous metals from solution through multiple sorption mechanisms. Thus we investigated experimentally the relationship between Ni isotopes in solution and Ni associated with ferrihydrite. We experimented with two different sorption mechanisms: adsorption of aqueous Ni onto surfaces of synthetic ferrihydrite and coprecipitation of aqueous Ni with ferrihydrite. Preliminary results indicate that light isotopes are preferentially associated with ferrihydrite in both adsorption and coprecipitation experiments, with an average fractionation of 0.3‰ in terms of δ60/58 Ni. Future experiments will investigate whether the observed isotope fractionations reflect kinetics or

  17. New system for manipulation of nanoobjects based on composite Ti2NiCu/Pt nanotweezers with shape memory effect

    NASA Astrophysics Data System (ADS)

    Zhikharev, A. M.; Irzhak, A. V.; Beresin, M. Y.; Lega, P. V.; Koledov, V. V.; Kasyanov, N. N.; Martynov, G. S.

    2016-08-01

    We report the new system for manipulation of nanoobjects based on composite Ti2NiCu/Pt nanotweezers with shape memory effect. The design consists of the bimetallic Ti2NiCu/Pt shape memory nanotweezers placed on a tip of electrochemically etched tungsten needle. The semiconductor diode placed on the tip of the needle plays both role of resistive element of the heater and temperature sensor for feedback control loop closing. The device is compatible with existing positioning systems like OmniProbe®, Kleindiek®, etc. and may find numerous practical applications in various tasks of nanotechnology connected with 3D manipulation.

  18. Thermodynamical properties of La-Ni-T (T = Mg, Bi and Sb) hydrogen storage systems

    NASA Astrophysics Data System (ADS)

    Giza, K.; Iwasieczko, W.; Pavlyuk, V. V.; Bala, H.; Drulis, H.

    The hydrogen absorption properties of LaNi 4.8T 0.2 (T = Mg, Bi and Sb) alloys are reported. The effects of the substitution of Ni in the LaNi 5 compound with Mg, Bi and Sb are investigated. The ability of alloys to absorb hydrogen is characterized by the pressure-composition (p- c) isotherms. The p- c isotherms allow the determining thermodynamic parameters enthalpy (Δ H des) and entropy (Δ S des) of the dehydrogenation processes. The calculated Δ H des and Δ S des data helps to explain the decrease of hydrogen equilibrium pressure in alloys doped with Al, Mg and Bi and its increase in the Sb-doped LaNi 5 compound. Generally, partial substitution of Ni in LaNi 5 compound with Mg, Bi and Sb cause insignificant changes of hydrogen storage capacity compared to the hydrogen content in the initial LaNi 5H 6 hydride phase. However, it is worth to stress that, in the case of LaNi 4.8Bi 0.2, a small increase of H/f.u. up to 6.8 is observed. The obtained results in these investigations indicate that the LaNi 4.8T 0.2 (T = Al, Mg and Bi) alloys can be very attractive materials dedicated for negative electrodes in Ni/MH batteries.

  19. Effect of Ni content on the diffusion-controlled growth of the product phases in the Cu(Ni)-Sn system

    NASA Astrophysics Data System (ADS)

    Baheti, Varun A.; Islam, Sarfaraj; Kumar, Praveen; Ravi, Raju; Narayanan, Ramesh; Hongqun, Dong; Vuorinen, Vesa; Laurila, Tomi; Paul, Aloke

    2016-01-01

    A strong influence of Ni content on the diffusion-controlled growth of the (Cu,Ni)3Sn and (Cu,Ni)6Sn5 phases by coupling different Cu(Ni) alloys with Sn in the solid state is reported. The continuous increase in the thickness ratio of (Cu,Ni)6Sn5 to (Cu,Ni)3Sn with the Ni content is explained by combined kinetic and thermodynamic arguments as follows: (i) The integrated interdiffusion coefficient does not change for the (Cu,Ni)3Sn phase up to 2.5 at.% Ni and decreases drastically for 5 at.% Ni. On the other hand, there is a continuous increase in the integrated interdiffusion coefficient for (Cu,Ni)6Sn5 as a function of increasing Ni content. (ii) With the increase in Ni content, driving forces for the diffusion of components increase for both components in both phases but at different rates. However, the magnitude of these changes alone is not large enough to explain the high difference in the observed growth rate of the product phases because of Ni addition. (iv) Kirkendall marker experiments indicate that the Cu6Sn5 phase grows by diffusion of both Cu and Sn in the binary case. However, when Ni is added, the growth is by diffusion of Sn only. (v) Also, the observed grain refinement in the Cu6Sn5 phase with the addition of Ni suggests that the grain boundary diffusion of Sn may have an important role in the observed changes in the growth rate.

  20. Fatigue of NiTi SMA-pulley system using Taguchi and ANOVA

    NASA Astrophysics Data System (ADS)

    Mohd Jani, Jaronie; Leary, Martin; Subic, Aleksandar

    2016-05-01

    Shape memory alloy (SMA) actuators can be integrated with a pulley system to provide mechanical advantage and to reduce packaging space; however, there appears to be no formal investigation of the effect of a pulley system on SMA structural or functional fatigue. In this work, cyclic testing was conducted on nickel-titanium (NiTi) SMA actuators on a pulley system and a control experiment (without pulley). Both structural and functional fatigues were monitored until fracture, or a maximum of 1E5 cycles were achieved for each experimental condition. The Taguchi method and analysis of the variance (ANOVA) were used to optimise the SMA-pulley system configurations. In general, one-way ANOVA at the 95% confidence level showed no significant difference between the structural or functional fatigue of SMA-pulley actuators and SMA actuators without pulley. Within the sample of SMA-pulley actuators, the effect of activation duration had the greatest significance for both structural and functional fatigue, and the pulley configuration (angle of wrap and sheave diameter) had a greater statistical significance than load magnitude for functional fatigue. This work identified that structural and functional fatigue performance of SMA-pulley systems is optimised by maximising sheave diameter and using an intermediate wrap-angle, with minimal load and activation duration. However, these parameters may not be compatible with commercial imperatives. A test was completed for a commercially optimal SMA-pulley configuration. This novel observation will be applicable to many areas of SMA-pulley system applications development.

  1. A study of reactant interfaces in Ni+Al particle systems during shock wave propagation

    NASA Astrophysics Data System (ADS)

    Austin, Ryan A.; McDowell, David L.; Horie, Yasuyuki; Benson, David J.

    2007-06-01

    Macro-scale responses of energetic materials during shock compression are influenced strongly by thermo-mechano-chemical processes occurring at the level of the microstructure. For example, it is believed that the propagation of chemical reactions in reactive particle systems is intimately linked to conditions at reactant interfaces such as surface temperature, phase changes, defect density, and mass mixing due to inelastic deformation. To provide explicit resolution of such interfacial conditions, numerical models are constructed. The finite element method is used to numerically solve the differential equations that govern the coupled thermomechanical response of micron-size particle mixtures of Ni and Al during shock wave propagation (interface chemistry is not yet modeled). The size and temperature distributions of contiguous reactant contact surfaces are quantified for a range of shock strengths. A parametric study of mixture attributes is undertaken to assess the sensitivity of the aforementioned distributions to variations of the microstructure.

  2. 31P NMR investigations on the ferromagnetic quantum critical system YbNi4P2

    NASA Astrophysics Data System (ADS)

    Sarkar, R.; Khuntia, P.; Krellner, C.; Geibel, C.; Steglich, F.; Baenitz, M.

    2012-04-01

    We studied the heavy-fermion system YbNi4P2, which presents strong ferromagnetic correlations, using the local 31P NMR probe over a wide field (0.2-8.6 T) and temperature (1.8-200 K) range. The 31P NMR Knight shift provides the static spin susceptibility which tracks the bulk susceptibility whereas the spin-lattice relaxation rate 31(1/T1) provides information about the fluctuations of the Yb 4f moment. The Korringa law is valid over a wide range of temperature and field. The Korringa product 31(1/T1TK2S0)≪1 gives evidence for the presence of strong ferromagnetic correlations. A 31(1/T1T)˜T-3/4 behavior was found over two decades in temperature.

  3. Vapor phase oxidation of benzoic acid to phenol over a novel catalyst system consisting of NiO and NiFe{sub 2}O{sub 4}

    SciTech Connect

    Miki, Jun; Asanuma, Minoru; Tachibana, Yakudo

    1995-02-01

    NiO and Fe{sub 2}O{sub 3} were found to show the catalytic activities for the vapor phase oxidation of benzoic acid to form phenol. Furthermore, the enhancement of the activity and phenol selectivity were achieved by combined Ni and Fe components prepared by precipitation. The calcination temperature and the atomic ratio of Ni to Fe were found to be important for the enhancement of activity. The homogeneous distribution profile of NiO and NiFe{sub 2}O{sub 4} on the surface and in the bulk of the catalyst is essential for the optimization of phenol formation. 32 refs., 7 figs., 4 tabs.

  4. Immune system responses and fitness costs associated with consumption of bacteria in larvae of Trichoplusia ni

    PubMed Central

    Freitak, Dalial; Wheat, Christopher W; Heckel, David G; Vogel, Heiko

    2007-01-01

    Background Insects helped pioneer, and persist as model organisms for, the study of specific aspects of immunity. Although they lack an adaptive immune system, insects possess an innate immune system that recognizes and destroys intruding microorganisms. Its operation under natural conditions has not been well studied, as most studies have introduced microbes to laboratory-reared insects via artificial mechanical wounding. One of the most common routes of natural exposure and infection, however, is via food; thus, the role of dietary microbial communities in herbivorous insect immune system evolution invites study. Here, we examine the immune system response and consequences of exposing a lepidopteran agricultural pest to non-infectious microorganisms via simple oral consumption. Results Immune system response was compared between Trichoplusia ni larvae reared on diets with or without non-pathogenic bacteria (Escherichia coli and Micrococcus luteus). Two major immune response-related enzymatic activities responded to diets differently – phenoloxidase activity was inhibited in the bacteria-fed larvae, whereas general antibacterial activity was enhanced. Eight proteins were highly expressed in the hemolymph of the bacteria fed larvae, among them immune response related proteins arylphorin, apolipophorin III and gloverin. Expression response among 25 putative immune response-related genes were assayed via RT-qPCR. Seven showed more than fivefold up regulation in the presence of bacterial diet, with 22 in total being differentially expressed, among them apolipophorin III, cecropin, gallerimycin, gloverin, lysozyme, and phenoloxidase inhibiting enzyme. Finally, potential life-history trade-offs were studied, with pupation time and pupal mass being negatively affected in bacteria fed larvae. Conclusion The presence of bacteria in food, even if non-pathogenic, can trigger an immune response cascade with life history tradeoffs. Trichoplusia ni larvae are able to detect

  5. Optimization of the Ni-Cr-Al-Y/ZrO2-Y2O3 thermal barrier system

    NASA Technical Reports Server (NTRS)

    Stecura, S.

    1986-01-01

    The effects of bond and thermal barrier coating compositions, thicknesses, and densities on air plasma spray deposited Ni-Cr-Al-Y/ZrO2-Y2O3 life were evaluated in cyclic furnace oxidation tests at temperatures from 1110 to 1220 C. An empirical relation was developed to give life as a function of the above parameters. The thermal barrier system tested which had the longest life consisted of Ni-35.0 wt pct Cr-5.9 wt pct Al-0.95 wt pct Y bond coating and ZrO2-6.1 wt pct Y2O3 thermal barrier coating.

  6. Optimization of the NiCrAl-Y/ZrO-Y2O3 thermal barrier system

    NASA Technical Reports Server (NTRS)

    Stecura, S.

    1985-01-01

    The effects of bond and thermal barrier coating compositions, thicknesses, and densities on air plasma spray deposited Ni-Cr-Al-Y/ZrO2-Y2O3 life were evaluated in cyclic furnace oxidation tests at temperatures from 1110 to 1220 C. An empirical relation was developed to give life as a function of the above parameters. The thermal barrier system tested which had the longest life consisted of Ni-35.0 wt% Cr-5.9 wt% Al-0.95 wt% Y bond coating and ZrO2-6.1 wt% Y2O3 thermal barrier coating.

  7. Further Observations of Fe-60-Ni-60 and Mn-53-Cr-53 Isotopic Systems in Sulfides from Enstatite Chondrites

    NASA Technical Reports Server (NTRS)

    Guan, Y.; Huss, G. R.; Leshin, L. A.

    2004-01-01

    Recent studies have shown that short-lived Fe-60 (t(sub 1/2) = 1.5 Ma) was present in some components of ordinary and enstatite chondrites when they formed. Here we report additional data on Fe-60 from sulfides in enstatite chondrites and on the potential relationship between the Fe-60-Ni-60 and Mn-53-Cr-53 systems.

  8. The effect of silicon on the oxidation behavior of NiAlHf coating system

    NASA Astrophysics Data System (ADS)

    Dai, Pengchao; Wu, Qiong; Ma, Yue; Li, Shusuo; Gong, Shengkai

    2013-04-01

    Two types of NiAlHf coatings doped with different content of Si (1 at.% and 2 at.%) were deposited on a Ni3Al based single crystal superalloy IC32 by electron beam physical vapor deposition (EB-PVD) method, respectively. For comparison, NiAlHf coating with 0 at.% Si was also prepared. The oxidation tests were carried out at 1423 K in air. At the initial stage of oxidation, large amount of flake-like θ-Al2O3 was found on NiAlHf coating surface. However, no θ-Al2O3 was observed in 2 at.% Si doped NiAlHf coating except α-Al2O3. It revealed that the Si additions could contribute to the transformation from θ-Al2O3 to α-Al2O3. When oxidation time prolonged to 100 h, it was found that the degradation of NiAlHf coating was very severe with no residual β-phase, which was due to the serious inter-diffusion between the coating and substrate. In contrast, the inter-diffusion in Si-doped coating was reduced with some residual β-phase and R-Ni(Mo, Re) precipitates. The presence of Si could retard the inter-diffusion of elements between coating and substrate, indicating a barrier diffusion effect. As a result, the oxidation resistance of NiAlHf coating was improved significantly.

  9. The Effects of Ni-Plating and Prolonged High Temperature Oxidation at 1423 K (1150 °C) on a CMSX-10 Single-Crystal Ni-Based Super-Alloy and Coating System

    NASA Astrophysics Data System (ADS)

    Clancy, Marie; Pomeroy, Michael J.

    2013-07-01

    A hypothesis was investigated, to assess if Ni-plating a 3rd-generation single-crystal alloy could favorably alter the diffusion profile of critical elements such that brittle, deleterious topologically close-packed (TCP) phases did not form or at least the extent to which they did was reduced. In conjunction with delaying the onset of these phases, it was hoped that more favorable alternatives could be promoted, such as martensite (β'). This study showed that Ni-plating did have some positive effects on the super-alloy/coating system. While the coating produced on the Ni-plated alloy was thinner, it retained a higher Al content than its unplated counterpart when subjected to oxidation. The retention of Al within the coating delayed the phase evolution of the coating from a β or β + β' to a γ'-dominant coating as the Ni-plated system had a greater driving force for Ni and Al diffusion, which helped to establish the Ni-rich diffusion barrier that entrapped Al in the coating. Unfortunately, Ni-plating does not sufficiently alter the diffusion profiles within the alloy to prevent precipitation of the TCP phases. Four pairs of the CMSX-10 alloy were used for this study. While they were all aluminized, only half of them, one in each pair, were Ni plated prior to aluminizing. Three of the four pairs were then oxidized at 1423 K (1150 °C), while the first pair was kept as a standard. X-ray diffraction, scanning electron microscopy, and energy dispersive X-ray spectroscopy were used to characterize each alloy-coating system in an effort to better understand their performance under high temperature oxidation.

  10. The binding of Ni(II) ions to hexahistidine as a model system of the interaction between nickel and His-tagged proteins.

    PubMed

    Valenti, Laura E; De Pauli, Carlos P; Giacomelli, Carla E

    2006-02-01

    The aim of this work is to study the binding of nickel ions to hexahistidine (His(6)) combining potentiometric titrations and spectroscopic (UV-Vis and circular dichroism) determinations in order to establish the species distribution as a function of the pH, their stoichiometry, stability and geometry. For comparative purposes, the same procedure was applied to the Ni-histidine (His) system. His behaves as a tridentate ligand, coordinating the carboxyl group, the imidazole and the amino nitrogen atoms to Ni(II) ions in an octahedral coordination and a bis(histidine) complex is formed at pH higher than 5. For the Ni-His(6) system, the complex formation starts at pH 4 and five different species (Ni(His(6))H, Ni(His(6)), Ni(n)(His(6))(n), Ni(n)(His(6))(n)H(-n/2), Ni(n)(His(6))(n)H(-n)) are formed as a function of the pH. Ni(His(6))H involves the coordination of the imidazole nitrogen and a deprotonated amide nitrogen (N(Im), N(-)) resulting in an octahedral geometry. In Ni(His(6)), an imidazole nitrogen is deprotonated and coordinated (2N(Im), N(-)) to the metal ion with a square planar geometry. The aggregated forms result from the extra Ni-N(Im) coordination, resulting in a 4N square planar geometry that is stabilized by inter/intramolecular hydrogen bonds. This coordination mode is not altered during the deprotonation steps from Ni(n)(His(6))(n). PMID:16376429

  11. Structural chemistry of some phases in the YC-Ni-B system

    SciTech Connect

    Chakoumakos, B.C.

    1994-12-31

    NiB, monoclinic Ni{sub 4}B{sub 3}, Ni{sub 2}B and Ni{sub 3}B were prepared by arc-melting and their room-temperature crystal structures were refined by Rietveld analysis of neutron powder diffraction data. The NiB refinement is altogether new data. Although the B atoms in NiB form characteristic zigzag chains, the primary coordination of each atom by atoms of the other kind is similar and distinctively sevenfold, with one short (2.117 {angstrom}), two intermediate (2.152 {angstrom}), and four long (2.163 {angstrom}) bonds. Other samples with stoichiometries (YC)nNi{sub 2}B{sub 2}, n = 3, 4, did not yield single-phase material, but both x-ray and neutron powder diffraction suggest that the n = 4 structure is present in both of these samples. Phase-pure samples of these homologues may require non-stoichiometry and a more controlled thermal history than is attainable by arc melting. To screen samples for superconductivity, ac susceptibility measurements were made using the mutual inductance method with ac signal of 200 Hz.

  12. Bioavailability and trophic transfer of sediment-bound Ni and U in a southeastern wetland system.

    PubMed

    Punshon, T; Gaines, K F; Jenkins Jr, R A

    2003-01-01

    Elemental composition of soil, herbaceous and woody plant species, and the muscle and liver tissue of two common small mammal species were determined in a wetland ecosystem contaminated with Ni and U from nuclear target processing activities at the Savannah River Site, Aiken, SC. Species studied were black willow ( Salix nigra L.), rushes ( Juncus effusus L.), marsh rice rat ( Oryzomys palustris), and cotton rat ( Sigmodon hispidus). Two mature trees were sampled around the perimeter of the former de facto settling basin, and transect lines sampling rushes and trapping small mammals were laid across the wetland area, close to a wooden spillway that previously enclosed the pond. Ni and U concentrations were elevated to contaminant levels; with a total concentration of 1,065 (+/- 54) mg kg(-1) U and 526.7 (+/-18.3) mg kg(-1) Ni within the soil. Transfer of contaminants into woody and herbaceous plant tissues was higher for Ni than for U, which appeared to remain bound to the outside of root tissues, with very little (0.03 +/- 0.001 mg kg(-1)) U detectable within the leaf tissues. This indicated a lower bioavailability of U than the cocontaminant Ni. Trees sampled from the drier margins of the pond area contained more Ni within their leaf tissues than the rushes sampled from the wetter floodplain area, with leaf tissues concentrations of Ni of approximately 75.5 (+/- 3.6) mg kg(-1) Ni. Ni concentrations were also elevated in small mammal tissues. Transfer factors of contaminants indicated that U bioavailability is negligable in this wetland ecosystem.

  13. Interface stability in the Ni-Cr-AI system: Part I. morphological stability of β-γ diffusion couple interfaces at 1150°C

    NASA Astrophysics Data System (ADS)

    Merchant, Sailesh M.; Notis, Michael R.; Goldstein, Joseph I.

    1990-07-01

    Aluminide coatings on Ni-base superalloys offer resistance to oxidation and hot corrosion at elevated temperatures. Complex depositional and subsequent diffusional interactions of the coating with the substrate result in a multiphase product consisting primarily of β-NiAl and γ'-Ni3Al intermediate phases. An understanding of interfacial stability between the coating and the substrate is therefore necessary in order to explain the formation of such phases. The Ni-Cr-AI system serves to simplify the complex chemistry of most Ni-base superalloys. In this study, reaction diffusion and interfacial stability were investigated in solid-solid diffusion couples, consisting of a common β-Ni50Al end-member and a series of γ-pure Ni, binary Ni-Cr, and ternary Ni-Cr-Al alloys, isothermally annealed at 1150 °C for 49 hours. The morphological development of the interface was examined using optical metallography and quantitative information obtained using electron-probe microanalysis. A transition from a stable or planar to an unstable or nonplanar interface in the β-γ diffusion couples was observed with the systematic variation in Cr content of the γ end-member. Interface breakdown in the β-γ couples was explained by means of microstructural information gathered about interfaces, measured diffusion paths, and a knowledge of phase constitution relationships.

  14. Fabrication and Characterization of Multi-Walled Carbon Nanotube (MWCNT) and Ni-Coated Multi-Walled Carbon Nanotube (Ni-MWCNT) Repair Patches for Carbon Fiber Reinforced Composite Systems

    NASA Technical Reports Server (NTRS)

    Johnson, Brienne; Caraccio, Anne; Tate, LaNetra; Jackson, Dionne

    2011-01-01

    Multi-walled carbon nanotube (MWCNT)/epoxy and nickel-coated multi-walled carbon nanotube (Ni-MWCNT)/epoxy systems were fabricated into carbon fiber composite repair patches via vacuum resin infusion. Two 4 ply patches were manufactured with fiber orientations of [90/ 90/ 4590] and [0/90/ +45/ -45]. Prior to resin infusion, the MWCNT/Epoxy system and NiMWCNT/ epoxy systems were optimized for dispersion quality. Scanning electron microscopy (SEM) and optical microscopy (OM) were used to determine the presence ofcarbon nanotubes and assess dispersion quality. Decomposition temperatures were determined via thermogravametric analysis (TGA). SEM and TGA were also used to evaluate the composite repair patches.

  15. Discovery of a thermally persistent h.c.p. solid-solution phase in the Ni-W system

    SciTech Connect

    Kurz, S. J. B. Leineweber, A.; Maisel, S. B.; Höfler, M.; Müller, S.; Mittemeijer, E. J.

    2014-08-28

    Although the accepted Ni-W phase diagram does not reveal the existence of h.c.p.-based phases, h.c.p.-like stacking sequences were observed in magnetron-co-sputtered Ni-W thin films at W contents of 20 to 25 at. %, by using transmission electron microscopy and X-ray diffraction. The occurrence of this h.c.p.-like solid-solution phase could be rationalized by first-principles calculations, showing that the vicinity of the system's ground-state line is populated with metastable h.c.p.-based superstructures in the intermediate concentration range from 20 to 50 at. % W. The h.c.p.-like stacking in Ni-W films was observed to be thermally persistent, up to temperatures as high as at least 850 K, as evidenced by extensive X-ray diffraction analyses on specimens before and after annealing treatments. The tendency of Ni-W for excessive planar faulting is discussed in the light of these new findings.

  16. Combustion synthesis in the Ti-C-Ni-Mo system: Part I. Micromechanisms

    NASA Astrophysics Data System (ADS)

    Lasalvia, J. C.; Kim, D. K.; Lipsett, R. A.; Meyers, M. A.

    1995-11-01

    Combustion-wave arresting experiments were conducted on Ti-C-Ni and Ti-C-Ni-Mo powder mixtures. The reactant powder mixtures were placed within a conical hole machined in a Cu block. The reaction was initiated at the base of the cone and proceeded down the cone axis, toward the apex, until the heat loss to the Cu block was sufficient to arrest the reaction. This enabled the postreaction characterization of the three distinct regions of the combustion wave: unreacted, partially reacted, and fully reacted. The unreacted region is characterized by removal of a surface scale on the Ti particles and Ti α → β solid-state phase transformation. The partially reacted region is characterized by a number of physical processes and a distinct interface with the unreacted region. These processes include the formation of Ti-Ni phases, Ti-Ni melt, TiC, layer on the C particles, and TiCx spherules. The TiCx layer is composed of coarsening TiCx precipitates which are ejected into the progressively Ni-rich Ti-Ni melt. These TiCx spherules vary in size with apparent diameters of approximately 0.2 to 1 μm. No distinct interface exists between the partially and fully reacted regions. Final consumption of C is followed by TiCx spherule growth by combined Ostwald ripening and grain coalescence mechanisms resulting in an apparent diameter of 2.5 μm. The addition of Mo does not significantly affect the processes occurring within the partially reacted region. It is apparent that Mo enters into solution with the Ti-Ni melt at a rate much slower than that characteristic of the other processes (i.e., Ti-Ni melt mixing or Ti-C reaction).

  17. Blanch Resistant and Thermal Barrier NiAl Coating Systems for Advanced Copper Alloys

    NASA Technical Reports Server (NTRS)

    Raj, Sai V. (Inventor)

    2005-01-01

    A method of forming an environmental resistant thermal barrier coating on a copper alloy is disclosed. The steps include cleansing a surface of a copper alloy, depositing a bond coat on the cleansed surface of the copper alloy, depositing a NiAl top coat on the bond coat and consolidating the bond coat and the NiAl top coat to form the thermal barrier coating. The bond coat may be a nickel layer or a layer composed of at least one of copper and chromium-copper alloy and either the bond coat or the NiAl top coat or both may be deposited using a low pressure or vacuum plasma spray.

  18. Estimation of excess energies and activity coefficients for the penternary Ni-Cr-Co-Al-Mo system and its subsystems

    NASA Astrophysics Data System (ADS)

    Dogan, A.; Arslan, H.; Dogan, T.

    2015-06-01

    Using different prediction methods, such as the General Solution Model of Kohler and Muggianu, the excess energy and activities of molybdenum for the sections of the phase diagram for the penternary Ni-Cr-Co-Al-Mo system with mole ratios xNi/ xMo = 1, xCr/ xMo = 1, xCo/ xMo = 1, and xAl/ xMo = r = 0.5 and 1, were thermodynamically investigated at a temperature of 2000 K, whereas the excess energy and activities of Bi for the section corresponding to the ternary Bi-Ga-Sb system with mole ratio xGa/ xSb = 1/9 were thermodynamically investigated at a temperature of 1073 K. In the case of r = 0.5 and 1 in the alloys Ni-Cr-Co-Al-Mo, a positive deviation in the activity coefficient was revealed, as molybdenum content increased. Moreover, in the calculations performed in Chou's GSM model, the obtained values for excess Gibbs energies are negative in the whole concentration range of bismuth at 1073 K and exhibit the minimum of about -2.2 kJ/mol at the mole ratio xGa/ xSb = 1/9 in the alloy Bi-Ga-Sb.

  19. Corrosion of NiCoCrAlY Coatings and TBC Systems Subjected to Water Vapor and Sodium Sulfate

    NASA Astrophysics Data System (ADS)

    Eriksson, Robert; Yuan, Kang; Li, Xin-Hai; Lin Peng, Ru

    2015-08-01

    Thermal barrier coating (TBC) systems are commonly used in gas turbines for protection against high-temperature degradation. Penetration of the ceramic top coat by corrosive species may cause corrosion damage on the underlying NiCoCrAlY bond coat and cause failure of the TBC system. In the current study, four oxidation/corrosion conditions were tried: (i) lab air, (ii) water vapor, (iii) sodium sulfate deposited on the specimens, and (iv) water vapor + sodium sulfate. The test was done at 750 °C in a cyclic test rig with 48 h cycles. The corrosion damage was studied on NiCoCrAlY-coated specimens, thin APS TBC specimens, and thick APS TBC specimens. Water vapor was found to have very minor influence on the oxidation, while sodium sulfate increased the TGO thickness both for NiCoCrAlY specimens and TBC-coated specimens; the influence of the TBC thickness was found to be very small. Sodium sulfate promoted thicker TGO; more Cr-rich TGO; the formation of Y oxides, and internally, Y sulfides; pore formation in the coating as well as in the substrate; and the formation of a Cr-depleted zone in the substrate.

  20. Influence of the nonmagnetic impurities on the spin-1 Heisenberg chain SrNi2V2O8 system

    NASA Astrophysics Data System (ADS)

    Giapintzakis, J.; Androulakis, J.; Syskakis, E.; Papageorgiou, Th. P.; Apostolopoulos, G.; Thanos, S.; Papastaikoudis, C.

    Dc-magnetization and heat capacity measurements on polycrystalline samples of SrNi2-x Mgx V2O8 (x = 0 and 0.05) are reported. The magnetization data suggest that both compounds are S = 1 quasi one-dimensional Heisenberg antiferromagnets. The substitution of non-magnetic impurity Mg2+ ions for Ni2+ induces a magnetic phase transition at ?3.7 K. A simple Hamiltonian model is proposed for these systems giving good quantitative agreement with the experimental magnetization data. The intrachain magnetic exchange constant (J 1/k B) and the Haldane gap (? ) for both compounds are estimated to be ?105 K and ?58.3 K (5.02 meV), respectively.

  1. Elastic scattering and total reaction cross section for the {sup 6}He+{sup 58}Ni system

    SciTech Connect

    Morcelle, V.; Lichtenthäler, R.; Lépine-Szily, A.; Guimarães, V.; Gasques, L.; Scarduelli, V.; Condori, R. Pampa; Leistenschneider, E.; Mendes Jr, D. R.; Faria, P. N. de; Pires, K. C. C.; Barioni, A.; Morais, M. C.; Shorto, J. M. B.; Zamora, J. C.

    2014-11-11

    Elastic scattering measurements of {sup 6}He + {sup 58}Ni system have been performed at the laboratory energy of 21.7 MeV. The {sup 6}He secondary beam was produced by a transfer reaction {sup 9}Be ({sup 7}Li, {sup 6}He) and impinged on {sup 58}Ni and {sup 197}Au targets, using the Radioactive Ion Beam (RIB) facility, RIBRAS, installed in the Pelletron Laboratory of the Institute of Physics of the University of São Paulo, Brazil. The elastic angular distribution was obtained in the angular range from 15° to 80° in the center of mass frame. Optical model calculations have been performed using a hybrid potential to fit the experimental data. The total reaction cross section was derived.

  2. Simulation of atomic diffusion in the Fcc NiAl system: A kinetic Monte Carlo study

    SciTech Connect

    Alfonso, Dominic R.; Tafen, De Nyago

    2015-04-28

    The atomic diffusion in fcc NiAl binary alloys was studied by kinetic Monte Carlo simulation. The environment dependent hopping barriers were computed using a pair interaction model whose parameters were fitted to relevant data derived from electronic structure calculations. Long time diffusivities were calculated and the effect of composition change on the tracer diffusion coefficients was analyzed. These results indicate that this variation has noticeable impact on the atomic diffusivities. A reduction in the mobility of both Ni and Al is demonstrated with increasing Al content. As a result, examination of the pair interaction between atoms was carried out for the purpose of understanding the predicted trends.

  3. The role of the non-magnetic material in spin pumping and magnetization dynamics in NiFe and CoFeB multilayer systems

    SciTech Connect

    Ruiz-Calaforra, A. Brächer, T.; Lauer, V.; Pirro, P.; Heinz, B.; Geilen, M.; Chumak, A. V.; Conca, A.; Leven, B.; Hillebrands, B.

    2015-04-28

    We present a study of the effective magnetization M{sub eff} and the effective damping parameter α{sub eff} by means of ferromagnetic resonance spectroscopy on the ferromagnetic (FM) materials Ni{sub 81}Fe{sub 19} (NiFe) and Co{sub 40}Fe{sub 40}B{sub 20} (CoFeB) in FM/Pt, FM/NM, and FM/NM/Pt systems with the non-magnetic (NM) materials Ru, Cr, Al, and MgO. Moreover, for NiFe layer systems, the influence of interface effects is studied by way of thickness dependent measurements of M{sub eff} and α{sub eff}. Additionally, spin pumping in NiFe/NM/Pt is investigated by means of inverse spin Hall effect (ISHE) measurements. We observe a large dependence of M{sub eff} and α{sub eff} of the NiFe films on the adjacent NM layer. While Cr and Al do not induce a large change in the magnetic properties, Ru, Pt, and MgO affect M{sub eff} and α{sub eff} in different degrees. In particular, NiFe/Ru and NiFe/Ru/Pt systems show a large perpendicular surface anisotropy and a significant enhancement of the damping. In contrast, the magnetic properties of CoFeB films do not have a large influence of the NM adjacent material and only CoFeB/Pt systems present an enhancement of α{sub eff}. However, this enhancement is much more pronounced in NiFe/Pt. By the introduction of the NM spacer material, this enhancement is reduced. Furthermore, a difference in symmetry between NiFe/NM/Pt and NiFe/NM systems in the output voltage signal from the ISHE measurements reveals the presence of spin pumping into the Pt layer in all-metallic NiFe/NM/Pt and NiFe/Pt systems.

  4. Phase and structural stability in Ni-Al systems from first principles

    NASA Astrophysics Data System (ADS)

    Goiri, Jon Gabriel; Van der Ven, Anton

    2016-09-01

    We report on a comprehensive first-principles study of phase stability in the Ni-Al binary, both at zero Kelvin and at finite temperature. First-principles density functional theory calculations of the energies of enumerated orderings on fcc and the sublattices of B2 not only predict the stability of known phases, but also reveal the stability of a family of ordered phases that combine features of L 12 and L 10 in different ratios to adjust their overall composition. The calculations also confirm the stability of vacancy ordered B2 derivatives that are stable in the Al-rich half of the phase diagram. We introduce strain order parameters to systematically analyze instabilities with respect to the Bain path connecting the fcc and bcc lattices. Many unstable orderings on both fcc and bcc are predicted around compositions of xNi=0.625 , where a martensitic phase transformation is known to occur. Cluster expansion techniques together with Monte Carlo simulations were used to calculate a finite-temperature-composition phase diagram of the Ni-Al binary. The calculated phase diagram together with an analysis of Bain instabilities reveals the importance of anharmonicity in determining the phase bounds between the B2 based β phase and the L 12 based γ' phase, as well as properties related to martensitic transformations that are observed upon quenching Ni-rich β .

  5. Systematics of Ni, Co, Cr and V in Olivine from Planetary Melt Systems: Martian Basalts

    NASA Technical Reports Server (NTRS)

    Herd, C. D. K.; Jones, J. H.; Shearer, C. K.; Papike, J. J.

    2001-01-01

    Secondary Ion Mass Spectrometry (SIMS) data for Ni, Co, Cr, and V in olivine in martian basalts is compared to data from lunar and terrestrial basalts. We use experimentally-derived and published D values to calculate as-yet unsampled, olivine-bearing, non-cumulus melt compositions. Additional information is contained in the original extended abstract.

  6. Electrodeposition of nanocrystalline Ni-W coatings with citric acid system.

    PubMed

    Du, Jingjing; Xu, Lijian; Chen, Baizhen; De, Li

    2013-01-01

    Ni-W alloy coatings were prepared by electrodeposition technique with citric acid as a complexing agent. The influence of the main technical parameters on W content in the Ni-W alloy coatings were investigated by electron dispersive spectroscopy (EDS), and the microstructure of the coatings was characterized and analyzed by employing X-ray diffractometer (XRD), scanning electron microscope (SEM). The results showed that bright and compact Ni-W alloy coatings with 25.78 wt% W were obtained when the concentration of Na2WO4 x 2H2O was 50 g/L, the concentration of NH4Cl was 20 g/L, the bath pH value was 8.0 and the bath temperature was 70 degrees C. The surface of Ni-W alloy coatings were bright, flat and compact, the mircostructure of the alloy coatings were nanocrystalline and the average grain size was about 38 nm by calculating using Scherrer Equation.

  7. Highly processable bulk metallic glass-forming alloys in the Pt-Co-Ni-Cu-P system

    NASA Astrophysics Data System (ADS)

    Schroers, Jan; Johnson, William L.

    2004-05-01

    Highly processable bulk metallic glass alloys in the Pt-Co-Ni-Cu-P system were discovered. The alloys show low liquidus temperature below 900 K, excellent processability with low critical cooling rate reflecting in maximum casting thicknesses in quartz tubes of up to 20 mm, and a large supercooled liquid region. The Pt57.5Cu14.7Ni5.3P22.5 composition has a liquidus temperature of 795 K, a glass transition temperature of 508 K with a supercooled liquid region of 98 K. For medical and jewelry applications a Ni-free alloy, Pt60Cu16Co2P22 was discovered with a liquidus temperature of 881 K, a glass transition temperature of 506 K, and a supercooled liquid region of 63 K. Glass formation was observed in a wider composition range. Vickers hardness of these alloys is in the 400 Hv range. The alloys can be processed in the supercooled liquid region in air without any measurable oxidation. In this region, a large processing window is available in which the material does not embrittle. Embrittlement in these alloys is correlated with crystallization. It can be avoided as long as substantial crystallization does not take place during isothermal processing in the supercooled liquid region. Also, liquid processing can be performed in air when flux with B2O3.

  8. Mg substitution effect on the hydrogenation behaviour, thermodynamic and structural properties of the La{sub 2}Ni{sub 7}-H(D){sub 2} system

    SciTech Connect

    Denys, R.V.; Riabov, A.B.; Yartys, V.A. Sato, Masashi; Delaplane, R.G.

    2008-04-15

    The present work is focused on studies of the influence of magnesium on the hydrogenation behaviour of the (La,Mg){sub 2}Ni{sub 7} alloys. Substitution of La in La{sub 2}Ni{sub 7} by Mg to form La{sub 1.5}Mg{sub 0.5}Ni{sub 7} preserves the initial Ce{sub 2}Ni{sub 7} type of the hexagonal P6{sub 3}/mmc structure and leads to contraction of the unit cell. The system La{sub 1.5}Mg{sub 0.5}Ni{sub 7}-H{sub 2} (D{sub 2}) was studied using in situ synchrotron X-ray and neutron powder diffraction in H{sub 2}/D{sub 2} gas and pressure-composition-temperature measurements. La replacement by Mg was found to proceed in an ordered way, only within the Laves-type parts of the hybrid crystal structure, yielding formation of LaMgNi{sub 4} slabs with statistic and equal occupation of one site by La and Mg atoms. Mg alters structural features of the hydrogenation process. Instead of a strong unilateral anisotropic expansion which takes place on hydrogenation of La{sub 2}Ni{sub 7}, the unit cell of La{sub 1.5}Mg{sub 0.5}Ni{sub 7}D{sub 9.1} is formed by nearly equal hydrogen-induced expansions proceeding in the basal plane ({delta}a/a=7.37%) and along [001] ({delta}c/c=9.67%). In contrast with La{sub 2}Ni{sub 7}D{sub 6.5} where only LaNi{sub 2} layers absorb hydrogen atoms, in La{sub 1.5}Mg{sub 0.5}Ni{sub 7}D{sub 9.1} both LaNi{sub 5} and LaMgNi{sub 4} layers become occupied. Nine types of sites were found to be filled by D in total, including tetrahedral (La,Mg){sub 2}Ni{sub 2}, (La,Mg)Ni{sub 3}, Ni{sub 4}, tetragonal pyramidal La{sub 2}Ni{sub 3} and trigonal bipyramidal (La,Mg){sub 3}Ni{sub 2} interstices. The hydrogen sublattice around the La/Mg site shows formation of two co-ordination spheres of D atoms: an octahedron MgD{sub 6} and a 16-vertex polyhedron LaD{sub 16} around La. The interatomic distances are in the following ranges: La-D (2.28-2.71), Mg-D (2.02-2.08), Ni-D (1.48-1.86 A). All D-D distances exceed 1.9 A. Thermodynamic PCT studies yielded the following values for the

  9. Mg substitution effect on the hydrogenation behaviour, thermodynamic and structural properties of the La 2Ni 7-H(D) 2 system

    NASA Astrophysics Data System (ADS)

    Denys, R. V.; Riabov, A. B.; Yartys, V. A.; Sato, Masashi; Delaplane, R. G.

    2008-04-01

    The present work is focused on studies of the influence of magnesium on the hydrogenation behaviour of the (La,Mg) 2Ni 7 alloys. Substitution of La in La 2Ni 7 by Mg to form La 1.5Mg 0.5Ni 7 preserves the initial Ce 2Ni 7 type of the hexagonal P6 3/ mmc structure and leads to contraction of the unit cell. The system La 1.5Mg 0.5Ni 7-H 2 (D 2) was studied using in situ synchrotron X-ray and neutron powder diffraction in H 2/D 2 gas and pressure-composition-temperature measurements. La replacement by Mg was found to proceed in an ordered way, only within the Laves-type parts of the hybrid crystal structure, yielding formation of LaMgNi 4 slabs with statistic and equal occupation of one site by La and Mg atoms. Mg alters structural features of the hydrogenation process. Instead of a strong unilateral anisotropic expansion which takes place on hydrogenation of La 2Ni 7, the unit cell of La 1.5Mg 0.5Ni 7D 9.1 is formed by nearly equal hydrogen-induced expansions proceeding in the basal plane (Δ a/ a=7.37%) and along [001] (Δ c/ c=9.67%). In contrast with La 2Ni 7D 6.5 where only LaNi 2 layers absorb hydrogen atoms, in La 1.5Mg 0.5Ni 7D 9.1 both LaNi 5 and LaMgNi 4 layers become occupied. Nine types of sites were found to be filled by D in total, including tetrahedral (La,Mg) 2Ni 2, (La,Mg)Ni 3, Ni 4, tetragonal pyramidal La 2Ni 3 and trigonal bipyramidal (La,Mg) 3Ni 2 interstices. The hydrogen sublattice around the La/Mg site shows formation of two co-ordination spheres of D atoms: an octahedron MgD 6 and a 16-vertex polyhedron LaD 16 around La. The interatomic distances are in the following ranges: La-D (2.28-2.71), Mg-D (2.02-2.08), Ni-D (1.48-1.86 Å). All D-D distances exceed 1.9 Å. Thermodynamic PCT studies yielded the following values for the Δ H and Δ S of hydrogenation/decomposition; Δ HH=-15.7±0.9 kJ (mol H) -1 and Δ SH=-46.0±3.7 J (K mol H) -1 for H 2 absorption, and Δ HH=16.8±0.4 kJ (mol H) -1 and Δ SH=48.1±1.5 J (K mol H) -1 for H 2 desorption.

  10. Oxygen impurity effects at metal/silicide interfaces - Formation of silicon oxide and suboxides in the Ni/Si system

    NASA Technical Reports Server (NTRS)

    Grunthaner, P. J.; Grunthaner, F. J.; Scott, D. M.; Nicolet, M.-A.; Mayer, J. W.

    1981-01-01

    The effect of implanted oxygen impurities on the Ni/Ni2Si interface is investigated using X-ray photoelectron spectroscopy, He-4(+) backscattering and O(d, alpha)-16 N-14 nuclear reactions. Oxygen dosages corresponding to concentrations of 1, 2, and 3 atomic percent were implanted into Ni films evaporated on Si substrates. The oxygen, nickel, and silicon core lines were monitored as a function of time during in situ growth of the Ni silicide to determine the chemical nature of the diffusion barrier which forms in the presence of oxygen impurities. Analysis of the Ni, Si, and O core levels demonstrates that the formation of SiO2 is responsible for the Ni diffusion barrier rather than Ni oxide or mixed oxides, such as Ni2SiO4. It is determined that 2.2 x 10 to the 16th O/qu cm is sufficient to prevent Ni diffusion under UHV annealing conditions.

  11. Simulation of atomic diffusion in the Fcc NiAl system: A kinetic Monte Carlo study

    DOE PAGES

    Alfonso, Dominic R.; Tafen, De Nyago

    2015-04-28

    The atomic diffusion in fcc NiAl binary alloys was studied by kinetic Monte Carlo simulation. The environment dependent hopping barriers were computed using a pair interaction model whose parameters were fitted to relevant data derived from electronic structure calculations. Long time diffusivities were calculated and the effect of composition change on the tracer diffusion coefficients was analyzed. These results indicate that this variation has noticeable impact on the atomic diffusivities. A reduction in the mobility of both Ni and Al is demonstrated with increasing Al content. As a result, examination of the pair interaction between atoms was carried out formore » the purpose of understanding the predicted trends.« less

  12. Sustainability assessment and comparison of waste management systems: The Cities of Sofia and Niš case studies.

    PubMed

    Milutinović, Biljana; Stefanović, Gordana; Kyoseva, Vanya; Yordanova, Dilyana; Dombalov, Ivan

    2016-09-01

    Sustainability assessment of a waste management system is a very complex problem for numerous reasons. Firstly, it is a problem of environmental assessment, economic viability and social acceptability, and also a choice of the most practical waste treatment technique, taking into account all the specific areas in which a waste management system is implemented. For these reasons, among others, it is very important to benchmark, cooperate and exchange experiences in areas with similar characteristics. In this study, a comparison of waste management scenarios in the Cities of Niš and Sofia was performed. Based on the amount and composition of municipal solid waste, and taking into account local specifics (economic conditions, social acceptance, etc.), different scenarios were developed: landfilling without energy recovery, landfilling with energy recovery, mechanical-biological treatment, anaerobic digestion with biogas utilization and incineration with energy recovery. Scenario ranking was done using multi-criteria analysis and 12 indicators were chosen as the criteria. The obtained results show that the most sustainable scenario in both case studies is the mechanical-biological treatment (recycling, composting and Refuse Derived Fuel production). Having in mind that this scenario is the current waste management system in Sofia, these results can help decision-makers in the City of Niš in choosing a successful and sustainable waste management system.

  13. An investigation of electrical current induced phase transformations in the NiPtSi/polysilicon system

    NASA Astrophysics Data System (ADS)

    Kim, Deok-kee; Domenicucci, Anthony; Iyer, Subramanian S.

    2008-04-01

    We studied phase transformations and microstructural changes of NiPtSi/polysilicon fuses programmed with three different current densities (under, optimal, and over programming). Electromigration of NiPt toward the anode occurred in all three cases studied. Achieving high resistance after the fuse programming strongly depends on the kinetics of the electromigration and dopant diffusion processes which operate during the fuse blow. A thick silicide region was formed after electrically programmable fuse programming by the reaction of the electromigrated NiPt with the polysilicon layer underneath. The low tails of the underprogrammed fuses seemed to result from the incomplete electromigration and the incomplete dopant depletion due to the insufficient programming current density, while the depletion of the implanted dopants due to the sufficiently elevated temperature seemed to make the postresistance of the optimally programmed fuse higher. In the overprogrammed fuse, the newly formed silicide seemed to have further electromigrated due to the sufficiently high temperature during programming, which caused voids and hillocks. The high temperature caused melting of the polysilicon and the surrounding nitride layer, and their reaction as well. The conduction paths created by the unremoved silicide in fuse link caused the postprogramming resistance of the overprogrammed fuse to be low.

  14. Thermal stability and degradation mechanism of NiFe/Cu giant magnetoresistance multilayer systems

    NASA Astrophysics Data System (ADS)

    Hecker, M.; Tietjen, D.; Schneider, C. M.; Cramer, N.; Malkinski, L.; Camley, R. E.; Celinski, Z.

    2002-05-01

    Ni80Fe20/Cu multilayers show large giant magnetoresistance (GMR) at low magnetic saturation fields. The GMR signal is known to degrade irreversibly at elevated temperatures. Clarification of the relevant deterioration mechanisms refines our basic understanding of the GMR effect and may help to improve the thermal stability of devices. We therefore investigated structural, transport, and magnetic properties of sputtered Ni80Fe20/Cu multilayers in the as-deposited state and after different anneals (up to 600 °C) by x-ray techniques, transport measurements, ferromagnetic resonance (FMR), and magneto-optical Kerr effect (MOKE). Multilayers with the second maximum of the antiferromagnetic (afm) coupling showed a sharp drop of the GMR at about 250 °C. The changes of the transport properties were associated with a series of structural alterations. These ranged from grain growth and defect reduction through texture sharpening and stress evolution up to the onset of interdiffusion. Interdiffusion changed the NiFe layer composition and the interface structure and finally caused layer intermixing with a loss of the former multilayer structure. Further insight into the magnetic behavior was gained from FMR and MOKE measurements, from which we determined the in-plane magnetic anisotropies, the strength of the afm coupling (bilinear and biquadratic), and the homogeneity of the layer magnetization as a function of the annealing temperature.

  15. Properties and structure of carbon nanotubes in the system C-Ni

    NASA Astrophysics Data System (ADS)

    Czerwosz, E.; Keczkowska, J.; Kowalska, E.; Kozłowski, M.; Radomska, J.; Suchańska, M.; Wronka, H.

    2014-11-01

    We present results of Raman studies of CNT-Ni films obtained in two steps method. In the first step an initial nanocomposite Ni-C film (produced by PVD method) was prepared. This initial film has multiphase composite-like structure with nanograins of fullerenes, amorphous carbon and nickel. In the second step CNTs were obtained by CVD method. In this process the initial films were placed in a quartz tube reactor where pyrolysis process were performed in xylene. Decomposition of xylene at 650°C was occurred. Products of this CVD decomposition process take part in nanotubes growth on Ni nanograins. These nanograins play a role of a catalyser of the growth process. SEM observations showed that form of nanotubes obtained with the various CVD process parameters is similar. Raman studies of initial films (obtained PVD process) confirm the presence of fullerenes C60 in and some forms of graphite-like objects in the samples. Raman spectra of MWCNTs films contained: bands characteristic for carbon nanotube's vibrations.

  16. Sub-barrier fusion of {sup 36}S + {sup 64}Ni and other medium-light systems

    SciTech Connect

    Montagnoli, G.; Scarlassara, F.; Stefanini, A. M.; Corradi, L.; Fioretto, E.; Silvestri, R.; Courtin, S.; Haas, F.; Lebhertz, D.; Szilner, S.

    2010-12-15

    Sub-barrier fusion cross sections of {sup 36}S + {sup 64}Ni have been measured down to {approx_equal}3 {mu}b. The logarithmic slope of the fusion excitation function has a steep rise in the barrier region with decreasing energy and saturates at lower energies. The data can be reproduced within the coupled-channels model using a Woods-Saxon potential with a large diffuseness. The slope saturation is analogous to what has been observed for {sup 36}S, {sup 48}Ca + {sup 48}Ca, while for heavier systems the slope increases steadily below the barrier.

  17. The use of diffusion multiples to explore the Co-Cr-Fe-Mn-Ni high entropy system

    NASA Astrophysics Data System (ADS)

    Wilson, Paul Nathaniel

    High entropy alloys (HEAs) or Multi-principal element alloys (MEAs) are a relatively new class of alloys. These alloys are defined as having at least five major alloying elements in atomic percent from 5% to 35%. There are hundreds of thousands of equiatomic compositions possible and only a fraction have been explored. This project examines diffusion multiples as a method to accelerate alloy development in these systems. The system chosen for this experiment is the Co-Cr-Fe-Mn-Ni system. The methodology developed for creating these diffusion multiples involved a two-step process. In the first step two binary alloys (50at-% Fe-Mn and 50 at%- Ni-Co ) were diffusion bonded together. In the second step, under uniaxial compression, was used to bond Cr to diffusion couple prepared in Step I. Successful diffusion multiples were created by this method. An auxiliary method named differential melting liquid impingement (DMLI) was developed that created diffusion multiples using liquid processing methods that will be described. After creation of these multiples, the ternary and quinary interface regions were examined using scanning electron microscopy (SEM), transmission electron microscopy (TEM), energy dispersive spectroscopy (EDS), and nanoindentation. The Cr/NiCo region experienced interdiffusion but no intermediate phase formation retaining the FCC / BCC interface at the hot-pressing temperature (1200 °C). However, upon cooling from 1200 °C, the BCC region adjacent to the interface decomposed into BCC + sigma. In contrast, the Cr/FeMn interface region developed a layered structure of FCC/sigma/BCC suggesting that sigma is stable at 1200 °C in contradiction to the published 1200 °C ternary phase diagram. Upon cooling, the sigma present at 1200 °C decomposed into FCC + sigma, except in samples that were contaminated with C; in those cases, FCC + M23C6 was observed as the decomposition product. The quinary regions were evaluated using the various HEA parameters, namely

  18. The influence of transfer reactions on the sub-barrier fusion enhancement in the systems {sup 58.64}Ni +, {sup 92,100}Mo

    SciTech Connect

    Rehm, K.E.; Jiang, C.L.; Esbensen, H.

    1995-08-01

    High resolution experiments performed during the past few years demonstrated that the various reaction modes occurring in heavy ion collisions can strongly influence each other. This interrelation of the different reaction modes brings a nuclear structure dependence to the fusion and deep-inelastic channels that were previously described in the framework of pure statistical models. In order to fully understand the interrelation between these reaction channels, a complete set of measurements including elastic and inelastic scattering, few-nucleon transfer and fusion is required. In continuation of our earlier measurements of the fusion cross sections in the system {sup 58,64}Ni + {sup 92,100}Mo we finished the studies of the quasielastic process in these systems. The experiments were done in inverse reaction kinematics using the split-pole spectrograph with its hybrid focal-plane detector for particle identification. The experiments with {sup 100}Mo beams were performed previously. First test runs with {sup 92}Mo showed the possible interference with {sup 98}Mo ions which could be eliminated by using the 13{sup +} charge state from the ECR source. The data from these experiments were completely analyzed. The smallest transfer cross sections are observed for the systems {sup 64}Ni + {sup 100}Mo and {sup 58}Ni + {sup 92}Mo, i.e., the most neutron-rich and neutron-deficient systems, respectively. For the other systems, {sup 64}Ni + {sup 92}Mo and {sup 58}Ni + {sup 100}Mo, the transfer cross sections at energies close to the barrier are about of equal magnitude. This observation does not correlate with the deviation of the experimental fusion cross sections from the coupled-channels predictions. While for {sup 58}Ni + {sup 100}Mo discrepancies between the experimental and theoretical fusion cross sections are observed, the system {sup 64}Ni + {sup 92}Mo which shows about the same transfer yields, is quite well described by the coupled-channels calculations.

  19. Improving simulation of El Niño Impacts on summer cropping systems of the Iberian Peninsula

    NASA Astrophysics Data System (ADS)

    Capa-Morocho, Mirian; Ruiz-Ramos, Margarita; Rodríguez-Fonseca, Belén

    2013-04-01

    El Niño event is a main driver of seasonal climate variability that greatly impacts agriculture and regional economies (Legler et al., 1999). The relationships found between El Niño and yield can be helpful to anticipate yield anomalies (higher or lower than usual) what can help us to adapt crop systems in advance: insurance coverage, changes in sowing dates, choice of species and varieties, as well as changes in the management of fertilization and irrigation and the establishment of an early warning system. In a previous work, we found that the ENSO affects maize yield differently depending on the location in the Iberian Peninsula (Capa et al., 2012), using observed data series for periods ranging from 22 to 46 years. The specific objective of this work is 1) to confirm these results using a longer time series from re-analysis data; 2) to evaluate the yield simulations done with re-analysis regarding observed crops yields and simulations obtained with observed climate data; and 3) to use re-analysis climate data to help to explain the mechanism of the influence of El Niño. Crop yield was simulated with the ecophysiological crop model CERES-maize, included in DSSAT v.4.5 (Decision Support System for Agrotechnology Transfer). To simulate maize yields, re-analysis daily data of radiation, maximum and minimum temperature and precipitation were used. The re-analysis climate data were obtained from NCEP/NCAR 40-year reanalysis project (NOAA National Center for Environmental Prediction) and ECMWF Data server (European Centre for Medium-Range Weather Forecasts: ERA 40 and ERA Interim). Simulations were made on three locations where site- specific calibrations were done and validated with independent field data: Lugo (northwestern), Getafe (centre) and Albacete (southeastern Spain). Re-analysis data confirm the preliminary results obtained with observed data (AEMET): El Niño phenomenon affects irrigated maize depending on the location in the Iberian Peninsula. Also

  20. Predicting stochastic systems by noise sampling, and application to the El Niño-Southern Oscillation.

    PubMed

    Chekroun, Mickaël David; Kondrashov, Dmitri; Ghil, Michael

    2011-07-19

    Interannual and interdecadal prediction are major challenges of climate dynamics. In this article we develop a prediction method for climate processes that exhibit low-frequency variability (LFV). The method constructs a nonlinear stochastic model from past observations and estimates a path of the "weather" noise that drives this model over previous finite-time windows. The method has two steps: (i) select noise samples--or "snippets"--from the past noise, which have forced the system during short-time intervals that resemble the LFV phase just preceding the currently observed state; and (ii) use these snippets to drive the system from the current state into the future. The method is placed in the framework of pathwise linear-response theory and is then applied to an El Niño-Southern Oscillation (ENSO) model derived by the empirical model reduction (EMR) methodology; this nonlinear model has 40 coupled, slow, and fast variables. The domain of validity of this forecasting procedure depends on the nature of the system's pathwise response; it is shown numerically that the ENSO model's response is linear on interannual time scales. As a result, the method's skill at a 6- to 16-month lead is highly competitive when compared with currently used dynamic and statistic prediction methods for the Niño-3 index and the global sea surface temperature field. PMID:21730171

  1. Experiments on Lunar Core Composition: Phase Equilibrium Analysis of A Multi-Element (Fe-Ni-S-C) System

    NASA Technical Reports Server (NTRS)

    Go, B. M.; Righter, K.; Danielson, L.; Pando, K.

    2015-01-01

    Previous geochemical and geophysical experiments have proposed the presence of a small, metallic lunar core, but its composition is still being investigated. Knowledge of core composition can have a significant effect on understanding the thermal history of the Moon, the conditions surrounding the liquid-solid or liquid-liquid field, and siderophile element partitioning between mantle and core. However, experiments on complex bulk core compositions are very limited. One limitation comes from numerous studies that have only considered two or three element systems such as Fe-S or Fe-C, which do not supply a comprehensive understanding for complex systems such as Fe-Ni-S-Si-C. Recent geophysical data suggests the presence of up to 6% lighter elements. Reassessments of Apollo seismological analyses and samples have also shown the need to acquire more data for a broader range of pressures, temperatures, and compositions. This study considers a complex multi-element system (Fe-Ni-S-C) for a relevant pressure and temperature range to the Moon's core conditions.

  2. Geodynamics of magmatic Cu-Ni-PGE sulfide deposits: new insights from the Re-Os isotope system

    USGS Publications Warehouse

    Lambert, D.D.; Foster, J.G.; Frick, L.R.; Ripley, E.M.; Zientek, M.L.

    1998-01-01

    In this study, we reassess crustal contamination and sulfide ore-forming processes in some of the largest magmatic ore deposits, using published Re-Os isotope data and a modeling methodology that incorporates the R factor, defined as the effective mass of silicate magma with which a given mass of sulfide magma has equilibrated, in an Re-Os isotope mixing equation. We show that there is less disparity between conclusions based on Re-Os isotope data compared to other isotopic systems if the R factor is considered, Komatiite-associated Ni sulfide ore systems typically have high Os concentrations, low Re/Os ratios, and near-chondritic initial Os isotope compositions. For magmatic sulfide ores that are interpreted to have experienced relatively low R factors (2,000). Sulfide saturation in these ore systems may, therefore, have been achieved via changes in intensive parameters of the komatiite lavas (cooling or decompression) or changes in compositional parameters transparent to the Re-Os isotope system (e.g., fo2/fs2/fH2O)- Basalt-gabbro-associated Cu-Ni sulfide ore systems at Duluth, Sudbury, and Stillwater are quite distinct from those at Kambalda by having comparatively low Os concentrations, high Re/Os ratios, and high initial Os isotope compositions, These chemical and isotopic characteristics are indicative of significant interactions between their parental basaltic magmas and old crust because there are no known mantle reservoirs with such extreme geocheinical characteristics. Our modeling suggests that for Cu-Ni sulfide ores at Duluth, Sudbury, and Stillwater to maintain the observed high initial Os isotope compositions inherited from a crustal contaminant, R factors for these systems must have been low (< 10,000), consistent with their low metal concentrations. Thus, we interpret this style of base metal sulfide mineralization to be derived from crustally contaminated but less dynamic magmatic systems that did not permit extensive equilibration of sulfide magma

  3. Intermixing at Ni n/Cu( 0 0 1 ) interface and its effects on the magnetic properties of Ni

    NASA Astrophysics Data System (ADS)

    Yang, Zongxian; Wu, Ruqian

    2002-01-01

    Effects of interfacial interdiffusion on electronic and magnetic properties of Ni n/Cu(0 0 1) system are studied by using the full-potential linearized-augmented-plane-wave method with the generalized-gradient approximation for the exchange correlation interactions. Three systems, namely NiCu/Cu(0 0 1), Ni 3/NiCu/Cu(0 0 1), and NiCu/Ni 3/Cu(0 0 1) are used to simulate the intermixing in Ni n/Cu(0 0 1). Ni atoms in NiCu/Cu(0 0 1) are magnetically dead, while magnetic moment of Ni atom is significantly reduced in the alloy layer to 0.19 μB/atom in Ni 3/NiCu/Cu(0 0 1) and to 0.57 μB/atom in NiCu/Ni 3/Cu(0 0 1).

  4. Performance of two-layer thermal barrier systems on directionally solidified Ni-Al-Mo and comparative effects of alloy thermal expansion on system life

    NASA Technical Reports Server (NTRS)

    Stecura, S.

    1980-01-01

    A promising two-layer thermal barrier coating system (TBS), Ni-16.4Cr-5.1A1-0.15Y/ZrO2-6.1Y2O3 (all in weight percent), was identified for directionally solidified Ni-Al-Mo (gamma/gamma' alpha). In cyclic furnace tests at 1095 C this system on gamma/gamma' alpha was better than Ni-16. 4Cr-5.1Al-0.15Y/ZrO2-7.8Y2O3 by about 50 percent. In natural gas - oxygen torch rig tests at 1250 C the ZrO2-6.1Y2O3 coating was better than the ZrO2-7.8Y2O3 coating by 95 percent, on MAR-M509 substrates and by 60 percent on gamma/gamma' alpha substrates. Decreasing the coefficient of thermal expansion of the substrate material from 17-18x10 to the -6 power/C (MAR-M200 + Hf and MAR-M509) to 11x10 to the -6 power/C (gamma/gamma' alpha) also resulted in improved TBS life. For example, in natural gas - oxygen torch rig tests at 1250 C, the life of Ni-16.4Cr-5.1Al-0.15Y/ZrO26.1Y2O3 was about 30 percent better on gamma/gamma' alpha than on MAR-M509 substrates. Thus compositional changes in the bond and thermal barrier coatings were shown to have a greater effect on TBS life than does the coefficient of thermal expansion.

  5. Petrogenesis of the Ni-Cu-PGE sulfide-bearing Tamarack Intrusive Complex, Midcontinent Rift System, Minnesota

    NASA Astrophysics Data System (ADS)

    Taranovic, Valentina; Ripley, Edward M.; Li, Chusi; Rossell, Dean

    2015-01-01

    The Tamarack Intrusive Complex (TIC, 1105.6 ± 1.2 Ma) in NE Minnesota, was emplaced during the early stages of the development of the Midcontinent Rift System (MRS, "Early Stage": 1110-1106 Ma). Country rocks of the TIC are those of the Paleoproterozoic Thomson Formation, part of the Animikie Group including sulfide-bearing metasedimentary black shale. The magmatic system is composed of at least two principal mafic-ultramafic intrusive sequences: the sulfide-barren Bowl Intrusion in the south and the "dike" area intrusions in the north which host Ni-Cu-Platinum Group Elements (PGE) mineralization with up to 2.33% Ni, 1.24% Cu, 0.34 g/t Pt, 0.23 g/t Pd and 0.18 g/t Au. Two distinct intrusive units in the "dike" area are the CGO (coarse-grained olivine-bearing) Intrusion, a sub-vertical dike-like body, and the overlying sub-horizontal FGO (fine-grained olivine-bearing) Intrusion. Both intrusions comprise peridotite, feldspathic peridotite, feldspathic pyroxenite, melatroctolite and melagabbro. Massive sulfides are volumetrically minor and mainly occur as lenses emplaced into the country rocks associated with both intrusions. Semi-massive (net-textured) sulfides are distributed at the core of the CGO Intrusion, surrounded by a halo of the disseminated sulfides. Disseminated sulfides also occur in lenses along the base of the FGO Intrusion. Olivine compositions in the CGO Intrusion are between Fo89 and Fo82 and in the FGO Intrusion from Fo84 to Fo82. TIC intrusions have more primitive olivine compositions than that of olivine in the sheet-like intrusions in the Duluth Complex (below Fo70), as well as olivine from the smaller, conduit-related, Eagle and East Eagle Intrusions in Northern Michigan (Fo86 to Fo75). The FeO/MgO ratios of the CGO and FGO Intrusion parental magmas, inferred from olivine compositions, are similar to those of picritic basalts erupted during the early stages of the MRS formation. Trace element ratios differ slightly from other intrusions in the

  6. Thermodynamic study of the NiO-MgO system in the temperature range 1,073 to 1,473 K by a galvanic cell technique

    SciTech Connect

    Jakobsson, A.; Sichen, D.; Seetharaman, S.

    1993-12-01

    In the present work, the thermodynamic activities of NiO in NiO-MgO solid solutions were measured by means of the ZrO{sub 2}-CaO solid-electrolyte galvanic cell method in the temperature range 1,073 to 1,473 K. The systems shows a near-ideal behavior, while at lower temperatures, the results are anomalous at a high MgO content. Lattice parameter measurements show that the system conforms to Vegard`s law. The enthalpies estimated from the present results are compared with previous work as well as those estimated from theoretical models. A complete thermodynamic description and a calculation of the phase diagram of the NiO-MgO system are enabled by the application of a two-sublattice model.

  7. Study of fatigue and fracture behavior of NbCr{sub 2}-based alloys: Phase stability in Nb-Cr-Ni ternary system

    SciTech Connect

    Zhu, J.H.; Liaw, P.K.; Liu, C.T.

    1997-12-01

    Phase stability in a ternary Nb-Cr-Ni Laves phase system was studied in this paper. Their previous study in NbCr{sub 2}-based transition-metal Laves phases has shown that the average electron concentration factor, e/a, is the dominating factor in controlling the phase stability of NbCr{sub 2}-based Laves phases when the atomic size ratios are kept identical. Since Ni has ten out-shell electrons, the substitution of Ni for Cr in NbCr{sub 2} will increase the average electron concentration of the alloy, thus leading to the change of the crystal structures from C15 to C14. In this paper, a number of pseudo-binary Nb(Cr,Ni){sub 2} alloys were prepared, and the crystal structures of the alloys after a long heat-treatment at 1000 C as a function of the Ni content were determined by the X-ray diffraction technique. The boundaries of the C15/C14 transition were determined and compared to their previous predictions. It was found that the electron concentration and phase stability correlation is obeyed in the Nb-Cr-Ni system. However, the e/a ratio corresponding to the C15/C14 phase transition was found to move to a higher value than the predicted one. The changes in the lattice constant, Vickers hardness and fracture toughness were also determined as a function of the Ni content, which were discussed in light of the phase stability difference of the alloys.

  8. Measurements of fusion cross sections in the systems {sup 58,64}Ni +, {sup 78,86}Kr

    SciTech Connect

    Rehm, K.E.; Jiang, C.L.; Esbensen, H.

    1995-08-01

    We investigated the nuclear structure dependence of the sub-barrier fusion enhancement in heavy-ion induced reactions by studying the systems {sup 58,64}Ni + {sup 78,86}Kr at energies in the vicinity of the Coulomb barrier. These {sup 78,86}Kr selected because, similar to the Mo case discussed isotopes were above, there are strong changes in nuclear structure as a function of the neutron number. However, contrary to Mo, where the {open_quotes}softness{close_quotes} of the nucleus increases with higher neutron number, the most collective nucleus for the Kr case is the neutron-deficient {sup 78}Kr. The experiment was performed with Kr beams from the positive-ion injector using enriched {sup 78,86}Kr gas in the ECR ion source. The separation of evaporation residues from the elastically-scattered particles was achieved by using their difference in time-of-flight and magnetic rigidity in the gas-filled spectrograph. The excitation functions for the four systems were compared to coupled-channels calculations including inelastic excitations of one- and two-phonon states in projectile and target. For systems involving {sup 86}Kr, good agreement between theory and experiment is obtained, while for {sup 78}Kr + {sup 58,64}Ni an additional enhancement of the cross sections persisted at the lowest energies. It was found that this fusion enhancement correlates with the nuclear structure of the individual nucleus. Characterizing the structure of vibrational even-even nuclei by their restoring force parameter C{sub 2}, which can be calculated from the energy of the lowest 2{sup +} state and the associated B(E2) value, one observes that nuclei with small C{sub 2} values exhibit a large sub-barrier fusion enhancement, while nuclei with high values of C{sub 2} (usually closed-shell nuclei), show smaller fusion yields.

  9. Heat-capacity and magnetic measurements on the Y(Ni2-xCox)B2C system

    NASA Astrophysics Data System (ADS)

    Hoellwarth, C. C.; Klavins, P.; Shelton, R. N.

    1996-02-01

    We have performed field- and temperature-dependent magnetization, resistivity, and heat-capacity measurements on polycrystalline samples of the Y(Ni2-xCox)B2C system with 0.0<=x<=0.4. Values of Tc,χ0,Hc2,ΘD, λ, and N(Ed) were determined for various samples. We observe that ΘD increases with x, while all the other parameters decrease with x. The Tc vs x data can be described using the BCS theory and the measured values of N(Ef) and ΘD. The results suggest that the decrease in Tc is due to the decrease in N(Ef), in agreement with the results from band structure calculations.

  10. Reaction of amorphous Ni-W and Ni-N-W films with substrate silicon

    NASA Technical Reports Server (NTRS)

    Zhu, M. F.; Suni, I.; Nicolet, M.-A.; Sands, T.

    1984-01-01

    Wiley et al. (1982) have studied sputtered amorphous films of Nb-Ni, Mo-Ni, Si-W, and Si-Mo. Kung et al. (1984) have found that amorphous Ni-Mo films as diffusion barriers between multilayer metallizations on silicon demonstrate good electrical and thermal stability. In the present investigation, the Ni-W system was selected because it is similar to the Ni-Mo system. However, W has a higher silicide formation temperature than Mo. Attention is given to aspects of sample preparation, sample characterization, the interaction between amorphous Ni-W films and Si, the crystallization of amorphous Ni(36)W(64) films on SiO2, amorphous Ni-N-W films, silicide formation and phase separation, and the crystallization of amorphous Ni(36)W(64) and Ni(30)N(21)W(49) layers.

  11. Preparation and property of duplex Ni-B-TiO2/Ni nano-composite coatings

    NASA Astrophysics Data System (ADS)

    Wang, Shu-Jen; Wang, Yuxin; Shu, Xin; Tay, Seeleng; Gao, Wei; Shakoor, R. A.; Kahraman, Ramazan

    2015-03-01

    The duplex Nickel-Boron-Titania/Nickel (Ni-B-TiO2/Ni) coatings were deposited on mild steel by using two baths with Ni as the inner layer. TiO2 nanoparticles were incorporated into the Ni-B coatings as the outer layer by using solid particle mixing method. The microstructure, morphology and corrosion resistance of the duplex Ni-B-TiO2/Ni nanocomposite coatings were systemically investigated. The results show that the duplex interface was uniform and the adhesion between two layers was very good. The microhardness of duplex Ni-B-TiO2/Ni coating was much higher than the Ni coating due to the outer layer of Ni-B-TiO2 coating. The corrosion resistance of the duplex Ni-B-TiO2/Ni coating was also significantly improved comparing with single Ni-B coating. The Ni-B-10 g/L TiO2/Ni coating was found to have the best corrosion resistance among these duplex coatings. This type of duplex Ni-B-TiO2/Ni coating, with high hardness and good corrosion resistance properties, should be able to find broad applications under adverse environmental conditions.

  12. Impacts of the 2015-2016 El Niño on the California Current System: Early assessment and comparison to past events

    NASA Astrophysics Data System (ADS)

    Jacox, Michael G.; Hazen, Elliott L.; Zaba, Katherine D.; Rudnick, Daniel L.; Edwards, Christopher A.; Moore, Andrew M.; Bograd, Steven J.

    2016-07-01

    The 2015-2016 El Niño is by some measures one of the strongest on record, comparable to the 1982-1983 and 1997-1998 events that triggered widespread ecosystem change in the northeast Pacific. Here we describe impacts of the 2015-2016 El Niño on the California Current System (CCS) and place them in historical context using a regional ocean model and underwater glider observations. Impacts on the physical state of the CCS are weaker than expected based on tropical sea surface temperature anomalies; temperature and density fields reflect persistence of multiyear anomalies more than El Niño. While we anticipate El Niño-related impacts on spring/summer 2016 productivity to be similarly weak, their combination with preexisting anomalous conditions likely means continued low phytoplankton biomass. This study highlights the need for regional metrics of El Niño's effects and demonstrates the potential to assess these effects before the upwelling season, when altered ecosystem functioning is most apparent.

  13. In situ spectroscopic detection of SMSI effect in a Ni/CeO2 system: hydrogen-induced burial and dig out of metallic nickel

    SciTech Connect

    Caballero, Alfonso; Holgado, Juan P.; Gonzalez-delaCruz, Victor M.; Habas, Susan e.; Herranz, Tirma; Salmeron, Miquel

    2010-06-29

    In situ APPES technique demonstrates that the strong metal support interaction effect (SMSI) in the Ni-ceria system is associated with the decoration and burial of metallic particles by the partially reduced support, a phenomenon reversible by evacuation at high temperature of the previously absorbed hydrogen.

  14. Internal nitridation of nickel-base alloys. Part 1: Behavior of binary and ternary alloys of the Ni-Cr-Al-Ti system

    SciTech Connect

    Krupp, U.; Christ, H.J.

    1999-10-01

    The internal-nitriding behavior of several model alloys of the Ni-Cr-Al-Ti system in an oxygen-free nitrogen atmosphere at 800--1100 C was studied. Thermogravimetry as well as various metallographic techniques (SEM and TEM) were used. It was shown that both the nitrogen solubility and the nitrogen diffusion coefficient are strongly affected by the Cr content of the Ni alloy. Hence, in Ni-Cr-Ti alloys a higher chromium content leads to an increased depth of the internal precipitation of TiN. Nitridation of the alloying element Cr takes place only at high concentrations of Cr. In general, the nitridation rate was found to obey Wagner`s parabolic rate law of internal oxidation. Changes in the parabolic rate constant with alloy composition can be understood by means of thermodynamic calculations in combination with microstructural observations.

  15. Solvent Design Methodology to Recycle Chamber Parts and Recover Platinum by Highly Selective Wet Treatment for Ni-Pt Sputtering System

    NASA Astrophysics Data System (ADS)

    Futase, Takuya; Sabae, Yoshichika; Tanimoto, Hisanori

    2013-11-01

    In this paper, we describe a methodology of solvent design for selective removal of nickel-platinum (Ni-Pt) alloy film deposited on the surface of stainless-steel (SUS) chamber parts, based on electrochemistry. Several removal treatments were compared, such as sandblast-based physical treatment, pre sprayed aluminum lift-off treatment, and a newly proposed dilute-acid treatment. When using dilute acid with a redox potential between 0.75-0.85 V for Ni-Pt removal, no obvious damage was observed on the chamber parts after the treatment. The recycled parts were adequately worked in the sputtering chamber for mass production without causing the particle problem. Furthermore, we acquired losses of only 1.1% for platinum recovery efficiency in the Ni-Pt sputtering system.

  16. Single crystal X-ray structure study of the Li(2-x)Na(x)Ni[PO4]F system.

    PubMed

    Ben Yahia, Hamdi; Shikano, Masahiro; Koike, Shinji; Tatsumi, Kuniaki; Kobayashi, Hironori

    2012-05-21

    The new compounds Li(2-x)Na(x)Ni[PO(4)]F (x = 0.7, 1, and 2) have been synthesized by a solid state reaction route. Their crystal structures were determined from single-crystal X-ray diffraction data. Li(1.3)Na(0.7)Ni[PO(4)]F crystallizes with the orthorhombic Li(2)Ni[PO(4)]F structure, space group Pnma, a = 10.7874(3), b = 6.2196(5), c = 11.1780(4) Å and Z = 8, LiNaNi[PO(4)]F crystallizes with a monoclinic pseudomerohedrally twinned structure, space group P2(1)/c, a = 6.772(4), b = 11.154(6), c = 5.021(3) Å, β = 90° and Z = 4, and Na(2)Ni[PO(4)]F crystallizes with a monoclinic twinned structure, space group P2(1)/c, a = 13.4581(8), b = 5.1991(3), c = 13.6978(16) Å, β = 120.58(1)° and Z = 8. For x = 0.7 and 1, the structures contain NiFO(3) chains made up of edge-sharing NiO(4)F(2) octahedra, whereas for x = 2 the chains are formed of dimer units (face-sharing octahedra) sharing corners. These chains are interlinked by PO(4) tetrahedra forming a 3D framework for x = 0.7 and different Ni[PO(4)]F layers for x = 1 and 2. A sodium/lithium disorder over three atomic positions is observed in Li(1.3)Na(0.7)Ni[PO(4)]F structure, whereas the alkali metal atoms are well ordered in between the layers in the LiNaNi[PO(4)]F and Na(2)Ni[PO(4)]F structures, which makes both compounds of great interest as potential positive electrodes for sodium cells.

  17. Stabilization of hexagonal close-packed metallic nickel for alumina-supported systems prepared from Ni(II) glycinate

    SciTech Connect

    Rodriguez-Gonzalez, Vicente; Marceau, Eric Beaunier, Patricia; Che, Michel; Train, Cyrille

    2007-01-15

    The decomposition in flowing argon of the neutral complex [Ni{sup II}(glycinate){sub 2}(H{sub 2}O){sub 2}] leads to a mixture of face-centered cubic (fcc) and hexagonal close-packed (hcp) metallic nickel. The latter is the main phase when the Ni(II) complex is supported on alumina. Unlike most hexagonal Ni phases described earlier, and similar to hexagonal Ni{sub 3}C, the unit cell parameters (a=0.2493 and c=0.4084nm) lead to Ni-Ni distances equal to those encountered in fcc Ni. TEM shows that the nanoparticles are protected by graphite layers, whose elimination by heating in hydrogen results in transformation to the fcc phase and crystal growth. Magnetic measurements provide evidence of the coexistence of superparamagnetic and ferromagnetic nanoparticles. This result is in line with the broad size distribution observed by TEM and is interpreted on the basis of the metallic character of hcp Ni particles.

  18. Copper-based alloys, crystallographic and crystallochemical parameters of alloys in binary systems Cu-Me (Me=Co, Rh, Ir, Cu, Ag, Au, Ni, Pd, Pt)

    NASA Astrophysics Data System (ADS)

    Porobova, Svetlana; Markova, Tat'jana; Klopotov, Vladimir; Klopotov, Anatoliy; Loskutov, Oleg; Vlasov, Viktor

    2016-01-01

    The article presents the results of the analysis of phase equilibrium of ordered phases in binary systems based on copper Cu- Me (where Me - Co, Rh, Ir, Ag, Au, Ni, Pd, Pt) to find correlations of crystallochemical and crystallographic factors. It is established that the packing index in disordered solid solutions in binary systems based on copper is close to the value of 0.74 against the background of an insignificant deviation of atomic volumes from the Zen's law.

  19. Structural and electrical characterizations of cerium (Ce3+)-doped double perovskite system Sr2NiMoO6- δ

    NASA Astrophysics Data System (ADS)

    Kumar, Pravin; Singh, Nitish Kumar; Sinha, A. S. K.; Singh, Prabhakar

    2016-09-01

    The double perovskite system Sr2- x Ce x NiMoO6- δ (SCNM) with 0.01 ≤ x ≤ 0.05 was synthesized by the citrate-nitrate auto-combustion synthesis route. Thermal studies were carried out by simultaneous differential scanning calorimetry and thermal gravimetry. Phase constitution was analyzed by powder X-ray diffraction (XRD). Rietveld refinement showed that the major phase exists in tetragonal form with space group I4/m. Microstructural investigations revealed the formation of uniform grains. The electrical conductivity studied by impedance spectroscopy in the temperature range 300-600 °C was found to follow a thermally activated process. The sample with x = 0.01 showed the highest conductivity with lowest activation energy. The electrical conductivity of the system was discussed in terms of identified impurity phases and charge density [{{{Mo}}_{{{{Mo}}^{6 +}}}^{5 +} {}^' ]. The variation of electrical conductivity with composition was explained on the basis of X-ray photoelectron spectroscopy and XRD studies.

  20. Implement an adjustable delay time digital trigger for an NI data acquisition card in a high-speed demodulation system

    NASA Astrophysics Data System (ADS)

    Zhang, Hongtao; Fan, Lingling; Wang, Pengfei; Park, Seong-Wook

    2012-06-01

    A National Instruments (NI) DAQ card PCI 5105 is installed in a high-speed demodulation system based on Fiber Fabry-Pérot Tunable Filter. The instability of the spectra of Fiber Bragg Grating sensors caused by intrinsic drifts of FFP-TF needs an appropriate, flexible trigger. However, the driver of the DAQ card in the current development environment does not provide the functions of analog trigger but digital trigger type. Moreover, the high level of the trigger signal from the tuning voltage of FFP-TF is larger than the maximum input overload voltage of PCI 5105 card. To resolve this incompatibility, a novel converter to change an analog trigger signal into a digital trigger signal has been reported previously. However, the obvious delay time between input and output signals limits the function of demodulation system. Accordingly, we report an improved low-cost, small-size converter with an adjustable delay time. This new scheme can decline the delay time to or close to zero when the frequency of trigger signal is less than 3,000 Hz. This method might be employed to resolve similar problems or to be applied in semiconductor integrated circuits.

  1. Interdecadal variability of El Niño onset and its impact on monsoon systems over areas encircling the Pacific Ocean

    NASA Astrophysics Data System (ADS)

    Cai, Jiaxi; Xu, Jianjun; Guan, Zhaoyong; Powell, Alfred M.

    2016-10-01

    Based on previous study by Xu and Chan (J Clim 14:418-433, 2001), two types of El Niño distinguished by the onset time, a Spring (SP) type and a Summer (SU) type, have been investigated from 1871 through 2011. As can be classified by the spatial patterns of sea surface temperature anomaly into the Warm Pool (WP) and Cold Tongue (CT) El Niño, the temporal features of the CT are dominated by the SP events whereas the SU events mostly display the spatial pattern of WP or Mixed events. The approximate 140-year data analysis shows that the frequency of SP events tends to increase in the most recent 30 years (1980-2009) while the SU events show very strong activity in the beginning of the twentieth century (1900-1929), which are closely associated with the decadal changes in oceanic and atmospheric background conditions. The air-sea processes indicate that the pattern of sea surface temperature (SST) gradient between tropical and extratropical Pacific Ocean on decadal time scales is related to the sea level pressure distribution, which tends to produce wind anomalies. The wind anomalies in turn affect the SST anomalies on inter-annual time scales over the equatorial areas and finally result in the early onset of El Niño in SP time or late onset of El Nino in SU time. A spring onset El Niño favors a Kelvin wave that propagates across the basin and a summer onset favors a Kelvin wave that does not traverse the basin or the related effects are not strong enough. The early or late onset of El Niño significantly impacts the precipitation distribution correlated with the monsoon systems including the Asian-Australian monsoon and North-South American monsoon. The El Niño-monsoon relationship is modulated by decadal changes in atmospheric and oceanic background conditions. The precipitation in the monsoonal area circling the Pacific Ocean exhibits characteristic quasi-biennial variations that are closely associated with the onset time of El Niño events, especially with

  2. In situ x-ray and neutron powder diffraction study of LaNi5-xSnx-H systems

    NASA Technical Reports Server (NTRS)

    Bowman, Robert C., Jr.; Nakamara, Yumiko; Akiba, Etsuo

    2004-01-01

    This paper will present results of in situ XRD measurements of LaNi4.75Sn0.25 .during the initial absorption-desorption cycle, These measurements were performed under a similar condition to that for LaNi4.75Al0.25 previously reported [1]. The data were analyzed by the Rietveld method. Lattice parameter change and strain formation accompanying hydride phase formation and decomposition will be discussed. In addition, results of in situ neutron diffraction of LaNi4.78Sn0.22, focusing on hydrogen occupation in the hydride phase, will be presented.

  3. Combinatorial Study of the Li-Ni-Mn-Co Oxide Pseudoquaternary System for Use in Li-Ion Battery Materials Research.

    PubMed

    Brown, Colby R; McCalla, Eric; Watson, Cody; Dahn, J R

    2015-06-01

    Combinatorial synthesis has proven extremely effective in screening for new battery materials for Li-ion battery electrodes. Here, a study in the Li-Ni-Mn-Co-O system is presented, wherein samples with nearly 800 distinct compositions were prepared using a combinatorial and high-throughput method to screen for single-phase materials of high interest as next generation positive electrode materials. X-ray diffraction is used to determine the crystal structure of each sample. The Gibbs' pyramid representing the pseudoquaternary system was studied by making samples within three distinct pseudoternary planes defined at fractional cobalt metal contents of 10%, 20%, and 30% within the Li-Ni-Mn-Co-O system. Two large single-phase regions were observed in the system: the layered region (ordered rocksalt) and cubic spinel region; both of which are of interest for next-generation positive electrodes in lithium-ion batteries. These regions were each found to stretch over a wide range of compositions within the Li-Ni-Mn-Co-O pseudoquaternary system and had complex coexistence regions existing between them. The sample cooling rate was found to have a significant effect on the position of the phase boundaries of the single-phase regions. The results of this work are intended to guide further research by narrowing the composition ranges worthy of study and to illustrate the broad range of applications where solution-based combinatorial synthesis can have significant impact.

  4. Self-Propagating High-Temperature Synthesis in the Ti-C-Ni-Mo System on Application of Powerful Ultrasound

    NASA Astrophysics Data System (ADS)

    Kulak, M. M.; Khina, B. B.

    2014-03-01

    An experimental setup has been developed and a study has been made of the self-propagating high-temperature synthesis in a Ti-C-Ni-Mo system under the conditions of action of ultrasonic vibrations. The influence of the amplitude of ultrasonic vibrations on the combustion rate and temperature and on the phase composition and structure of the derived composite material based on titanium carbide with a metal binder has been determined. The heat-transfer coefficient on the surface of a sample for vibrations at ultrasound frequency has been evaluated. Consideration has been given to possible mechanisms of influence of ultrasonic vibrations on the process of self-propagating high-temperature synthesis. It has been shown that the reduction in the synthesis temperature is due to the cooling of the sample because of the forced convection of the surrounding gas, whereas the change in the structure of the synthesized material is related to the change in the conditions of high-temperature heterogeneous interaction in the wave of self-propagating high-temperature synthesis.

  5. Solar-Driven Reduction of Aqueous Protons Coupled to Selective Alcohol Oxidation with a Carbon Nitride–Molecular Ni Catalyst System

    PubMed Central

    2016-01-01

    Solar water-splitting represents an important strategy toward production of the storable and renewable fuel hydrogen. The water oxidation half-reaction typically proceeds with poor efficiency and produces the unprofitable and often damaging product, O2. Herein, we demonstrate an alternative approach and couple solar H2 generation with value-added organic substrate oxidation. Solar irradiation of a cyanamide surface-functionalized melon-type carbon nitride (NCNCNx) and a molecular nickel(II) bis(diphosphine) H2-evolution catalyst (NiP) enabled the production of H2 with concomitant selective oxidation of benzylic alcohols to aldehydes in high yield under purely aqueous conditions, at room temperature and ambient pressure. This one-pot system maintained its activity over 24 h, generating products in 1:1 stoichiometry, separated in the gas and solution phases. The NCNCNx–NiP system showed an activity of 763 μmol (g CNx)−1 h–1 toward H2 and aldehyde production, a Ni-based turnover frequency of 76 h–1, and an external quantum efficiency of 15% (λ = 360 ± 10 nm). This precious metal-free and nontoxic photocatalytic system displays better performance than an analogous system containing platinum instead of NiP. Transient absorption spectroscopy revealed that the photoactivity of NCNCNx is due to efficient substrate oxidation of the material, which outweighs possible charge recombination compared to the nonfunctionalized melon-type carbon nitride. Photoexcited NCNCNx in the presence of an organic substrate can accumulate ultralong-lived “trapped electrons”, which allow for fuel generation in the dark. The artificial photosynthetic system thereby catalyzes a closed redox cycle showing 100% atom economy and generates two value-added products, a solar chemical, and solar fuel. PMID:27337491

  6. Solar-Driven Reduction of Aqueous Protons Coupled to Selective Alcohol Oxidation with a Carbon Nitride-Molecular Ni Catalyst System.

    PubMed

    Kasap, Hatice; Caputo, Christine A; Martindale, Benjamin C M; Godin, Robert; Lau, Vincent Wing-Hei; Lotsch, Bettina V; Durrant, James R; Reisner, Erwin

    2016-07-27

    Solar water-splitting represents an important strategy toward production of the storable and renewable fuel hydrogen. The water oxidation half-reaction typically proceeds with poor efficiency and produces the unprofitable and often damaging product, O2. Herein, we demonstrate an alternative approach and couple solar H2 generation with value-added organic substrate oxidation. Solar irradiation of a cyanamide surface-functionalized melon-type carbon nitride ((NCN)CNx) and a molecular nickel(II) bis(diphosphine) H2-evolution catalyst (NiP) enabled the production of H2 with concomitant selective oxidation of benzylic alcohols to aldehydes in high yield under purely aqueous conditions, at room temperature and ambient pressure. This one-pot system maintained its activity over 24 h, generating products in 1:1 stoichiometry, separated in the gas and solution phases. The (NCN)CNx-NiP system showed an activity of 763 μmol (g CNx)(-1) h(-1) toward H2 and aldehyde production, a Ni-based turnover frequency of 76 h(-1), and an external quantum efficiency of 15% (λ = 360 ± 10 nm). This precious metal-free and nontoxic photocatalytic system displays better performance than an analogous system containing platinum instead of NiP. Transient absorption spectroscopy revealed that the photoactivity of (NCN)CNx is due to efficient substrate oxidation of the material, which outweighs possible charge recombination compared to the nonfunctionalized melon-type carbon nitride. Photoexcited (NCN)CNx in the presence of an organic substrate can accumulate ultralong-lived "trapped electrons", which allow for fuel generation in the dark. The artificial photosynthetic system thereby catalyzes a closed redox cycle showing 100% atom economy and generates two value-added products, a solar chemical, and solar fuel.

  7. Solar-Driven Reduction of Aqueous Protons Coupled to Selective Alcohol Oxidation with a Carbon Nitride-Molecular Ni Catalyst System.

    PubMed

    Kasap, Hatice; Caputo, Christine A; Martindale, Benjamin C M; Godin, Robert; Lau, Vincent Wing-Hei; Lotsch, Bettina V; Durrant, James R; Reisner, Erwin

    2016-07-27

    Solar water-splitting represents an important strategy toward production of the storable and renewable fuel hydrogen. The water oxidation half-reaction typically proceeds with poor efficiency and produces the unprofitable and often damaging product, O2. Herein, we demonstrate an alternative approach and couple solar H2 generation with value-added organic substrate oxidation. Solar irradiation of a cyanamide surface-functionalized melon-type carbon nitride ((NCN)CNx) and a molecular nickel(II) bis(diphosphine) H2-evolution catalyst (NiP) enabled the production of H2 with concomitant selective oxidation of benzylic alcohols to aldehydes in high yield under purely aqueous conditions, at room temperature and ambient pressure. This one-pot system maintained its activity over 24 h, generating products in 1:1 stoichiometry, separated in the gas and solution phases. The (NCN)CNx-NiP system showed an activity of 763 μmol (g CNx)(-1) h(-1) toward H2 and aldehyde production, a Ni-based turnover frequency of 76 h(-1), and an external quantum efficiency of 15% (λ = 360 ± 10 nm). This precious metal-free and nontoxic photocatalytic system displays better performance than an analogous system containing platinum instead of NiP. Transient absorption spectroscopy revealed that the photoactivity of (NCN)CNx is due to efficient substrate oxidation of the material, which outweighs possible charge recombination compared to the nonfunctionalized melon-type carbon nitride. Photoexcited (NCN)CNx in the presence of an organic substrate can accumulate ultralong-lived "trapped electrons", which allow for fuel generation in the dark. The artificial photosynthetic system thereby catalyzes a closed redox cycle showing 100% atom economy and generates two value-added products, a solar chemical, and solar fuel. PMID:27337491

  8. Cycling Stability Performance of La0.75Mg0.25Ni3.5Si0.10 Hydrogen Storage Alloy in Discharge-Charge System

    NASA Astrophysics Data System (ADS)

    Liu, Zhaojiang; Huang, Lei; Wan, Qi; Li, Xu; Guang, Ma; Li, Ping

    2014-12-01

    La0.75Mg0.25Ni3.5Si0.10 hydrogen storage alloy was prepared by vacuum induction melting furnace and subsequently heated treatment at 940°C for 8 h and cooled to room temperature in the oven. The electrochemical properties of La0.75Mg0.25Ni3.5Si0.10 compound were measured by LAND CT2001A battery test system. The morphologies of the samples were characterized by scanning electron microscopy (SEM). The surface state of samples was analyzed by X-ray photoelectron spectroscopy (XPS). It was found that the charge-discharge rate plays the key impact on the cycling stability of the alloy. During the cycle test, the prepared La0.75Mg0.25Ni3.5Si0.10 compound presented an excellent capacity retention at the charge-discharge of 1 C while the capacity of sample declined rapidly at 0.2 C. The excellent cycling stability performance of La0.75Mg0.25Ni3.5Si0.10 electrode at 1 C could be attributed to the less powder and less oxidation of surface effective active elements. The pulverization inevitably leads to the separation of the part of the cracking alloy and the electrode, resulting in reduction of the effective active substance and increasing attenuation of the capacity per cycle. In addition, on the analysis of the different cut-off potential effects on the electrode, it was found that the La0.75Mg0.25Ni3.5Si0.10 electrode shows good comprehensive electrochemical properties at 1 C cut-off 0.6-0.7 V. During charging, heavy overcharge will not be conducive to cycling stability performance during the charging test.

  9. From One Extreme to Another: Tsunami, Hurricane, and El Niño Observations from the NDBC Ocean Observing Systems of Systems

    NASA Astrophysics Data System (ADS)

    Bouchard, R. H.; Henderson, D.; Locke, L.

    2008-05-01

    NOAA`s National Data Buoy Center (NDBC) operates a system of ocean observing systems (NOOSS) to provide critical information in real-time during extreme events, such as tsunamis, hurricanes, and El Niños. NDBC recently completed the 39-station array of tsunameters that employ the second-generation Deep-ocean and Assessment and Reporting of Tsunamis (DART II) technology. The tsunameter array spans the Pacific Ocean and the western Atlantic Ocean providing real-time water-level measurements and tsunami detection times. At depths down to 6000 meters the tsunameters can send information in less than 3 minutes to the Tsunami Warning Centers in Hawaii and Alaska and to the international tsunami community. The tsunameters have provided data for the Kuril tsunamis of November 2006 and January 2007, the Peru tsunamis of August and September 2007, and the southern Sumatra tsunami of September 2007. In 2006, NDBC assumed operations of the Tropical Atmosphere Ocean Array (TAO), the "crown jewel" of the Global Climate Observation System. TAO provides real-time data for improved detection, understanding, and prediction of El Niño and La Niña. The 55-buoy TAO array spans the central and eastern equatorial Pacific. Real-time and post-deployment recovery data support climate analysis and forecasts. For more than 30 years, NDBC has operated a system of buoys and coastal automated stations for meteorological and oceanographic observations that support real-time weather analysis, forecasting, and warnings. These "traditional" NDBC stations measure winds, waves, temperature, and humidity routinely. Some stations are augmented with ocean current and temperature and salinity (conductivity) sensors. In recent years, among the Gulf of Mexico and Caribbean hurricanes passing in proximity to NDBC stations include Ivan in 2004, Cindy, Emily, Dennis, Katrina, Rita, and Wilma in 2005, Ernesto in 2006, and Dean and Felix in 2007 as well as numerous tropical storms. Not confined to tropical

  10. Degradation behavior of Ni3Al plasma-sprayed boiler tube steels in an energy generation system

    NASA Astrophysics Data System (ADS)

    Sidhu, Buta Singh; Prakash, S.

    2005-06-01

    Boiler steels, namely, low-C steel, ASTM-SA210-Grade A1 (GrA1), 1Cr-0.5Mo steel, ASTM-SA213-T-11 (T11) and 2.25Cr-1Mo steel, ASTM-SA213-T-22 (T22) were plasma sprayed with Ni3Al. The alloy powder was prepared by mixing Ni and Al in the stoichiometric ratio of 3 to 1. The Ni-22Cr-10Al-1Y alloy powder was used as a bond coat, with a 150 µm thick layer sprayed onto the surface before applying the 200 µm coating of Ni3Al. Exposure studies have been performed in the platen superheater zone of a coal-fired boiler at around 755 °C for 10 cycles, each of 100 h duration. The protection to the base steel was minimal for the three steels. Scale spallation and the formation of a porous and nonadherent NiO scale were probably the main reasons for the lack of protection. In the case of T22-coated steel, cracks in the coatings have been observed after the first 100 h exposure cycle.

  11. Competitive adsorption of Cd(II), Zn(II) and Ni(II) from their binary and ternary acidic systems using tourmaline.

    PubMed

    Liu, Haibin; Wang, Cuiping; Liu, Jingting; Wang, Baolin; Sun, Hongwen

    2013-10-15

    The adsorption of Cd(II), Zn(II) and Ni(II) from aqueous solutions in binary and ternary component systems by tourmaline was investigated. Kinetic data were accurately fitted to pseudo-second order and internal diffusion models, which indicated that the adsorption of heavy metals occurred on the interior surface of the sorbent and internal diffusion was the controlling mechanism during heavy metal ion adsorption but was not the only rate-controlling step. Additionally, tourmaline had a very good adsorption capacity for Cd(II), Zn(II) and Ni(II) in multi-component aqueous solutions at strongly acidic pH values (in contrast to industrial wastewater pH values). This good adsorption capacity is attributed to the fact that tourmaline can automatically adjust the pH values of acidic (except pH 2.0 and 3.0), neutral or alkaline aqueous solutions to 6.0. Adsorption isotherms and separation factors showed that tourmaline displays a high selectivity toward one metal in a two-component or a three-component system with an affinity order of Cd(II) > Zn(II) > Ni(II). Thermodynamic parameters indicated that heavy metal adsorption was feasible, spontaneous, and endothermic. Therefore, tourmaline should be explored as a material for removing pollutants from the strongly acidic wastewater. PMID:23851318

  12. Competitive adsorption of Cd(II), Zn(II) and Ni(II) from their binary and ternary acidic systems using tourmaline.

    PubMed

    Liu, Haibin; Wang, Cuiping; Liu, Jingting; Wang, Baolin; Sun, Hongwen

    2013-10-15

    The adsorption of Cd(II), Zn(II) and Ni(II) from aqueous solutions in binary and ternary component systems by tourmaline was investigated. Kinetic data were accurately fitted to pseudo-second order and internal diffusion models, which indicated that the adsorption of heavy metals occurred on the interior surface of the sorbent and internal diffusion was the controlling mechanism during heavy metal ion adsorption but was not the only rate-controlling step. Additionally, tourmaline had a very good adsorption capacity for Cd(II), Zn(II) and Ni(II) in multi-component aqueous solutions at strongly acidic pH values (in contrast to industrial wastewater pH values). This good adsorption capacity is attributed to the fact that tourmaline can automatically adjust the pH values of acidic (except pH 2.0 and 3.0), neutral or alkaline aqueous solutions to 6.0. Adsorption isotherms and separation factors showed that tourmaline displays a high selectivity toward one metal in a two-component or a three-component system with an affinity order of Cd(II) > Zn(II) > Ni(II). Thermodynamic parameters indicated that heavy metal adsorption was feasible, spontaneous, and endothermic. Therefore, tourmaline should be explored as a material for removing pollutants from the strongly acidic wastewater.

  13. Current-driven domain wall motion due to volume spin transfer torque in Co/Ni multilayer systems on Au underlayer

    NASA Astrophysics Data System (ADS)

    Ryu, Kwang-Su; Yang, See-Hun; Thomas, Luc; Parkin, Stuart

    2016-09-01

    We have studied the current-induced domain wall (CIDW) dynamics in perpendicularly magnetized Co/Ni multilayers deposited on Au underlayer, where the conventional spin transfer torque governs the domain wall dynamics, by the Kerr microscope. It is found that the DW angle tilting following Oersted field profile plays an important role in domain wall (DW) motion at high current density J by decreasing DW velocity with the increasing J, while distorting its DW morphology. Also we find that the DW pinning becomes pronounced as the anisotropy decreases by increasing number of Co/Ni repeats. Most remarkably, the DW tilting angle changes its sign by inserting ultrathin Pt layer between Au and Co layer, which suggests that the Dzyaloshinskii-Moriya interaction and spin Hall effect induces opposite effect in DW tilting. Our findings can be of use for application of CIDW to spintronics with perpendicularly magnetized systems.

  14. Current-driven domain wall motion due to volume spin transfer torque in Co/Ni multilayer systems on Au underlayer

    NASA Astrophysics Data System (ADS)

    Ryu, Kwang-Su; Yang, See-Hun; Thomas, Luc; Parkin, Stuart

    2016-09-01

    We have studied the current-induced domain wall (CIDW) dynamics in perpendicularly magnetized Co/Ni multilayers deposited on Au underlayer, where the conventional spin transfer torque governs the domain wall dynamics, by the Kerr microscope. It is found that the DW angle tilting following Oersted field profile plays an important role in domain wall (DW) motion at high current density J by decreasing DW velocity with the increasing J, while distorting its DW morphology. Also we find that the DW pinning becomes pronounced as the anisotropy decreases by increasing number of Co/Ni repeats. Most remarkably, the DW tilting angle changes its sign by inserting ultrathin Pt layer between Au and Co layer, which suggests that the Dzyaloshinskii–Moriya interaction and spin Hall effect induces opposite effect in DW tilting. Our findings can be of use for application of CIDW to spintronics with perpendicularly magnetized systems.

  15. The cytotoxicity of NiO nanoparticle with borate capping.

    PubMed

    Liu, Zunjing; Wang, Yongjing; Pan, Danmei; Chen, Zhi; Pan, Xiaohong; Wang, Yonghao; Lin, Zhang

    2011-11-01

    The impact of surface capping on cytotoxicity of NiO nanoparticle was investigated with Escherichia coil (E.coli) in this work. The NiO nanoparticle and NiO nanoparticle capped by borate (denoted as NiO-borate) were synthesized by hydrothermal method. The average size of both nanoparticles is about 4.0 nm. The plate experiments demonstrated that NiO-borate nanoparticles show lower cytotoxicity than NiO nanopaticles. Further spectrophotometric analysis revealed that the concentration of both extracellular and intercellular Ni2+ in NiO-borate system were lower than that of uncapped one. Intracellular ICP-AES analysis also showed the concentration of Ni element was higher than Ni2+, suggesting the NiO nanoparticles might penetrate into the cellular interior. Comprehensive AFM, SEM and TEM observation illustrated both NiO-borate and NiO nanoparticles lead to the collapse of cellular body, the convex on the cell wall and the damage of cell wall ultimately. In summary, the surface capping with borate on NiO nanopaticles will suppress the release of the Ni2+ ions and impede the contact between the NiO nanoparticle and cell wall, which ultimately decreased the cytotoxicity of NiO nanoparticles.

  16. Material properties of perovskites in the quasi-ternary system LaFeO3–LaCoO3–LaNiO3

    DOE PAGES

    Tietz, F.; Arul Raj, I.; Ma, Q.; Baumann, S.; Mahmoud, A.; Hermann, R. P.

    2016-02-02

    We present an overview on the variation of electrical conductivity, oxygen permeation, oxygen surface exchange and thermal expansion coefficient as a function of the composition of perovskites in the quasi-ternary system LaFeO3–LaCoO3–LaNiO3. Powders of thirteen nominal perovskite compositions were synthesized under identical conditions by the Pechini method. The powder X-ray diffraction data of two series, namely La(Ni0.5Fe0.5)1-xCoxO3 and LaNi0.5- xFexCo0.5O3, are presented after the powders had been sintered at 1100 C for 6 h in air. The measurements revealed a rhombohedral structure for all compositions except LaNi0.5Fe0.5O3 for which 60% rhombohedral and 40% orthorhombic phase was found. Moreover, the maximummore » DC electrical conductivity value of the perovskites at 800 C was 1229 S cm-1 for the composition LaCoO3 and the minimum was 91 S cm-1 for the composition LaCo0.5Fe0.5O3. The oxygen permeation of samples with promising conductivities at 800 C was one order of magnitude lower than that of La0.6Sr0.4Co0.8Fe0.2O3 (LSCF). The highest value of 0.017 ml cm-2 min-1 at 950 C was obtained with LaNi0.5Co0.5O3. The coefficients of thermal expansion varied in the range of 13.2 x 10-6 K-1 and 21.9 x 10-6 K-1 for LaNi0.5Fe0.5O3 and LaCoO3, respectively. 57Fe M ssbauer spectroscopy was used as probe for the oxidation states, local environment and magnetic properties of iron ions as a function of chemical composition. Ultimately, the substitution had a great influence on the chemical properties of the materials.« less

  17. Material properties of perovskites in the quasi-ternary system LaFeO3-LaCoO3-LaNiO3

    NASA Astrophysics Data System (ADS)

    Tietz, F.; Arul Raj, I.; Ma, Q.; Baumann, S.; Mahmoud, A.; Hermann, R. P.

    2016-05-01

    An overview is presented on the variation of electrical conductivity, oxygen permeation, and thermal expansion coefficient as a function of the composition of perovskites in the quasi-ternary system LaFeO3-LaCoO3-LaNiO3. Powders of thirteen nominal perovskite compositions were synthesized under identical conditions by the Pechini method. The powder X-ray diffraction data of two series, namely La(Ni0.5Fe0.5)1-xCoxO3 and LaNi0.5-xFexCo0.5O3, are presented after the powders had been sintered at 1100 °C for 6 h in air. The measurements revealed a rhombohedral structure for all compositions except LaNi0.5Fe0.5O3 for which 60% rhombohedral and 40% orthorhombic phase was found. The maximum DC electrical conductivity value of the perovskites at 800 °C was 1229 S cm-1 for the composition LaCoO3 and the minimum was 91 S cm-1 for the composition LaCo0.5Fe0.5O3. The oxygen permeation of samples with promising conductivities at 800 °C was one order of magnitude lower than that of La0.6Sr0.4Co0.8Fe0.2O3 (LSCF). The highest value of 0.017 ml cm-2 min-1 at 950 °C was obtained with LaNi0.5Co0.5O3. The coefficients of thermal expansion varied in the range of 13.2×10-6 K-1 and 21.9×10-6 K-1 for LaNi0.5Fe0.5O3 and LaCoO3, respectively. 57Fe Mössbauer spectroscopy was used as probe for the oxidation states, local environment and magnetic properties of iron ions as a function of chemical composition. The substitution had a great influence on the chemical properties of the materials.

  18. Hydrogen atom distribution and hydrogen induced site depopulation for the La{sub 2-x}Mg{sub x}Ni{sub 7}-H system

    SciTech Connect

    Guzik, Matylda N.; Hauback, Bjorn C.; Yvon, Klaus

    2012-02-15

    opposed to nine proposed for La{sub 1.5}Mg{sub 0.5}Ni{sub 7}D{sub 8.9(9.1)}. The reported four remaining deuterium atom positions in La{sub 1.5}Mg{sub 0.5}Ni{sub 7}D{sub 8.9(9.1)} were not found in the investigated La{sub 1.63}Mg{sub 0.37}Ni{sub 7}D{sub 8.8}. The five Ni atoms have deuterium among their nearest neighbors, which surround them in a way similar to configurations observed in some complex transition metal hydrides and already reported for metallic hydrides. In the presented deuterium-rich phase, deformed tetrahedron, rigid trigonal pyramids as well as disordered and deformed saddle-like configuration are observed. Highlights: Black-Right-Pointing-Pointer Alpha- and beta-phase for La{sub 2-x}Mg{sub x}Ni{sub 7}-H system have been characterized. Black-Right-Pointing-Pointer Five different interstitial sites are occupied by deuterium/hydrogen atoms in the beta-phase. Black-Right-Pointing-Pointer One D/H site has been determined in the alpha-phase. Black-Right-Pointing-Pointer Deuterium/hydrogen induced site depopulation during phase transformation is observed. Black-Right-Pointing-Pointer Ni atoms tend to have tetrahedral-like D/H atom coordination.

  19. Influence of Friction Resistance on Expression of Superelastic Properties of Initial NiTi Wires in "Reduced Friction" and Conventional Bracket Systems.

    PubMed

    Reznikov, Natalie; Har-Zion, Gilad; Barkana, Idit; Abed, Yosef; Redlich, Meir

    2010-01-01

    Objectives. The aim of this study was to assess the influence of resistance to sliding on expression of superelastic properties of NiTi wires. Methods and Materials. A three-point bending test was performed for 0.014 NiTi wire engaged in self-ligating (Damon, SmartClip, In-Ovation) and conventional brackets (Victory) ligated with regular and reduced friction modules (Slide). The wire was deflected in the buccal direction and allowed to straighten. The maximum load, unloading plateau and unloading capacity were registered. Results. The lowest activation load was required in the active self-ligating group (In-Ovation 2.2 ± 0.4 N) and reduced friction module group (Victory/Slide 2.9 ± 0.4 N), followed by the passive self-ligating systems (Damon 3.6 ± 0.7 N, SmartClip 3.7 ± 0.4 N). Higher activation load was obtained in the conventionally ligated group (Victory/module 4.5 ± 0.4 N). Unloading plateau phase with the load magnitude ranging from 1.27 ± 0.4 N (In-Ovation) to 1.627 ± 0.4 N (Slide) was distinct in all groups but one (Victory). Conclusions. Higher friction at flanking points reduces the net force delivered by the wire. Unloading plateau phase of NiTi load-deflection curve disappears in the conventionally ligated group thus indicating to an incomplete expression of NiTi superelastic properties. A rigid passive bracket clip amplifies resistance to sliding in an active configuration and produces a permanent deflection of the wire. PMID:20981153

  20. Influence of Friction Resistance on Expression of Superelastic Properties of Initial NiTi Wires in “Reduced Friction” and Conventional Bracket Systems

    PubMed Central

    Reznikov, Natalie; Har-Zion, Gilad; Barkana, Idit; Abed, Yosef; Redlich, Meir

    2010-01-01

    Objectives. The aim of this study was to assess the influence of resistance to sliding on expression of superelastic properties of NiTi wires. Methods and Materials. A three-point bending test was performed for 0.014 NiTi wire engaged in self-ligating (Damon, SmartClip, In-Ovation) and conventional brackets (Victory) ligated with regular and reduced friction modules (Slide). The wire was deflected in the buccal direction and allowed to straighten. The maximum load, unloading plateau and unloading capacity were registered. Results. The lowest activation load was required in the active self-ligating group (In-Ovation 2.2 ± 0.4 N) and reduced friction module group (Victory/Slide 2.9 ± 0.4 N), followed by the passive self-ligating systems (Damon 3.6 ± 0.7 N, SmartClip 3.7 ± 0.4 N). Higher activation load was obtained in the conventionally ligated group (Victory/module 4.5 ± 0.4 N). Unloading plateau phase with the load magnitude ranging from 1.27 ± 0.4 N (In-Ovation) to 1.627 ± 0.4 N (Slide) was distinct in all groups but one (Victory). Conclusions. Higher friction at flanking points reduces the net force delivered by the wire. Unloading plateau phase of NiTi load-deflection curve disappears in the conventionally ligated group thus indicating to an incomplete expression of NiTi superelastic properties. A rigid passive bracket clip amplifies resistance to sliding in an active configuration and produces a permanent deflection of the wire. PMID:20981153

  1. Phase Equilibria of the Sn-Ni-V System: The 980°C Isothermal Section and the Sn-Rich Corner at 600°C and 300°C

    NASA Astrophysics Data System (ADS)

    Wu, Changjun; Su, Xuping; Peng, Haoping; Liu, Ya; Tu, Hao; Wang, Jianhua

    2015-10-01

    Ternary Sn-Ni-V alloys were prepared and annealed at 980°C, 600°C, and 300°C for 15, 60 and 60 days, respectively. The annealed alloys were metallographically examined and the equilibrium phases formed were identified on the basis of determination of composition and x-ray diffraction analysis. The isothermal region of the ternary Sn-Ni-V system at 980°C was studied. Nine three-phase regions and more than 20 conjugate lines were detected at 980°C. The range of composition of VNi2Sn at 980°C spans 24.5-59.2 at.% V, 52.1-25.5 at.% Ni, and 15.3-23.4 at.% Sn. Its lattice constant increases with increasing V content. A sharp increase near 40.4 at.% V is indicative of a second-order transition. It is believed that atomic site occupation changed when the V content was >40.4 at.%. The maximum solubility of V in Ni3Sn2 can reach 23.3 at.%; that in Ni3Sn is below 0.6 at.%. Up to 3.4 at.% Ni dissolves in V3Sn. The Sn-rich corner of the Sn-Ni-V system at 600°C and 300°C was also investigated experimentally. The solubility of Ni in VSn2 and V in Ni3Sn4 at 600°C and 300°C are both less than 0.5 at.%.

  2. Assessing the Effects of Radiation Damage on Ni-base Alloys for the Prometheus Space Reactor System

    SciTech Connect

    T. Angeliu

    2006-01-19

    Ni-base alloys were considered for the Prometheus space reactor pressure vessel with operational parameters of {approx}900 K for 15 years and fluences up to 160 x 10{sup 20} n/cm{sup 2} (E > 0.1 MeV). This paper reviews the effects of irradiation on the behavior of Ni-base alloys and shows that radiation-induced swelling and creep are minor considerations compared to significant embrittlement with neutron ,exposure. While the mechanism responsible for radiation-induced embrittlement is not fully understood, it is likely a combination of helium embrittlement and solute segregation that can be highly dependent on the alloy composition and exposure conditions. Transmutation calculations show that detrimental helium levels would be expected at the end of life for the inner safety rod vessel (thimble) and possibly the outer pressure vessel, primarily from high energy (E > 1 MeV) n,{alpha} reactions with {sup 58}Ni. Helium from {sup 10}B is significant only for the outer vessel due to the proximity of the outer vessel to the Be0 control elements. Recommendations for further assessments of the material behavior and methods to minimize the effects of radiation damage through alloy design are provided.

  3. Assessing the Effects of Radiation Damage on Ni-base Alloys for the Prometheus Space Reactor System

    SciTech Connect

    T Angeliu; J Ward; J Witter

    2006-04-04

    Ni-base alloys were considered for the Prometheus space reactor pressure vessel with operational parameters of {approx}900 K for 15 years and fluences up to 160 x 10{sup 20} n/cm{sup 2} (E > 0.1 MeV). This paper reviews the effects of irradiation on the behavior of Ni-base alloys and shows that radiation-induced swelling and creep are minor considerations compared to significant embrittlement with neutron exposure. While the mechanism responsible for radiation-induced embrittlement is not fully understood, it is likely a combination of helium embrittlement and solute segregation that can be highly dependent on the alloy composition and exposure conditions. Transmutation calculations show that detrimental helium levels would be expected at the end of life for the inner safety rod vessel (thimble) and possibly the outer pressure vessel, primarily from high energy (E > 1 MeV) n,{alpha} reactions with {sup 58}Ni. Helium from {sup 10}B is significant only for the outer vessel due to the proximity of the outer vessel to the BeO control elements. Recommendations for further assessments of the material behavior and methods to minimize the effects of radiation damage through alloy design are provided.

  4. Joining of Ni-TiC FGM and Ni-Al Intermetallics by Centrifugal Combustion Synthesis

    SciTech Connect

    Ohmi, Tatsuya; Matsuura, Kiyotaka; Iguchi, Manabu; Mizuma, Kiminori

    2008-02-15

    A centrifugal combustion synthesis (CCS) process has been investigated to join a Ni-Al intermetallic compound and a Ni-TiC cermet. The cermet, a tubular graphite mold, and a green compact of reactants consisting of Al, Ni and NiO were set in a centrifugal caster. When the combustion synthesis reaction was induced in the centrifugal force field, a synthesized molten Ni-Al alloy flowed into the graphite mold and joined to the cermet. The soundness of the joint interface depended on the volume percentage of TiC phase in the cermet. A lot of defects were formed near the interface between the Ni-TiC cermet and the cast Ni-Al alloy when the volume percentage of TiC was 50% or higher. For this kind of cermet system, using a functionally graded cermet such as Ni-10 vol.%TiC/Ni-25 vol.%TiC/Ni-50 vol.%TiC overcame this difficulty. The four-point bending strength of the joined specimen consisting of the three-layered FGM cermet and cast Ni-29 mol%Al alloy was 1010 MPa which is close to the result for a Ni-29 mol%Al alloy specimen.

  5. The initial errors that induce a significant "spring predictability barrier" for El Niño events and their implications for target observation: results from an earth system model

    NASA Astrophysics Data System (ADS)

    Duan, Wansuo; Hu, Junya

    2016-06-01

    The National Center for Atmospheric Research Community Earth System Model is used to study the "spring predictability barrier" (SPB) problem for El Niño events from the perspective of initial error growth. By conducting perfect model predictability experiments, we obtain two types of initial sea temperature errors, which often exhibit obvious season-dependent evolution and cause a significant SPB when predicting the onset of El Niño events bestriding spring. One type of initial errors possesses a sea surface temperature anomaly (SSTA) pattern with negative anomalies in the central-eastern equatorial Pacific, plus a basin-wide dipolar subsurface temperature anomaly pattern with negative anomalies in the upper layers of the eastern equatorial Pacific and positive anomalies in the lower layers of the western equatorial Pacific. The other type consists of an SSTA component with positive anomalies over the southeastern equatorial Pacific, plus a large-scale zonal dipole pattern of the subsurface temperature anomaly with positive anomalies in the upper layers of the eastern equatorial Pacific and negative anomalies in the lower layers of the central-western equatorial Pacific. Both exhibit a La Niña-like evolving mode and cause an under-prediction for Niño-3 SSTA of El Niño events. For the former initial error type, the resultant prediction errors grow in a manner similar to the behavior of the growth phase of La Niña; while for the latter initial error type, they experience a process that is similar to El Niño decay and transition to a La Niña growth phase. Both two types of initial errors cause negative prediction errors of Niño-3 SSTA for El Niño events. The prediction errors for Niño-3 SSTA are mainly due to the contribution of initial sea temperature errors in the large-error-related regions in the upper layers of the eastern tropical Pacific and/or in the lower layers of the western tropical Pacific. These regions may represent ``sensitive areas'' for El

  6. How distinct are the two flavors of El Niño in retrospective forecasts of Climate Forecast System version 2 (CFSv2)?

    NASA Astrophysics Data System (ADS)

    Pillai, Prasanth A.; Rao, Suryachandra A.; George, Gibies; Rao, D. Nagarjuna; Mahapatra, S.; Rajeevan, M.; Dhakate, Ashish; Salunke, Kiran

    2016-08-01

    Two different flavors of El Niño-Southern Oscillation (ENSO, canonical east Pacific type and Modoki/central Pacific type) are reported in the recent decades and are found to influence the global climate in different ways. The success of a seasonal prediction system is dependent on its ability to capture these two ENSO flavors accurately, together with associated teleconnections. The present study analyses the ability of Climate Forecast System version 2 (CFSv2) in simulating the two El Niño flavors and their teleconnections. The study uses two versions of CFSv2 in which the atmospheric model horizontal resolutions are different (T126 at 100 km and T382 at 38 km) and are initialized from a calendar month, ranging from February to June. The canonical ENSO pattern is captured as prominent mode of tropical Pacific sea surface temperature (SST) by both resolutions of CFSv2. Even though the tri-polar structure of ENSO Modoki is simulated as second mode, it has some disagreement with observations. The canonical El Niño induced SST, rainfall and atmospheric circulation in the tropical Pacific in summer and fall seasons are comparable with observations in both models. Meanwhile, the teleconnections in the tropical Indian Ocean and Indian monsoon regions are close to observations in T382 only. Teleconnections associated with El Niño Modoki are proper in T382 hindcasts, in which SST bias in Indian Ocean is slightly warm and the cold bias in central Pacific is marginal (mainly for Feb IC hindcasts). The present study indicates that the distinction of ENSO flavors in summer is the major reason for the higher skill of Indian summer monsoon rainfall (ISMR) in CFSv2 T382 Feb IC hindcasts. However, teleconnections associated with two flavors of ENSO are not distinguishable in fall and winter seasons, even in higher resolution model due to the presence of strong cold SST bias in central Pacific and warm SST bias in extreme east Pacific. Thus present study confirms that, higher

  7. Effects of alloying and local order in AuNi contacts for Ohmic radio frequency micro electro mechanical systems switches via multi-scale simulation

    NASA Astrophysics Data System (ADS)

    Gaddy, Benjamin E.; Kingon, Angus I.; Irving, Douglas L.

    2013-05-01

    Ohmic RF-MEMS switches hold much promise for low power wireless communication, but long-term degradation currently plagues their reliable use. Failure in these devices occurs at the contact and is complicated by the fact that the same asperities that bear the mechanical load are also important to the flow of electrical current needed for signal processing. Materials selection holds the key to overcoming the barriers that prevent widespread use. Current efforts in materials selection have been based on the material's (or alloy's) ability to resist oxidation as well as its room-temperature properties, such as hardness and electrical conductivity. No ideal solution has yet been found via this route. This may be due, in part, to the fact that the in-use changes to the local environment of the asperity are not included in the selection criteria. For example, Joule heating would be expected to raise the local temperature of the asperity and impose a non-equilibrium thermal gradient in the same region expected to respond to mechanical actuation. We propose that these conditions should be considered in the selection process, as they would be expected to alter mechanical, electrical, and chemical mechanisms in the vicinity of the surface. To this end, we simulate the actuation of an Ohmic radio frequency micro electro mechanical systems switch by using a multi-scale method to model a current-carrying asperity in contact with a polycrystalline substrate. Our method couples continuum solutions of electrical and thermal transport equations to an underlying molecular dynamics simulation. We present simulations of gold-nickel asperities and substrates in order to evaluate the influence of alloying and local order on the early stages of contact actuation. The room temperature response of these materials is compared to the response of the material when a voltage is applied. Au-Ni interactions are accounted for through modification of the existing Zhou embedded atom method

  8. Predictability of the Ningaloo Niño/Niña.

    PubMed

    Doi, Takeshi; Behera, Swadhin K; Yamagata, Toshio

    2013-01-01

    The seasonal prediction of the coastal oceanic warm event off West Australia, recently named the Ningaloo Niño, is explored by use of a state-of-the-art ocean-atmosphere coupled general circulation model. The Ningaloo Niño/Niña, which generally matures in austral summer, is found to be predictable two seasons ahead. In particular, the unprecedented extreme warm event in February 2011 was successfully predicted 9 months in advance. The successful prediction of the Ningaloo Niño is mainly due to the high prediction skill of La Niña in the Pacific. However, the model deficiency to underestimate its early evolution and peak amplitude needs to be improved. Since the Ningaloo Niño/Niña has potential impacts on regional societies and industries through extreme events, the present success of its prediction may encourage development of its early warning system. PMID:24100593

  9. Oxide-Sulfate equilibria in the Mg, Ni, and Mn systems measured by a solid K2SO4 concentration cell

    NASA Astrophysics Data System (ADS)

    Gauthier, Michel; Bale, Christopher W.

    1983-03-01

    An emf cell with a solid K2SO4 electrolyte and a circulating SO2/air gas mixture as the reference electrode has been employed as a gas probe to measure the thermodynamic properties of chemical reactions of the type: MSO4(s) = MO(s) + SO3(g). The three systems MgO-MgSO4, NiO-NiSO4, and Mn2O3-MnSO4 have been investigated in the temperature range 873 to 1173 K. The results for the magnesium and nickel systems are generally in good agreement with thermodynamic data from the recent literature, thus validat.ng the use of solid K2SO4 as an SO3 (and SO2) probe. The standard free energy change on sulfation of Mn2O3 determined here is in good agreement with values determined indirectly from the literature. Combination of the present results with the literature data provides additional evidence of solid-state transitions in MnSO4 and MgSO4 with an associated enthalpy of transition that is the same order of magnitude as the enthalpies of fusion for these compounds.

  10. TbxEr1-xNi5 compounds: ideal model system for competing Ising-XY anisotropy energies

    SciTech Connect

    Pirogov, A.N.; Park, J.-G.; Ermolenko, A.S.; Korolev, A.V.; Kuchin, A.G.; Lee, Seongsu; Choi, Y.N.; Park, Junghwan; Ranot, Mahipal; Yi, Junghwan; Gerasimov, E.G.; Dorofeev, Yu.A.; Vokhmyanin, A.P.; Podlesnyak, Andrey A; Swainson, I.P.

    2009-01-01

    We have studied TbxEr1-xNi5 (x=0, 0.1, 0.2, 0.3, 0.4, 0.6, 0.8, 0.925, and 1.0) compounds by using several experimental techniques such as ac-susceptibility, heat-capacity, and neutron-diffraction measurements. All the compounds are found to crystallize in the CaCu5-type structure with space group P6/mmm. The a axis shows a linear increase with Tb concentration, whereas the c axis remains almost unchanged over the whole doping range. Our neutron-diffraction studies revealed that samples for 0=x=0.8 have a commensurate magnetic structure with k=0, whereas the two samples on the Tb-rich phase (x=0.925 and 1.0) have an incommensurate structure. Of particular interest is that individual Tb and Er moments keep their mutually orthogonal arrangement seen at the end-member compositions over the whole doping range, due to very strong magnetic anisotropy of single-ion nature. We have established a complete magnetic x-T phase diagram of TbxEr1-xNi5 to find that two straight lines of the ordering of the Tb and Er subsystems are persistently seen, which intersect at a tetracritical point.

  11. Formation of dioxins on NiO and NiCl2 at different oxygen concentrations.

    PubMed

    Yang, Jie; Yan, Mi; Li, Xiaodong; Lu, Shengyong; Chen, Tong; Yan, Jianhua; Olie, Kees; Buekens, Alfons

    2015-08-01

    Model fly ash (MFA) containing activated carbon (AC) as source of carbon, NaCl as source of chlorine and either NiO or NiCl2 as de novo catalyst, was heated for 1h at 350 °C in a carrier gas flow composed of N2 containing 0, 6, 10, and 21 vol.% O2, to study the formation of PCDD/Fs (dioxins) and its dependence on oxygen. The formation of PCDD/Fs with NiCl2 was stronger by about two orders of magnitude than with NiO and the difference augmented with rising oxygen concentration. The thermodynamics of the NiO-NiCl2 system were represented, X-ray absorption near edge structural (XANES) spectroscopy allowed to probe the state of oxidation of the nickel catalyst in the MFA and individual metal species were distinguished using the LCF (Linear combination fitting) technique: thus three supplemental nickel compounds (Ni2O3, Ni(OH)2, and Ni) were found in the fly ash. Principal Component Analysis (PCA) indicates that both Ni2O3 and NiCl2 probably played an important role in the formation of PCDD/Fs. PMID:25951618

  12. Corrosion performance of bi-layer Ni/Cr2C3-NiCr HVAF thermal spray coating

    NASA Astrophysics Data System (ADS)

    Sadeghimeresht, E.; Markocsan, N.; Nylén, P.; Björklund, S.

    2016-04-01

    The corrosion behavior of three HVAF thermal spray coating systems (A: single-layer Ni, B: single-layer Cr2C3-NiCr coatings, and C: bi-layer Ni/Cr2C3-NiCr coating) was comparatively studied using immersion, salt spray, and electrochemical tests. Polarization and EIS results showed that the corrosion behavior of Cr2C3-NiCr coatings in 3.5 wt.% NaCl solution was significantly improved by adding the intermediate layer of Ni. It was illustrated that the polarization resistance of the bi-layer Ni/Cr2C3-NiCr and single-layer Cr2C3-NiCr coatings were around 194 and 38 kΩ cm2, respectively. Microstructure analysis revealed that the bond coating successfully prevented the corrosion propagation toward the coating.

  13. Structural models of the bimetallic subunit at the A-cluster of acetyl coenzyme a synthase/CO dehydrogenase: binuclear sulfur-bridged Ni-Cu and Ni-Ni complexes and their reactions with CO.

    PubMed

    Harrop, Todd C; Olmstead, Marilyn M; Mascharak, Pradip K

    2004-11-17

    The Ni(II)-dicarboxamido-dithiolato complexes (Et4N)2[Ni(NpPepS)] (1) and (Et4N)2[Ni(PhPepS)] (2) were used as Nid metallosynthons in the construction of higher nuclearity dinuclear Ni-Cu and Ni-Ni species to model the bimetallic Mp-Nid site of the A-cluster of acetyl coenzyme A synthase/CO dehydrogenase (ACS/CODH). Reaction of 1 with [Cu(neo)Cl] and [Ni(terpy)Cl2] in MeCN affords the dinuclear complexes (Et4N)[Cu(neo)Ni(NpPepS)] (3) and [Ni(terpy)Ni(NpPepS)] (4), respectively. Reaction of 2 with [Ni(dppe)Cl2] in MeCN yields [Ni(dppe)Ni(PhPepS)] (6). The Ni-Cu complex 3 exhibits no redox chemistry at the Nid site and no reaction with CO. In contrast, the Nip sites in 4 and 6 are readily reduced (characterized by their Ni(I) EPR spectra) and bind CO, exhibiting nuco bands at 2044 and 1997 cm-1, respectively, indicating terminal CO binding. The present Ni-Ni systems replicate the structural and chemical properties of the A-cluster site in ACS/CODH and support the presence of Ni at Mp in the catalytically active enzyme.

  14. Effects of PEG-Induced Water Deficit in Solanum nigrum on Zn and Ni Uptake and Translocation in Split Root Systems

    PubMed Central

    Feller, Urs; Anders, Iwona; Wei, Shuhe

    2015-01-01

    Drought strongly influences root activities in crop plants and weeds. This paper is focused on the performance of the heavy metal accumulator Solanum nigrum, a plant which might be helpful for phytoremediation. The water potential in a split root system was decreased by the addition of polyethylene glycol (PEG 6000). Rubidium, strontium and radionuclides of heavy metals were used as markers to investigate the uptake into roots, the release to the shoot via the xylem, and finally the basipetal transport via the phloem to unlabeled roots. The uptake into the roots (total contents in the plant) was for most makers more severely decreased than the transport to the shoot or the export from the shoot to the unlabeled roots via the phloem. Regardless of the water potential in the labeling solution, 63Ni and 65Zn were selectively redistributed within the plant. From autoradiographs, it became evident that 65Zn accumulated in root tips, in the apical shoot meristem and in axillary buds, while 63Ni accumulated in young expanded leaves and roots but not in the meristems. Since both radionuclides are mobile in the phloem and are, therefore, well redistributed within the plant, the unequal transfer to shoot and root apical meristems is most likely caused by differences in the cell-to-cell transport in differentiation zones without functional phloem (immature sieve tubes). PMID:27135329

  15. LDA-Prediction of New Stable Crystal Structures within=0A= the Cu-Au and Ni-Pt Alloy Systems.^*

    NASA Astrophysics Data System (ADS)

    Sanati, M.; Wang, L.; Zunger, Alex

    2002-03-01

    Cu-Au and Ni-Pt are among the best studied fcc alloy systems, exhibiting the famous L10 (AB) and L12 (A_3B) phases. We were wondering if a complete configurational search of the T=3D0 LDA total energies would reveal any unexpected phases. Total-energy calculations of ~ 30 arbitrarily chosen structures were used to construct a generalized (momentum-space) Ising Hamiltonian containing ~ 20 pair-interactions, ~ 5-10 many-body terms, as well as the long-range strain term. This Hamiltonian was tested carefully as to its ability to predict the LDA energies of other structures. Once accuracy is established, we searched the energies of all fcc configurations with 20 or less atoms per primitive cell ( ~ 2,700,000 structures), finding the known L1_0, L12 plus new, unsuspected structures. The new ground state structures are NiPt_7, Cu_2Au, and Cu_2Au_3. We find that LDA calculations of these structures confirm that they are ground states. We describe the band structure and other properties of these new structures. ^* Supported by DOE, SC-BES-DMS. abstract.

  16. A first-principles investigation on the effects of magnetism on the Bain transformation of α-phase FeNi systems

    NASA Astrophysics Data System (ADS)

    Rahman, Gul; Gee Kim, In; Bhadeshia, H. K. D. H.

    2012-03-01

    The effects of magnetism on the Bain transformation of α-phase FeNi systems are investigated by using the full potential linearized augmented plane wave method based on the generalized gradient approximation. We found that Ni impurity in bcc Fe increases the lattice constant in the ferromagnetic (FM) states, but not in the nonmagnetic (NM) states. The shear modulus, G, and Young's modulus, E, of bcc Fe are also increased by raising the concentration of nickel. All the compositions considered show high shear anisotropy, and the ratio of the bulk to shear modulus is greater than 1.75, implying ductility. The mean sound velocities in the [100] directions are greater than in the [110] directions. The Bain transformation, which is a component of martensitic transformation, has also been studied to reveal that NixFe1-x alloys are elastically unstable in the NM states, but not so in the FM states. The electronic structures explain these results in terms of the density of states at the Fermi level. It is evident that magnetism cannot be neglected when dealing with the Bain transformation in iron and its alloys.

  17. The magnetic composition temperature phase diagram of the kagome mixed system (CoxNi1-x)3V2O8

    NASA Astrophysics Data System (ADS)

    Qureshi, N.; Fuess, H.; Ehrenberg, H.; Hansen, T. C.; Ritter, C.; Adelmann, P.; Meingast, C.; Wolf, Th; Zhang, Q.; Knafo, W.

    2008-03-01

    The magnetic composition-temperature (x-T) phase diagram of the mixed kagome system (CoxNi1-x)3V2O8 (CNVO) deduced from neutron powder diffraction and single-crystal heat capacity experiments is presented. CNVO changes its magnetic structure twice below 5.5 K as a function of the compositional parameter x. A sample with x = 0.98 has been found to be of a critical composition where both ferromagnetic and antiferromagnetic reflections of the Co3V2O8 (CVO) type magnetic structure have been observed in the diffraction pattern. Below this composition the ferromagnetic phase is completely suppressed and antiferromagnetic short-range order is present, which is modulated by a propagation vector k1 = (0,δ,0) with δ being temperature and composition dependent. Below 4.2 K δ has a constant value of 0.4 for 0.76Ni3V2O8 (NVO) type with k2 = (δ,0,0), where δ is only dependent on x, takes place. Finally, for x<0.035 the positions of the magnetic reflections become temperature dependent again.

  18. New complex bismuth oxides in the Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5} system and their properties

    SciTech Connect

    Egorysheva, A.V.; Ellert, O.G.; Zubavichus, Y.V.; Gajtko, O.M.; Efimov, N.N.; Svetogorov, R.D.; Murzin, V.Yu.

    2015-05-15

    Phase equilibria in the Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5} system have been investigated. The isothermal section of the system (650°) has been constructed. For the first time the existence of the pyrochlore structure solid solution, (Bi{sub 2−x}Ni{sub x})Ni{sub 2/3−y}Sb{sub 4/3+y}O{sub 7±δ}, x=0.1−0.35, y=0−0.1, and a new compound Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} of KSbO{sub 3} structure type have been discovered. The structures and properties of these compounds were studied by XRD, XAFS, diffuse reflection spectroscopy and magnetic methods. Rietveld refinement of synchrotron radiation-based powder XRD data for pyrochlore sample of 38.43Bi{sub 2}O{sub 3}–33.0NiO–28.57Sb{sub 2}O{sub 5} composition and Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} compound was performed. The best possible refinement of the positional parameters for both pyrochlore and Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} structures was achieved for disordered models. Magnetic, diffuse reflection and an X-ray absorption spectroscopy study confirmed that in both compounds nickel ions are mainly in a 2+ oxidation state. According to magnetic data, Bi{sub 1.84}Ni{sub 0.16}(Ni{sub 0.63}Sb{sub 1.37})O{sub 7} pyrochlore and Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} are overall paramagnetic in nature. - Graphical abstract: Isothermal section of the Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5} system at 650 °C in air and variation of magnetic susceptibility and inverse susceptibility with temperature for Bi{sub 1.84}Ni{sub 0.79}Sb{sub 1.37}O{sub 7} pyrochlore. - Highlights: • We have constructed the isothermal section of the system Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5}. • The boundaries of pyrochlore structure solid solution have been determined. • New Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} compound of KSbO{sub 3} structure type have been discovered. • The structures were studied by means of synchrotron X-ray diffraction and XAFS. • Magnetic measurements

  19. Optimization of the Ni(P) Thickness for an Ultrathin Ni(P)-Based Surface Finish in Soldering Applications

    NASA Astrophysics Data System (ADS)

    Ho, C. E.; Wang, S. J.; Fan, C. W.; Wu, W. H.

    2014-01-01

    The effects of the Ni(P) thickness δ Ni(P) on the interfacial reaction between an Sn-3Ag-0.5Cu solder and an Au/Pd(P)/Ni(P)/Cu pad (thickness: 0.05/0.05/0.1-0.3/20 μm) and the resulting mechanical properties were investigated using scanning electron microscopy equipped with an electron backscatter diffraction system, a focused ion beam system, electron probe microanalysis, and high-speed ball shear (HSBS) testing. Regardless of δ Ni(P), all of the Au/Pd(P)/Ni(P) surface finishes examined were completely exhausted in one reflow, exposing the Cu pad underneath the solder. Cu6Sn5 dissolved with various Ni contents, termed (Cu,Ni)6Sn5, was the dominant intermetallic compound (IMC) species at the solder/Cu interface. Additionally, Ni2SnP and Ni3P IMCs might form with the (Cu,Ni)6Sn5 in the thick Ni(P) case, i.e., δ Ni(P) = 0.3 μm, and the two IMCs (Ni2SnP and Ni3P) were gradually eliminated from the interface after multiple reflows. A mass balance analysis indicated that the growth of the Ni-containing IMCs, rather than the dissolution of the metallization pad, played a key role in the Ni(P) exhaustion. The HSBS test results indicated that the mechanical strength of the solder joints was also δ Ni(P) dependent. The combined results of the interfacial reaction and the mechanical evaluation provided the optimal δ Ni(P) value for soldering applications.

  20. The Influence of Cooling Rate During Crystallization on the Effective Partitioning Coefficient in High-Entropy Alloys from Al-Ti-Co-Ni-Fe System

    NASA Astrophysics Data System (ADS)

    Górecki, Kamil; Bala, Piotr; Cios, Grzegorz; Koziel, Tomasz; Stępień, Milena; Wieczerzak, Krzysztof

    2016-07-01

    An influence of two different cooling rates on the microstructure and dispersion of the components of high-entropy alloy from Al-Ti-Co-Ni-Fe system has been examined. For investigated alloys, the effective partitioning coefficient has been calculated. This factor indicates the degree of segregation of elements and allows for the specification of the differences between dendrites and interdendritic regions. The obtained results allow for the conclusion that the cooling rate substantially affect the growth of dendrites and the volume fraction of interdendritic regions as well as the partitioning of elements in the alloy. Furthermore, the obtained results made it possible to compare the influence of the cooling rate and the chemical composition on the dispersion of the alloying elements.

  1. Dynamical multi-breakup processes in the {sup 124}Sn+{sup 64}Ni system at 35 MeV/nucleon

    SciTech Connect

    Papa, M.; Cardella, G.; De Filippo, E.; Giuliani, G.; Lanzano, G.; Pagano, A.; Pirrone, S.; Politi, G.; Porto, F.; Verde, G.; Amorini, F.; Anzalone, A.; Bonasera, A.; Cavallaro, S.; Colonna, M.; Di Toro, M.; Giustolisi, F.; Iacono-Manno, M.; La Guidara, E.; Lanzalone, G.

    2007-05-15

    Multi-breakup processes for the {sup 124}Sn+{sup 64}Ni system at 35 MeV/nucleon have been studied with the forward part of the CHIMERA detector. An extensive comparison between experimental data corresponding to almost complete ternary events and constrained molecular dynamics (CoMD-II) calculations suggests different characteristic times in the selected processes. This is in agreement with previous studies of the same reaction already published concerning the prompt intermediate-mass-fragment emission. Stimulated by CoMD-II calculations, we investigate the existence of more complex dynamical multi-breakup processes occurring on the same time scale. A detailed study of the rotational dynamics leading to slower dynamical fission processes is also presented.

  2. Large Scale DD Simulation Results for Crystal Plasticity Parameters in Fe-Cr And Fe-Ni Systems

    SciTech Connect

    Zbib, Hussein M.; Li, Dongsheng; Sun, Xin; Khaleel, Mohammad A.

    2012-04-30

    The development of viable nuclear energy source depends on ensuring structural materials integrity. Structural materials in nuclear reactors will operate in harsh radiation conditions coupled with high level hydrogen and helium production, as well as formation of high density of point defects and defect clusters, and thus will experience severe degradation of mechanical properties. Therefore, the main objective of this work is to develop a capability that predicts aging behavior and in-service lifetime of nuclear reactor components and, thus provide an instrumental tool for tailoring materials design and development for application in future nuclear reactor technologies. Towards this end goal, the long term effort is to develop a physically based multiscale modeling hierarchy, validated and verified, to address outstanding questions regarding the effects of irradiation on materials microstructure and mechanical properties during extended service in the fission and fusion environments. The focus of the current investigation is on modern steels for use in nuclear reactors including high strength ferritic-martensitic steels (Fe-Cr-Ni alloys). The effort is to develop a predicative capability for the influence of irradiation on mechanical behavior. Irradiation hardening is related to structural information crossing different length scales, such as composition, dislocation, and crystal orientation distribution. To predict effective hardening, the influence factors along different length scales should be considered. Therefore, a hierarchical upscaling methodology is implemented in this work in which relevant information is passed between models at three scales, namely, from molecular dynamics to dislocation dynamics to dislocation-based crystal plasticity. The molecular dynamics (MD) was used to predict the dislocation mobility in body centered cubic (bcc) Fe and its Ni and Cr alloys. The results are then passed on to dislocation dynamics to predict the critical resolved

  3. Capture of Hydrogen Using ZrNi

    NASA Technical Reports Server (NTRS)

    Patton, Lisa; Wales, Joshua; Lynch, David; Parrish, Clyde

    2005-01-01

    Water, as ice, is thought to reside in craters at the lunar poles along with CH4 and H2 . A proposed robotic mission for 2012 will utilize metal/metal hydrides for H2 recovery. Specifications are 99% capture of H2 initially at 5 bar and 100C (or greater), and degassing completely at 300C. Of 47-systems examined using the van't Hoff equation, 4 systems, Mg/MgH2, Mg2Ni/Mg2NiH4, ZrNi/ZrNiH2.8, and Pd/PdH0.77, were considered likely candidates for further examination. It is essential, when selecting a system, to also examine questions regarding activation, kinetics, cyclic stability, and gas impurity effects. After considering those issues, ZrN1 was selected as the most promising candidate, as it is easily activated and rapidly forms ZrNiH 2.8 . In addition, it resists oxide poisoning by CO2, and H2O, while some oxidation by O2 is recommended for improved activation . The presence of hydrogen in the as received Zr-Ni alloy from Alfa Aesar posed additional technical problems. X-ray diffraction of the Zr-Ni powder (-325 mesh), with a Zr:Ni wt% ratio of 70:30, was found to consist of ZrH2, ZrNiH2.8, and ZrNi. ZrH2 in the alloy presented the risk that after degassing that both Zr and ZrNi would be present, and thus lead to erroneous results regarding the reactivity of ZrNi with H2 . Fortunately, ZrH2 is a highly stable hydride that does not degas H2 to any significant extent at temperatures below 300C. Based on equilibrium calculations for the decomposition of ZrH2, only 1 millionth of the hydride decomposed at 300C under a N2 atmosphere flowing at 25 ccm for 64 hours, the longest time for pretreatment employed in the investigation. It was possible, from the X-ray results and knowledge of the Zr:Ni ratio, to compute the composition of a pretreated specimen as being 76 wt% ZrNi and the balance ZrH2.

  4. Theoretical studies of Ni/sub 3/Al and NiAl with impurities

    SciTech Connect

    Chen, S.P.; Voter, A.F.; Boring, A.M.; Albers, R.C.; Hay, P.J.

    1988-01-01

    Intermetallic compound has been extensively studied because of their superior properties in strength, low creep rate, and high melting point. But most of the systems have room temperature ductility problems, like Ll/sub 2/ and B2 compounds. Both Ll/sub 2/ Ni/sub 3/Al and B2 NiAl exhibit intergranular fracture mode. Understanding grain boundaries in these materials is of particular importance since intergranular fracture limits the applicability of these otherwise promising material. In an effort trying to understand the fracture mechanism, we have used embedded atom potentials to study the properties of Ni/sub 3/Al and NiAl. We also consider the effect of boron, sulfur, and nickel segregation on the strength of grain boundaries in Ni/sub 3/Al and NiAl. 22 refs., 2 figs.

  5. Scattering process for the system 7Be + 58Ni at 23.2 MeV beam energy

    NASA Astrophysics Data System (ADS)

    Mazzocco, M.; Torresi, D.; Fierro, N.; Acosta, L.; Boiano, A.; Boiano, C.; Glodariu, T.; Guglielmetti, A.; La Commara, M.; Martel, I.; Mazzocchi, C.; Molini, P.; Pakou, A.; Parascandolo, C.; Parker, V. V.; Patronis, N.; Pierroutsakou, D.; Romoli, M.; Sanchez-Benitez, A. M.; Sandoli, M.; Signorini, C.; Silvestri, R.; Soramel, F.; Stiliaris, E.; Strano, E.; Stroe, L.; Zerva, K.

    2013-03-01

    We measured for the first time the scattering process of 7Be nuclei from a 58Ni target at 23.2 MeV beam energy. The experiment was performed at the Laboratori Nazionali di Legnaro (LNL, Italy), where the 7Be Radioactive Ion Beam was in-flight produced with the facility EXOTIC. Charged reaction products were detected by means of the detector array DINEX, arranged in a cylindrical configuration around the target to ensure a polar angle coverage in the ranges θcm = 40°-80° and 110°-150°. The scattering differential cross section was analyzed within the optical model formalism with the coupled-channel code FRESCO to extract the total reaction cross section. The result was compared with those obtained at lower beam energies in an earlier experiment performed at the University of Notre Dame (USA). At the present stage of our analysis, the two data sets were found to be not fully consistent each other.

  6. Comparison of working length control consistency between hand K-files and Mtwo NiTi rotary system

    PubMed Central

    Krajczár, Károly; Varga, Enikő; Jeges, Sára; Tóth, Vilmos

    2016-01-01

    Background The purpose of this study was to investigate the consistency of working length control between hand instrumentation in comparison to engine driven Mtwo nickel-titanium rotary files. Material and Methods Forty extracted maxillary molars were selected and divided onto two parallel groups. The working lengths of the mesiobuccal root canals were estimated. The teeth were fixed in a phantom head. The root canal preparation was carried out group 1 (n=20) with hand K-files, (VDW, Munich, Germany) and group 2 (n=20) with Mtwo instruments (VDW, Munich, Germany). Vestibulo-oral and mesio-distal directional x-ray images were taken before the preparation with #10 K-file, inserted into the mesiobuccal root canal to the working length, and after preparation with #25, #30 and #40 files. Working lenght changes were detected with measurements between the radiological apex and the instrument tips. Results In the Mtwo group a difference in the working competency (p<0.05) could be noticed only in the vestibulo-oral direction from #10 to #40 file. The hand instrument group showed a significant difference in working length competency for each larger file size (p<0.05) (ANOVA). Regression analysis in the hand instrumentation group indicated a working length decrease with a mean of 0,2 mm after each consecutive file size (p<0.01). Conclusions The outcome of our trial indicated a high consistency in working length control for root canal preparation under simulated clinical condition using Mtwo rotary files. Mtwo NiTi rotary file did therefore proved to be more accurate in comparison to the conventional hand instrumentation. Key words:Working length, Mtwo, nickel-titanium, hand preparation, engine driven preparation. PMID:27034752

  7. PRINCEPS: A computer-based approach to the structural description and recognition of trends within structural databases, and its application to the Ce-Ni-Si System

    DOE PAGES

    Guo, Yiming; Fredrickson, Daniel C.

    2016-04-01

    Intermetallic crystal structures offer an enormous structural diversity, with an endless array of structural motifs whose connection to stability and physical properties are often mysterious. Making sense of the often complex crystal structures that arise here, developing a clear structural description, and identifying connections to other phases can be laborious and require an encyclopedic knowledge of structure types. In this Article, we present PRINCEPS, an algorithm based on a new coordination environment projection scheme that facilitates the structural analysis and comparison of such crystal structures. We demonstrate the potential of this approach by applying it to the complex Ce-Ni-Si ternarymore » system, whose 17 binary and 21 ternary phases would present a daunting challenge to one seeking to understand the system by manual inspection (but has nonetheless been well-described through the heroic efforts of previous researchers). With the help of PRINCEPS, most of the ternary phases in this system can be rationalized as intergrowths of simple structural fragments, and grouped into a handful of structural series (with some outliers). Lastly, these results illustrate how the PRINCEPS approach can be used to organize a vast collection of crystal structures into structurally meaningful families, and guide the description of complex atomic arrangements.« less

  8. Layer-Resolved Magnetic Moments in Ni/Pt Multilayers

    NASA Astrophysics Data System (ADS)

    Wilhelm, F.; Poulopoulos, P.; Ceballos, G.; Wende, H.; Baberschke, K.; Srivastava, P.; Benea, D.; Ebert, H.; Angelakeris, M.; Flevaris, N. K.; Niarchos, D.; Rogalev, A.; Brookes, N. B.

    2000-07-01

    The magnetic moments in Ni/Pt multilayers are thoroughly studied by combining experimental and ab initio theoretical techniques. SQUID magnetometry probes the samples' magnetizations. X-ray magnetic circular dichroism separates the contribution of Ni and Pt and provides a layer-resolved magnetic moment profile for the whole system. The results are compared to band-structure calculations. Induced Pt magnetic moments localized mostly at the interface are revealed. No magnetically ``dead'' Ni layers are found. The magnetization per Ni volume is slightly enhanced compared to bulk NiPt alloys.

  9. Probing antiferromagnetism in NiMn/Ni/(Co)/Cu3Au(001) single-crystalline epitaxial thin films

    NASA Astrophysics Data System (ADS)

    Yaqoob Khan, M.; Wu, Chii-Bin; Erkovan, Mustafa; Kuch, Wolfgang

    2013-01-01

    Antiferromagnetism of equi-atomic single-crystalline NiMn thin film alloys grown on Ni/Cu3Au(001) is probed by means of magneto-optical Kerr effect (MOKE). Thickness-dependent coercivity (HC) enhancement of polar MOKE measurements in NiMn/Ni/Cu3Au(001) shows that ˜7 atomic monolayers (MLs) NiMn order antiferromagnetically at room temperature. It is found that NiMn can couple to out-of-plane (OoP) as well as in-plane (IP) magnetized Ni films, the latter stabilized by Co under-layer deposition. The antiferromagnetic (AFM) ordering temperature (TAFM) of NiMn coupled to OoP Ni is found to be much higher (up to 110 K difference) than in the IP case, for similar interfacial conditions. This is attributed to a magnetic proximity effect in which the ferromagnetic (FM) layer substantially influences TAFM of the adjacent AFM layer, and can be explained by either (i) a higher interfacial coupling strength and/or (ii) a thermally more stable NiMn spin structure when coupled to Ni magnetized in OoP direction than in IP. An exchange-bias effect could only be observed for the thickest NiMn film studied (35.7 ML); the exchange-bias field is higher in the OoP exchange-coupled system than in the IP one, possibly due to the same reason/s.

  10. Probing antiferromagnetism in NiMn/Ni/(Co)/Cu3Au(001) single-crystalline epitaxial thin films

    NASA Astrophysics Data System (ADS)

    Yaqoob Khan, M.; Wu, Chii-Bin; Kuch, Wolfgang

    2012-02-01

    Antiferromagnetism of equi-atomic single-crystalline NiMn thin film alloys grown on Ni/Cu3Au(001) is probed by means of magneto-optical Kerr effect (MOKE). Thickness-dependent coercivity enhancement of NiMn/Ni/Cu3Au(001) showed that 7 atomic monolayers (ML) NiMn order antiferromagnetically at room temperature. It is found that NiMn can couple to out-of-plane (OoP) as well as in-plane (IP) magnetized Ni, the latter stabilized by Co under-layer deposition. The antiferromagnetic (AFM) ordering temperature (TAFM) of NiMn coupled to OoP Ni is found to be much higher (up to 110 K) than in the IP case, for otherwise identical interfacial conditions. This is attributed to the `magnetic proximity effect' in which the ferromagnetic (FM) layer substantially influences the TAFM of the adjacent AFM layer and can be explained by either (i) a higher interfacial coupling strength or/and (ii) more thermally stable NiMn distorted spin structure when coupled to Ni magnetized in OoP direction than in IP. An exchange-bias effect could only be observed for the thickest NiMn film studied (35.7 ML); the exchange-bias field is higher in the OoP exchange-coupled system than in the IP one due to the same reason/s.

  11. Crystal chemistry of the G-phases in the {l_brace}Ti, Zr, Hf{r_brace}-Ni-Si systems

    SciTech Connect

    Grytsiv, A.; Chen Xingqiu; Rogl, P. Podloucky, R.; Schmidt, H.; Giester, G.; Pomjakushin, V.

    2007-02-15

    Ternary compounds M{sub 6}Ni{sub 16}Si{sub 7} (M=Ti, Zr, Hf) have been investigated by X-ray powder/single crystal and neutron powder diffraction. Compounds with Zr and Hf crystallize in the ordered Th{sub 6}Mn{sub 23} type (Mg{sub 6}Cu{sub 16}Si{sub 7}-type, space group Fm3-bar m), whereas Ti{sub 6}Ni{sub 16.7}Si{sub 7} contains an additional Ni atom partially occupying the 24e site (M2 site, x=0.4637,0,0; occ.=0.119) inside a Ti octahedron; Ti atoms occupy a split position. Ti{sub 6}Ni{sub 16.7}Si{sub 7} represents a new variant of the filled Th{sub 6}Mn{sub 23} type structure. Ab initio calculations confirm the structural difference: additional Ni atoms favour the 24e site for Ti{sub 6}Ni{sub 16.7}Si{sub 7}, however, for the Zr and Hf-based compounds the unoccupied site renders an energetically lower ground state. Enthalpies of formation of Ti{sub 6}Ni{sub 17}Si{sub 7}, Zr{sub 6}Ni{sub 16}Si{sub 7}, and Hf{sub 6}Ni{sub 16}Si{sub 7} were calculated to be -68.65, -74.78, and -78.59kJ/(mol of atoms), respectively.

  12. The near-infrared spectrum of NiCl: Analysis of vibrational components of system G and system H between 12,500 cm-1 and 13,750 cm-1

    NASA Astrophysics Data System (ADS)

    Harms, Jack C.; Gipson, Courtney N.; Grames, Ethan M.; O'Brien, James J.; O'Brien, Leah C.

    2016-03-01

    The near-infrared spectrum of nickel chloride, NiCl, has been recorded at high resolution from 12,400-12,600 cm-1, 13,200-13,500 cm-1, and 13,600-13,750 cm-1 using intracavity laser absorption spectroscopy, ILS. The NiCl molecules were produced in the plasma discharge of a nickel-lined, copper hollow cathode with ∼1.8 torr of Ar as the sputter gas and a trace amount of CCl4 as the chloride source. Several transitions were observed and analyzed, including the (2, 0), (1, 0), and (0, 1) bands of the [13.0] 2Π3/2-X2Π3/2 transition, System G, and the (1, 0) band of the [12.3] 2Σ--X2Π3/2 transition, System H. The transitions were analyzed using PGOPHER and obtained molecular parameters are reported. A potential energy curve for the [13.0] 2Π3/2 state has been constructed using the vibrational information from the analyzed transitions.

  13. Magnetic properties of the intermetallic compounds PrNiSn and NdNiSn

    NASA Astrophysics Data System (ADS)

    Beirne, Eamonn Daniel

    Inelastic neutron scattering has been used to determine the crystalline electric field (CEF) excitations in the intermetallic compound PrNiSn. Polycrystalline samples of PiNiSn are found to have 7 excitations up to 30 meV, with strong low-lying modes at 2.0, 3.5, and 5.1 meV. The site symmetry of Pr3+ in this system is such that the degeneracy of the 9 levels in the J = 4 ground state multiplet is removed completely by the crystal field. From fitting this data, it is clear that the ground state is a singlet that couples to each of the other 8 excited states. The wavefunctions of the levels are determined and a level scheme proposed for this material. Inelastic scattering results are also presented for a single crystal of PrNiSn. The dispersion of the low-lying E = 3.5 meV CEF excitation is documented, showing 4 distinct modes corresponding to the 4 Pr ions in the unit cell. Susceptibility and magnetisation results for PrNiSn and NdNiSn are presented. From these measurements it is clear that the PrNiSn does not order magnetically down to 2K, whereas NdNiSn has an antifenomagnetic transition at TN = 3.1K. Resistivity measurements on PrNiSn also show no evidence of a magnetic transition, but there are gradient changes at around 4.5K and 12K. This corresponds to a local maximum at 12K and local minimum at 4.5K along the b-axis in this compound. Measurements on single crystals of these compounds show strong anisotropy in both cases, attributed to CEF effects. From the proposed CEF level scheme, the bulk properties such as the susceptibility can be modelled. Neutron powder diffraction measurements on both PrNiSn and NdNiSn confirm that there is no magnetic transition down to 1.6K in PrNiSn, and TN is confirmed for NdNiSn. Structural Rietveld fitting confirms the room temperature orthorhombic structure in both systems down to low temperature, but the magnetic structure of NdNiSn can not be determined. This is due to the magnetic peaks below TN doubling up, indicating a

  14. Evolution of Ni nanofilaments and electromagnetic coupling in the resistive switching of NiO

    NASA Astrophysics Data System (ADS)

    Luo, Yuxiang; Zhao, Diyang; Zhao, Yonggang; Chiang, Fu-Kuo; Chen, Pengcheng; Guo, Minghua; Luo, Nannan; Jiang, Xingli; Miao, Peixian; Sun, Ying; Chen, Aitian; Lin, Zhu; Li, Jianqi; Duan, Wenhui; Cai, Jianwang; Wang, Yayu

    2014-12-01

    Resistive switching effect in conductor/insulator/conductor thin-film stacks is promising for resistance random access memory with high-density, fast speed, low power dissipation and high endurance, as well as novel computer logic architectures. NiO is a model system for the resistive switching effect and the formation/rupture of Ni nanofilaments is considered to be essential. However, it is not clear how the nanofilaments evolve in the switching process. Moreover, since Ni nanofilaments should be ferromagnetic, it provides an opportunity to explore the electromagnetic coupling in this system. Here, we report a direct observation of Ni nanofilaments and their specific evolution process for the first time by a combination of various measurements and theoretical calculations. We found that multi-nanofilaments are involved in the low resistance state and the nanofilaments become thin and rupture separately in the RESET process with subsequent increase of the rupture gaps. Theoretical calculations reveal the role of oxygen vacancy amount in the evolution of Ni nanofilaments. We also demonstrate electromagnetic coupling in this system, which opens a new avenue for multifunctional devices.Resistive switching effect in conductor/insulator/conductor thin-film stacks is promising for resistance random access memory with high-density, fast speed, low power dissipation and high endurance, as well as novel computer logic architectures. NiO is a model system for the resistive switching effect and the formation/rupture of Ni nanofilaments is considered to be essential. However, it is not clear how the nanofilaments evolve in the switching process. Moreover, since Ni nanofilaments should be ferromagnetic, it provides an opportunity to explore the electromagnetic coupling in this system. Here, we report a direct observation of Ni nanofilaments and their specific evolution process for the first time by a combination of various measurements and theoretical calculations. We found

  15. Phase Equilibrium Experiments on Potential Lunar Core Compositions: Extension of Current Knowledge to Multi-Component (Fe-Ni-Si-S-C) Systems

    NASA Technical Reports Server (NTRS)

    Righter, K.; Pando, K.; Danielson, L.

    2014-01-01

    Numerous geophysical and geochemical studies have suggested the existence of a small metallic lunar core, but the composition of that core is not known. Knowledge of the composition can have a large impact on the thermal evolution of the core, its possible early dynamo creation, and its overall size and fraction of solid and liquid. Thermal models predict that the current temperature at the core-mantle boundary of the Moon is near 1650 K. Re-evaluation of Apollo seismic data has highlighted the need for new data in a broader range of bulk core compositions in the PT range of the lunar core. Geochemical measurements have suggested a more volatile-rich Moon than previously thought. And GRAIL mission data may allow much better constraints on the physical nature of the lunar core. All of these factors have led us to determine new phase equilibria experimental studies in the Fe-Ni-S-C-Si system in the relevant PT range of the lunar core that will help constrain the composition of Moon's core.

  16. Calorimetric and magnetic study for Ni{sub 50}Mn{sub 36}In{sub 14} and relative cooling power in paramagnetic inverse magnetocaloric systems

    SciTech Connect

    Chen, Jing-Han; Bruno, Nickolaus M.; Karaman, Ibrahim; Huang, Yujin; Li, Jianguo; Ross, Joseph H.

    2014-11-28

    The non-stoichiometric Heusler alloy Ni{sub 50}Mn{sub 36}In{sub 14} undergoes a martensitic phase transformation in the vicinity of 345 K, with the high temperature austenite phase exhibiting paramagnetic rather than ferromagnetic behavior, as shown in similar alloys with lower-temperature transformations. Suitably prepared samples are shown to exhibit a sharp transformation, a relatively small thermal hysteresis, and a large field-induced entropy change. We analyzed the magnetocaloric behavior both through magnetization and direct field-dependent calorimetry measurements. For measurements passing through the first-order transformation, an improved method for heat-pulse relaxation calorimetry was designed. The results provide a firm basis for the analytic evaluation of field-induced entropy changes in related materials. An analysis of the relative cooling power (RCP), based on the integrated field-induced entropy change and magnetizing behavior of the Mn spin system with ferromagnetic correlations, shows that a significant RCP may be obtained in these materials by tuning the magnetic and structural transformation temperatures through minor compositional changes or local order changes.

  17. Os, Nd, O and S isotope constraints on country rock contamination in the conduit-related Eagle Cu-Ni-(PGE) deposit, Midcontinent Rift System, Upper Michigan

    NASA Astrophysics Data System (ADS)

    Ding, Xin; Ripley, Edward M.; Shirey, Steven B.; Li, Chusi

    2012-07-01

    The Eagle Cu-Ni-(PGE) deposit is hosted by mafic to ultramafic intrusive rocks associated with the Marquette-Baraga dike swarm in northern Michigan. Sulfide mineralization formed in a conduit system during early stages in the development of the ∼1.1 Ga Midcontinent Rift System. The conduit environment represents a prime location for melt-rock interaction. In order to better assess the extent of country rock contamination in the Eagle system, a combined trace element, Nd, Os, O and S isotope study of country rocks, sulfide-bearing igneous rocks and massive sulfide was undertaken. Both the Eagle and the weakly mineralized East Eagle intrusion show trace element patterns that are similar to those of picritic basalts that formed during early stages of rift development. The trace element, Os, Nd, and O isotopic values of the igneous rocks are consistent with <5% of bulk contamination by Paleoproterozoic and Archean country rocks. Both the Re-Os and Sm-Nd system provide isochrons that are in agreement with the 1107 Ma U-Pb baddeleyite age of the intrusive rocks. Calculated γOs(1100) and εNd(1100) values for the magmas are +34 and -2. δ18O values of pyroxene in feldspathic pyroxenite range from 6.5‰ to 6.6‰ and provide the only indication that bulk contamination may locally have exceeded 20%. Sulfur isotopic values of disseminated and massive sulfide in the Eagle intrusion range from 0.3‰ to 4.6‰. The δ34S values are much lower than those that characterize most of the country rocks, but could still be indicative of a contribution of S from country rocks of up to ∼50%. Δ33S values of the disseminated and massive sulfides range from -0.10‰ to 0.09‰ indicating a source in Paleoproterozoic country rocks. Semi-massive sulfide in the Eagle deposit has δ34S values between 2.2‰ and 5.3‰, and Δ33S values show a broad range between -0.86‰ and 0.86‰ indicating a major contribution from an Archean source. Isotopic data from the Eagle deposit strongly

  18. Overall Photocatalytic Water Splitting with NiOx-SrTiO3 – A Revised Mechanism

    SciTech Connect

    Townsend, Troy K.; Browning, Nigel D.; Osterloh, Frank

    2012-11-01

    NiOx (0 < x < 1) modified SrTiO3 (STO) is one of the best studied photocatalyst for overall water splitting under UV light. The established mechanism for this and many other NiOx containing catalysts assumes water oxidation to occur at the early transition metal oxide and water reduction at NiOx. Here we show that NiOx-STO is more likely a three component Ni-STO-NiO catalyst, in which STO absorbs the light, Ni reduces protons, and NiO oxidizes water. This interpretation is based on systematic H2/O2 evolution tests of appropriately varied catalyst compositions using oxidized, chemically and photochemically added nickel and NiO nanoparticle cocatalysts. Surface photovoltage (SPV) measurements reveal that Ni(0) serves as an electron trap (site for water reduction) and that NiO serves as a hole trap (site for water oxidation). Electrochemical measurements show that the overpotential for water oxidation correlates with NiO content, whereas the water reduction overpotential depends on Ni content. Photodeposition experiments with NiCl2 and H2PtCl6 on NiO-STO show that electrons are available on the STO surface, not on the NiO particles. Based on photoelectrochemistry, both NiO and Ni particles suppress the Fermi level in STO, but the effect of this shift on catalytic activity is not clear. Overall, the results suggest a revised role for NiO in NiOx-STO and in many other nickel-containing water splitting systems, including NiOx-La:KTaO3, and many layered perovskites.

  19. The Effect of Metal Composition on Fe-Ni Partition Behavior between Olivine and FeNi-Metal, FeNi-Carbide, FeNi-Sulfide at Elevated Pressure

    NASA Technical Reports Server (NTRS)

    Holzheid, Astrid; Grove, Timothy L.

    2005-01-01

    Metal-olivine Fe-Ni exchange distribution coefficients were determined at 1500 C over the pressure range of 1 to 9 GPa for solid and liquid alloy compositions. The metal alloy composition was varied with respect to the Fe/Ni ratio and the amount of dissolved carbon and sulfur. The Fe/Ni ratio of the metal phase exercises an important control on the abundance of Ni in the olivine. The Ni abundance in the olivine decreases as the Fe/Ni ratio of the coexisting metal increases. The presence of carbon (up to approx. 3.5 wt.%) and sulfur (up to approx. 7.5 wt.%) in solution in the liquid Fe-Ni-metal phase has a minor effect on the partitioning of Fe and Ni between metal and olivine phases. No pressure dependence of the Fe-Ni-metal-olivine exchange behavior in carbon- and sulfur-free and carbon- and sulfur-containing systems was found within the investigated pressure range. To match the Ni abundance in terrestrial mantle olivine, assuming an equilibrium metal-olivine distribution, a sub-chondritic Fe/Ni-metal ratio that is a factor of 17 to 27 lower than the Fe/Ni ratios in estimated Earth core compositions would be required, implying higher Fe concentrations in the core forming metal phase. A simple metal-olivine equilibrium distribution does not seem to be feasible to explain the Ni abundances in the Earth's mantle. An equilibrium between metal and olivine does not exercise a control on the problem of Ni overabundance in the Earth's mantle. The experimental results do not contradict the presence of a magma ocean at the time of terrestrial core formation, if olivine was present in only minor amounts at the time of metal segregation.

  20. Determination of 63Ni and 59Ni in spent ion-exchange resin and activated charcoal from the IEA-R1 nuclear research reactor.

    PubMed

    Taddei, M H T; Macacini, J F; Vicente, R; Marumo, J T; Sakata, S K; Terremoto, L A A

    2013-07-01

    A radiochemical method has been adapted to determine (59)Ni and (63)Ni in samples of radioactive wastes from the water cleanup system of the IEA-R1 nuclear research reactor. The process includes extraction chromatographic resin with dimethylglyoxime (DMG) as a functional group. Activity concentrations of (59)Ni and (63)Ni were measured, respectively, by X-ray spectrometry and liquid scintillation counting, whereas the chemical yield was determined by ICP-OES. The average ratio of measured activity concentrations of (63)Ni and (59)Ni agree well with theory.

  1. Processing and Mechanical Properties of NiAl-Based In-Situ Composites. Ph.D. Thesis Final Report

    NASA Technical Reports Server (NTRS)

    Johnson, David Ray

    1994-01-01

    In-situ composites based on the NiAl-Cr eutectic system were successfully produced by containerless processing and evaluated. The NiAl-Cr alloys had a fibrous microstructure while the NiAl-(Cr,Mo) alloys containing 1 at. percent or more molybdenum exhibited a lamellar structure. The NiAl-28Cr-6Mo eutectic displays promising high temperature strength while still maintaining a reasonable room temperature fracture toughness when compared to other NiAl-based materials. The Laves phase NiAlTa was used to strengthen NiAl and very promising creep strengths were found for the directionally solidified NiAl-NiAlTa eutectic. The eutectic composition was found to be near NiAl-15.5Ta (at. percent) and well aligned microstructures were produced at this composition. An off-eutectic composition of NiAl-14.5Ta was also processed, consisting of NiAl dendrites surrounded by aligned eutectic regions. The room temperature toughness of these two phase alloys was similar to that of polycrystalline NiAl even with the presence of the brittle Laves phase NiAlTa. Polyphase in-situ composites were generated by directional solidification of ternary eutectics. The systems investigated were the Ni-Al-Ta-X (X=Cr, Mo, or V) alloys. Ternary eutectics were found in each of these systems and both the eutectic composition and temperature were determined. Of these ternary eutectics, the one in the NiAl-Ta-Cr system was found to be the most promising. The fracture toughness of the NiAl-(Cr,Al)NiTa-Cr eutectic was intermediate between those of the NiAl-NiAlTa eutectic and the NiAl-Cr eutectic. The creep strength of this ternary eutectic was similar to or greater than that of the NiAl-Cr eutectic.

  2. Numerical Prediction of the Thermodynamic Properties of Ternary Al-Ni-Pd Alloys

    NASA Astrophysics Data System (ADS)

    Zagula-Yavorska, Maryana; Romanowska, Jolanta; Kotowski, Sławomir; Sieniawski, Jan

    2016-01-01

    Thermodynamic properties of ternary Al-Ni-Pd system, such as exGAlNPd, µAl(AlNiPd), µNi(AlNiPd) and µPd(AlNiPd) at 1,373 K, were predicted on the basis of thermodynamic properties of binary systems included in the investigated ternary system. The idea of predicting exGAlNiPd values was regarded as calculation of values of the exG function inside a certain area (a Gibbs triangle) unless all boundary conditions, that is values of exG on all legs of the triangle are known (exGAlNi, exGAlPd, exGNiPd). This approach is contrary to finding a function value outside a certain area, if the function value inside this area is known. exG and LAl,Ni,Pd ternary interaction parameters in the Muggianu extension of the Redlich-Kister formalism were calculated numerically using the Excel program and Solver. The accepted values of the third component xx differed from 0.01 to 0.1 mole fraction. Values of LAlNiPd parameters in the Redlich-Kister formula are different for different xx values, but values of thermodynamic functions: exGAlNiPd, µAl(AlNiPd), µNi(AlNiPd) and µPd(AlNiPd) do not differ significantly for different xx values. The choice of xx value does not influence the accuracy of calculations.

  3. The Pd/Ni(110) bimetallic system: Surface characterisation by LEED, AES, XPS, and LEIS techniques; new insight on catalytic properties

    SciTech Connect

    Hermann, P.; Simon, D.; Guigner, J.M.

    1996-09-15

    Pd deposits on Ni(110) have been studied by low-energy electron diffraction (LEED), Auger electron spectroscopy (AES), low-energy ion scattering spectroscopy (LEIS), and X-ray photoelectron spectroscopy techniques and their catalytic properties tested by the butadiene hydrogenation reaction at room temperature. Their catalytic activity is greatly enhanced by appropriate annealings. Superstructure indicative of a long range-ordering of Pd atoms on Ni is evidenced for low Pd coverages neither before nor after annealing. AES and LEIS studies reveal a sharp Pd depth profile and the existence of a Pd-Ni surface alloy even at room temperature. The Pd 3d core level binding energy is shifted upwards by at least 0.4 eV with respect to pure Pd surface atoms and remains unchanged in the course of annealings. Hence geometrical rearrangements have to be taken into consideration to explain the activity enhancement. 22 refs., 6 figs., 4 tabs.

  4. Expression and characterization of recombinant human alpha-3/4-fucosyltransferase III from Spodoptera frugiperda (Sf9) and Trichoplusia ni (Tn) cells using the baculovirus expression system.

    PubMed Central

    Morais, V A; Serpa, J; Palma, A S; Costa, T; Maranga, L; Costa, J

    2001-01-01

    The human alpha-3/4-fucosyltransferase III (Fuc-TIII) participates in the synthesis of Lewis determinants. The enzyme from human sources is scarce and heterogeneous. In this paper we describe the expression of a secreted form of Fuc-TIII (SFT3) in two insect cell lines, Spodoptera frugiperda (Sf9) and Trichoplusia ni (Tn), using the baculovirus expression system. The Sf9 cells secreted approx. 0.4 unit/l (1 mg/l) of the enzyme. The Tn cells secreted approx. 3-fold this amount. A large proportion of active protein was accumulated in the two cell lines (50 and 75% respectively for Sf9 and Tn cells, on the fourth day after infection) indicating a possible limitation not only of the folding machinery, but also a saturation of the secretory pathway. SFT3 was purified by cation-exchange chromatography followed by affinity chromatography. The enzyme from the Tn cell line had a lower global charge, possibly due to post-translational modifications, such as phosphorylation or sulphation. The two glycosylation sites from SFT3 were occupied. SFT3 secreted by Sf9 cells was completely deglycosylated by peptide-N-glycanase F, whereas 50% of SFT3 secreted by Tn cells was resistant to deglycosylation by this enzyme. The apparent kinetic parameters determined with the type I acceptor were k(cat)=0.4 s(-1) and K(m)=0.87 mM for the SFT3 secreted by Tn cells, and k(cat)=0.09 s(-1) and K(m)=0.76 mM for the SFT3 secreted by Sf9 cells, indicating that the enzymes had substrate affinities within the same order of magnitude as their mammalian counterpart. Furthermore, SFT3 secreted by either cell type showed a clear preference for type 1 carbohydrate acceptors, similarly to human Fuc-TIII. PMID:11171070

  5. Application of atomic Hirshfeld surface analysis to intermetallic systems: is Mn in cubic CeMnNi4 a thermoelectric rattler atom?

    PubMed

    Jørgensen, Mads R V; Skovsen, Iben; Clausen, Henrik F; Mi, Jian-Li; Christensen, Mogens; Nishibori, Eiji; Spackman, Mark A; Iversen, Bo B

    2012-02-01

    The Mn atom in the cubic polymorph of CeMnNi(4) appears to be located in an oversized cage-like structure, and anomalously large atomic displacement parameters (ADPs) for the Mn atom indicate that it is a potential "rattler" atom. Here, multitemperature synchrotron powder X-ray diffraction data measured between 110 and 900 K are used to estimate ADPs for the Mn "guest" atom and the "host" structure atoms in cubic CeMnNi(4). The ADPs are subsequently fitted with Debye and Einstein models, giving Θ(D) = 301(2) K for the "host" structure and Θ(E) = 165(2) K for the Mn atom. This is higher than typical Einstein temperatures for rattlers in thermoelectric skutterudites and clathrates (Θ(E) = 50-80 K), indicating that the Mn atom in cubic CeMnNi(4) is more strongly bonded. In order to probe the chemical interactions of the potential Mn rattler atom, atomic Hirshfeld surface (AHS) analysis is carried out and compared with AHS analysis of well-established guest atom rattlers in archetypical skutterudites, MCoSb(3). Surprisingly, the skutterudite rattlers have more deformed AHSs than the Mn atom in cubic CeMnNi(4). This is related to the highly ionic nature of the skutterudite rattlers, which is not taken into account in the neutral spherical atom approach of the AHS. Additionally, visualization of void spaces in the two materials using the procrystal electron density shows that while the Mn atom is tightly fitting in the CeMnNi(4) structure then the La atom in the skutterudite is truly situated in an oversized cage of the host structure. Overall, we conclude that the Mn atom in cubic CeMnNi(4) cannot be coined a rattler.

  6. Laser ablation of Al-Ni alloys and multilayers

    NASA Astrophysics Data System (ADS)

    Roth, Johannes; Trebin, Hans-Rainer; Kiselev, Alexander; Rapp, Dennis-Michael

    2016-05-01

    Laser ablation of Al-Ni alloys and multilayers has been studied by molecular dynamics simulations. The method was combined with a two-temperature model to describe the interaction between the laser beam, the electrons, and the atoms. As a first step, electronic parameters for the alloys had to be found and the model developed originally for pure metals had to be generalized to multilayers. The modifications were verified by computing melting depths and ablation thresholds for pure Al and Ni. Here known data could be reproduced. The improved model was applied to the alloys Al_3Ni, AlNi and AlNi_3. While melting depths and ablation thresholds for AlNi behave unspectacular, sharp drops at high fluences are observed for Al_3Ni and AlNi_3. In both cases, the reason is a change in ablation mechanism from phase explosion to vaporization. Furthermore, a phase transition occurs in Al_3Ni. Finally, Al layers of various thicknesses on a Ni substrate have been simulated. Above threshold, 8 nm Al films are ablated as a whole while 24 nm Al films are only partially removed. Below threshold, alloying with a mixture gradient has been observed in the thin layer system.

  7. Euhedral metallic-Fe-Ni grains in extraterrestrial samples

    NASA Technical Reports Server (NTRS)

    Rubin, Alan E.

    1993-01-01

    Metallic Fe-Ni is rare in terrestrial rocks, being largely restricted to serpentinized peridotites and volcanic rocks that assimilated carbonaceous material. In contrast, metallic Fe-Ni is nearly ubiquitous among extraterrestrial samples (i.e., meteorites, lunar rocks, and interplanetary dust particles). Anhedral grains are common. For example, in eucrites and lunar basalts, most of the metallic Fe-Ni occurs interstitially between silicate grains and thus tends to have irregular morphologies. In many porphyritic chondrules, metallic Fe-Ni and troilite form rounded blebs in the mesostasis because their precursors were immiscible droplets. In metamorphosed ordinary chondrites, metallic Fe-Ni and troilite form coarse anhedral grains. Some of the metallic Fe-Ni and troilite grains has also been mobilized and injected into fractures in adjacent silicate grains where local shock-reheating temperatures reached the Fe-FeS eutectic (988 C). In interplanetary dust particles metallic Fe-Ni most commonly occurs along with sulfide as spheroids and fragments. Euhedral metallic Fe-Ni grains are extremely rare. Several conditions must be met before such grains can form: (1) grain growth must occur at free surfaces, restricting euhedral metallic Fe-Ni grains to systems that are igneous or undergoing vapor-deposition; (2) the metal (+/-) sulfide assemblage must have an appropriate bulk composition so that taenite is the liquidus phase in igneous systems or the stable condensate phase in vapor-deposition systems; and (3) metallic Fe-Ni grains must remain underformed during subsequent compaction, thermal metamorphism, and shock. Because of these restrictions, the occurrence of euhedral metallic Fe-Ni grains in an object can potentially provide important petrogenetic information. Despite its rarity, euhedral metallic Fe-Ni occurs in a wide variety of extraterrestrial materials. Some of these materials formed in the solar nebula; others formed on parent body surfaces by meteoroid

  8. Accurate interatomic potentials for Ni, Al and Ni/sub 3/Al

    SciTech Connect

    Voter, A.F.; Chen, Shao Ping

    1986-01-01

    To obtain meaningful results from atomistic simulations of materials, the interatomic potentials must be capable of reproducing the thermodynamic properties of the system of interest. Pairwise potentials have known deficiencies that make them unsuitable for quantitative investigations of defective regions such as crack tips and free surfaces. Daw and Baskes (Phys. Rev. B 29, 6443 (1984)) have shown that including a local ''volume'' term for each atom gives the necessary many-body character without the severe computational dependence of explicit n-body potential terms. Using a similar approach, we have fit an interatomic potential to the Ni/sub 3/Al alloy system. This potential can treat diatomic Ni/sub 2/, diatomic Al/sub 2/, fcc Ni, fcc Al and L1/sub 2/ Ni/sub 3/Al on an equal footing. Details of the fitting procedure are presented, along with the calculation of some properties not included in the fit.

  9. NiW and NiRu Bimetallic Catalysts for Ethylene Steam Reforming: Alternative Mechanisms for Sulfur Resistance

    SciTech Connect

    Rangan, M.; Yung, M. M.; Medlin, J. W.

    2012-06-01

    Previous investigations of Ni-based catalysts for the steam reforming of hydrocarbons have indicated that the addition of a second metal can reduce the effects of sulfur poisoning. Two systems that have previously shown promise for such applications, NiW and NiRu, are considered here for the steam reforming of ethylene, a key component of biomass derived tars. Monometallic and bimetallic Al{sub 2}O{sub 3}-supported Ni and W catalysts were employed for ethylene steam reforming in the presence and absence of sulfur. The NiW catalysts were less active than Ni in the absence of sulfur, but were more active in the presence of 50 ppm H{sub 2}S. The mechanism for the W-induced improvements in sulfur resistance appears to be different from that for Ru in NiRu. To probe reasons for the sulfur resistance of NiRu, the adsorption of S and C{sub 2}H{sub 4} on several bimetallic NiRu alloy surfaces ranging from 11 to 33 % Ru was studied using density functional theory (DFT). The DFT studies reveal that sulfur adsorption is generally favored on hollow sites containing Ru. Ethylene preferentially adsorbs atop the Ru atom in all the NiRu (111) alloys investigated. By comparing trends across the various bimetallic models considered, sulfur adsorption was observed to be correlated with the density of occupied states near the Fermi level while C{sub 2}H{sub 4} adsorption was correlated with the number of unoccupied states in the d-band. The diverging mechanisms for S and C{sub 2}H{sub 4} adsorption allow for bimetallic surfaces such as NiRu that enhance ethylene binding without accompanying increases in sulfur binding energy. In contrast, bimetallics such as NiSn and NiW appear to decrease the affinity of the surface for both the reagent and the poison.

  10. Site occupancy trend of Co in Ni{sub 2}MnIn: Ab initio approach

    SciTech Connect

    Pal, Soumyadipta Mahadevan, Priya; Biswas, C.

    2015-06-24

    The trend of site occupation of Co at Ni sites of Ni{sub 2}MnIn system is studied in austenitic phase having L2{sub 1} structure by ab initio density functional theory (DFT) calculation. The Co atoms prefer to be at Ni sites rather than Mn site and are ferromagetically coupled with Ni and Mn. The ground state has tetragonal structure for Ni{sub 1.5}Co{sub 0.5}MnIn and Ni{sub 1.25}Co{sub 0.75}MnIn. The Co tends to form cluster.

  11. Phase separation and antisite defects in the thermoelectric TiNiSn half-Heusler alloys

    SciTech Connect

    Kirievsky, K.; Gelbstein, Y. Fuks, D.

    2013-07-15

    The half-Heusler TiNiSn alloys have recently gained an attention as promising candidates for thermoelectric applications. Improvement of these alloys for such applications can be obtained by both electronic and compositional optimizations. The latter can result in a miscibility gap, allowing a phase separation in the nano-scale and consequently a thermal conductivity reduction. Combination of ab initio calculations and statistical thermodynamics was applied for studying the relative stability of a number of superstructures in TiNiSn based alloys. The quasi-binary phase diagram beyond T=0 K for TiNiSn–TiNi{sub 2}Sn solid solutions was calculated using energy parameters extracted from the total energy calculations for ordered structures in the Ni sublattice. We demonstrated that a decomposition of the off-stoichiometric Ni-rich half-Heusler alloy into the stoichiometric TiNiSn phase and into Ni deficient Heusler TiNi{sub 2}Sn phase occurs at elevated temperatures—an effect which recently had been observed experimentally. Furthermore, favorable energetic conditions for antisite defects formation were deduced, based on calculations of the energy of formation, an effect which was explained as a cooperative process of partial disordering on the Ni sublattice. The influence of these two effects on improvement of the thermoelectric performance of TiNiSn based half Heusler compounds is discussed. - Graphical abstract: Phase separation and antisite defects in the thermoelectric TiNiSn alloy, are covered as methods for nanostructuring and thereby enhancement of the thermoelectric potential. - Highlights: • Ab initio calculations/statistical thermodynamics was applied for studying the TiNiSn system. • The phase diagram for TiNiSn–TiNi{sub 2}Sn solid solutions was calculated. • Decomposition of the Ni-rich HH into TiNiSn and Ni deficient TiNi{sub 2}Sn phases was observed. • Favorable energetic conditions for antisite defects formation were deduced.

  12. [NiFeSe]-hydrogenase chemistry.

    PubMed

    Wombwell, Claire; Caputo, Christine A; Reisner, Erwin

    2015-11-17

    The development of technology for the inexpensive generation of the renewable energy vector H2 through water splitting is of immediate economic, ecological, and humanitarian interest. Recent interest in hydrogenases has been fueled by their exceptionally high catalytic rates for H2 production at a marginal overpotential, which is presently only matched by the nonscalable noble metal platinum. The mechanistic understanding of hydrogenase function guides the design of synthetic catalysts, and selection of a suitable hydrogenase enables direct applications in electro- and photocatalysis. [FeFe]-hydrogenases display excellent H2 evolution activity, but they are irreversibly damaged upon exposure to O2, which currently prevents their use in full water splitting systems. O2-tolerant [NiFe]-hydrogenases are known, but they are typically strongly biased toward H2 oxidation, while H2 production by [NiFe]-hydrogenases is often product (H2) inhibited. [NiFeSe]-hydrogenases are a subclass of [NiFe]-hydrogenases with a selenocysteine residue coordinated to the active site nickel center in place of a cysteine. They exhibit a combination of unique properties that are highly advantageous for applications in water splitting compared with other hydrogenases. They display a high H2 evolution rate with marginal inhibition by H2 and tolerance to O2. [NiFeSe]-hydrogenases are therefore one of the most active molecular H2 evolution catalysts applicable in water splitting. Herein, we summarize our recent progress in exploring the unique chemistry of [NiFeSe]-hydrogenases through biomimetic model chemistry and the chemistry with [NiFeSe]-hydrogenases in semiartificial photosynthetic systems. We gain perspective from the structural, spectroscopic, and electrochemical properties of the [NiFeSe]-hydrogenases and compare them with the chemistry of synthetic models of this hydrogenase active site. Our synthetic models give insight into the effects on the electronic properties and reactivity of

  13. [NiFeSe]-hydrogenase chemistry.

    PubMed

    Wombwell, Claire; Caputo, Christine A; Reisner, Erwin

    2015-11-17

    The development of technology for the inexpensive generation of the renewable energy vector H2 through water splitting is of immediate economic, ecological, and humanitarian interest. Recent interest in hydrogenases has been fueled by their exceptionally high catalytic rates for H2 production at a marginal overpotential, which is presently only matched by the nonscalable noble metal platinum. The mechanistic understanding of hydrogenase function guides the design of synthetic catalysts, and selection of a suitable hydrogenase enables direct applications in electro- and photocatalysis. [FeFe]-hydrogenases display excellent H2 evolution activity, but they are irreversibly damaged upon exposure to O2, which currently prevents their use in full water splitting systems. O2-tolerant [NiFe]-hydrogenases are known, but they are typically strongly biased toward H2 oxidation, while H2 production by [NiFe]-hydrogenases is often product (H2) inhibited. [NiFeSe]-hydrogenases are a subclass of [NiFe]-hydrogenases with a selenocysteine residue coordinated to the active site nickel center in place of a cysteine. They exhibit a combination of unique properties that are highly advantageous for applications in water splitting compared with other hydrogenases. They display a high H2 evolution rate with marginal inhibition by H2 and tolerance to O2. [NiFeSe]-hydrogenases are therefore one of the most active molecular H2 evolution catalysts applicable in water splitting. Herein, we summarize our recent progress in exploring the unique chemistry of [NiFeSe]-hydrogenases through biomimetic model chemistry and the chemistry with [NiFeSe]-hydrogenases in semiartificial photosynthetic systems. We gain perspective from the structural, spectroscopic, and electrochemical properties of the [NiFeSe]-hydrogenases and compare them with the chemistry of synthetic models of this hydrogenase active site. Our synthetic models give insight into the effects on the electronic properties and reactivity of

  14. Dye-sensitized MIL-101 metal organic frameworks loaded with Ni/NiO{sub x} nanoparticles for efficient visible-light-driven hydrogen generation

    SciTech Connect

    Liu, Xin-Ling; Wang, Rong; Yuan, Yu-Peng E-mail: cxue@ntu.edu.sg; Zhang, Ming-Yi; Xue, Can E-mail: cxue@ntu.edu.sg

    2015-10-01

    The Ni/NiO{sub x} particles were in situ photodeposited on MIL-101 metal organic frameworks as catalysts for boosting H{sub 2} generation from Erythrosin B dye sensitization under visible-light irradiation. The highest H{sub 2} production rate of 125 μmol h{sup −1} was achieved from the system containing 5 wt. % Ni-loaded MIL-101 (20 mg) and 30 mg Erythrosin B dye. Moreover, the Ni/NiO{sub x} catalysts show excellent stability for long-term photocatalytic reaction. The enhancement on H{sub 2} generation is attributed to the efficient charge transfer from photoexcited dye to the Ni catalyst via MIL-101. Our results demonstrate that the economical Ni/NiO{sub x} particles are durable and active catalysts for photocatalytic H{sub 2} generation.

  15. Recycling of the anode from spent Ni-MH batteries for synthesis of the lanthanide oxysulfide/oxysulfate compounds used in an oxygen storage and release system

    NASA Astrophysics Data System (ADS)

    Dixini, P. V. M.; Celante, V. G.; Lelis, M. F. F.; Freitas, M. B. J. G.

    2014-08-01

    In this work, lanthanide oxysulfide/oxysulfate compounds, denominated as an oxygen storage and release system, have been synthesized from the anode electrodes of spent Ni-MH batteries. The rare earth metals have recovered by means of chemical precipitation as a mixture of La2(SO4)3, Ce2(SO4)3, and Nd2(SO4)3. The synthesis of (La·Nd)O2S·CeO2 have been carried out by subjecting a mixture of La2(SO4)3, Ce2(SO4)3, and Nd2(SO4)3 to a heat treatment in a reducing atmosphere up to 1000 °C. The (La·Nd)O2SO4·CeO2 compounds have been obtained after thermal treatment of (La·Nd)O2S·CeO2 in a synthetic air atmosphere. The oxysulfide/oxysulfate compounds have been subjected to thermal cycles, respectively, in synthetic air as well as in an N2-CO atmosphere. The thermogravimetric plot (TG) for (La·Nd)2O2S·CeO2 shows a mass gain of 14.98% w/w in a temperature range of 300-550 °C, which is due to the oxidation of (La·Nd)2O2S·CeO2 to (La·Nd)2O2SO4CeO2, where 2 mol of O2 are added. Likewise, in the (La·Nd)2O2SO4CeO2 thermogravimetric plot, a mass loss of 17.16% w/w is observed in the range of 500-750 °C. This loss of mass can be associated with output of 2 mol of O2 forming again the (La·Nd)2O2S·CeO2. The transformation of the (La·Nd)2·O2S·CeO2 to (La·Nd)2O2SO4CeO2 causes an increase in the macropores.

  16. Spin states and electronic conduction in Ni oxides

    NASA Astrophysics Data System (ADS)

    Dionne, Gerald F.

    1990-05-01

    Magnetic and electronic properties of the mixed-valence semiconductor LixNi2+1-2xNi3+xO are reinterpreted in terms of low-spin states for both Ni ions. Anomalous decreases in hopping electron activation energies are discussed on the basis of (i) breakdown in antiferromagnetic ordering through spin canting of the Ni sublattices through exchange isolation caused by diamagnetic Li1+ ions that group with the low-spin Ni3+ (S= (1)/(2) ) to form polarons, and (ii) enhanced disruption of magnetic superexchange that results from a combination of Li1+ dilutants and S=0 states of surrounding Ni2+ ions induced at low temperatures by static Jahn-Teller tetragonal distortions of the oxygen octahedra around the Ni3+ polarons. Reported magnetic ordering and conduction anomalies in La2-xSrxNiO4 are then compared to the behavior of Cu in LixCu1-xO, and in the high-Tc superconducting La2-xSrxCuO4 system. Spontaneous conduction through molecular-orbital states involving zero-spin Ni and Cu ions is discussed, together with the role of S=0 polarons in other oxide superconductors.

  17. Ni-Co laterite deposits

    USGS Publications Warehouse

    Marsh, Erin E.; Anderson, Eric D.

    2011-01-01

    Nickel-cobalt (Ni-Co) laterite deposits are an important source of nickel (Ni). Currently, there is a decline in magmatic Ni-bearing sulfide lode deposit resources. New efforts to develop an alternative source of Ni, particularly with improved metallurgy processes, make the Ni-Co laterites an important exploration target in anticipation of the future demand for Ni. This deposit model provides a general description of the geology and mineralogy of Ni-Co laterite deposits, and contains discussion of the influences of climate, geomorphology (relief), drainage, tectonism, structure, and protolith on the development of favorable weathering profiles. This model of Ni-Co laterite deposits represents part of the U.S. Geological Survey Mineral Resources Program's effort to update the existing models to be used for an upcoming national mineral resource assessment.

  18. Dielectric properties of Li2O-CaF2-P2O5 glass ceramic system doped with NiO

    NASA Astrophysics Data System (ADS)

    Krishna, G. Murali; Venkateswararao, G.; Srikumar, T.; Sambasiva Rao, K.; Ram Prasad, Ch

    2009-07-01

    Studies on various physical properties viz., dielectric properties (dielectric constant, loss tan δ, a.c conductivity σ) over a wide range of frequency and temperature, of Li2O-CaF2-P2O5: NiO glass ceramics have been reported. The dielectric constant and loss variation with the concentration of NiO have been explained on the basis of space charge polarization mechanism. The dielectric relaxation effects exhibited by these samples have been analyzed by a graphical method and the spreading of dielectric relaxation has been established. The a.c conductivity in the high temperature region seems to be connected both with electronic transfer and ionic movements.

  19. Enhanced photophysical properties of plasmonic magnetic metal-alloyed semiconductor heterostructure nanocrystals: a case study for the Ag@Ni/Zn1-xMgxO system.

    PubMed

    Paul, Sumana; Ghosh, Sirshendu; Saha, Manas; De, S K

    2016-05-14

    Understanding the effect of homovalent cation alloying in wide band gap ZnO and the formation of metal-semiconductor heterostructures is very important for maximisation of the photophysical properties of ZnO. Nearly monodisperse ZnO nanopyramid and Mg alloyed ZnO nanostructures have been successfully synthesized by one pot decomposition of metal stearate by using oleylamine both as activating and capping agent. The solid solubility of Mg(ii) ions in ZnO is limited to ∼30% without phase segregation. An interesting morphology change is found on increasing Mg alloying: from nanopyramids to self-assembled nanoflowers. The morphology change is explained by the oriented attachment process. The introduction of Mg into the ZnO matrix increases the band gap of the materials and also generates new zinc interstitial (Zni) and oxygen vacancy related defects. Plasmonic magnetic Ag@Ni core-shell (Ag as core and Ni as shell) nanocrystals are used as a seed material to synthesize Ag@Ni/Zn1-xMgxO complex heterostructures. Epitaxial growth is established between Ag(111) and ZnO(110) planes in the heterostructure. An epitaxial metal-semiconductor interface is very crucial for complete electron-hole (e-h) separation and enhancement of the exciton lifetime. The alloyed semiconductor-metal heterostructure is observed to be highly photocatalytically active for dye degradation as well as photodetection. Incorporation of magnetic Ni(0) makes the photocatalyst superparamagnetic at room temperature which is found to be helpful for catalyst regeneration. PMID:27113320

  20. Mechanical and Tribological Properties of HVOF-Sprayed (Cr3C2-NiCr+Ni) Composite Coating on Ductile Cast Iron

    NASA Astrophysics Data System (ADS)

    Ksiazek, Marzanna; Boron, Lukasz; Radecka, Marta; Richert, Maria; Tchorz, Adam

    2016-08-01

    The aim of the investigations was to compare the microstructure, mechanical, and wear properties of Cr3C2-NiCr+Ni and Cr3C2-NiCr coatings deposited by HVOF technique (the high-velocity oxygen fuel spray process) on ductile cast iron. The effect of nickel particles added to the chromium carbide coating on mechanical and wear behavior in the system of Cr 3 C 2 -NiCr+Ni/ductile cast iron was analyzed in order to improve the lifetime of coated materials. The structure with particular emphasis of characteristic of the interface in the system of composite coating (Cr 3 C 2 -NiCr+Ni)/ductile cast iron was studied using the optical, scanning, and transmission electron microscopes, as well as the analysis of chemical and phase composition in microareas. Experimental results show that HVOF-sprayed Cr3C2-NiCr+Ni composite coating exhibits low porosity, high hardness, dense structure with large, partially molten Ni particles and very fine Cr3C2 and Cr7C3 particles embedded in NiCr alloy matrix, coming to the size of nanocrystalline. The results were discussed in reference to examination of bending strength considering cracking and delamination in the system of composite coating (Cr 3 C 2 -NiCr+Ni)/ductile cast iron as well as hardness and wear resistance of the coating. The composite structure of the coating provides the relatively good plasticity of the coating, which in turn has a positive effect on the adhesion of coating to the substrate and cohesion of the composite coating (Cr3C2-NiCr+Ni) in wear conditions.

  1. Mechanical and Tribological Properties of HVOF-Sprayed (Cr3C2-NiCr+Ni) Composite Coating on Ductile Cast Iron

    NASA Astrophysics Data System (ADS)

    Ksiazek, Marzanna; Boron, Lukasz; Radecka, Marta; Richert, Maria; Tchorz, Adam

    2016-07-01

    The aim of the investigations was to compare the microstructure, mechanical, and wear properties of Cr3C2-NiCr+Ni and Cr3C2-NiCr coatings deposited by HVOF technique (the high-velocity oxygen fuel spray process) on ductile cast iron. The effect of nickel particles added to the chromium carbide coating on mechanical and wear behavior in the system of Cr 3 C 2 -NiCr+Ni/ductile cast iron was analyzed in order to improve the lifetime of coated materials. The structure with particular emphasis of characteristic of the interface in the system of composite coating (Cr 3 C 2 -NiCr+Ni)/ductile cast iron was studied using the optical, scanning, and transmission electron microscopes, as well as the analysis of chemical and phase composition in microareas. Experimental results show that HVOF-sprayed Cr3C2-NiCr+Ni composite coating exhibits low porosity, high hardness, dense structure with large, partially molten Ni particles and very fine Cr3C2 and Cr7C3 particles embedded in NiCr alloy matrix, coming to the size of nanocrystalline. The results were discussed in reference to examination of bending strength considering cracking and delamination in the system of composite coating (Cr 3 C 2 -NiCr+Ni)/ductile cast iron as well as hardness and wear resistance of the coating. The composite structure of the coating provides the relatively good plasticity of the coating, which in turn has a positive effect on the adhesion of coating to the substrate and cohesion of the composite coating (Cr3C2-NiCr+Ni) in wear conditions.

  2. 61Ni synchrotron radiation-based Mössbauer spectroscopy of nickel-based nanoparticles with hexagonal structure

    NASA Astrophysics Data System (ADS)

    Masuda, Ryo; Kobayashi, Yasuhiro; Kitao, Shinji; Kurokuzu, Masayuki; Saito, Makina; Yoda, Yoshitaka; Mitsui, Takaya; Hosoi, Kohei; Kobayashi, Hirokazu; Kitagawa, Hiroshi; Seto, Makoto

    2016-02-01

    We measured the synchrotron-radiation (SR)-based Mössbauer spectra of Ni-based nanoparticles with a hexagonal structure that were synthesised by chemical reduction. To obtain Mössbauer spectra of the nanoparticles without 61Ni enrichment, we developed a measurement system for 61Ni SR-based Mössbauer absorption spectroscopy without X-ray windows between the 61Ni84V16 standard energy alloy and detector. The counting rate of the 61Ni nuclear resonant scattering in the system was enhanced by the detection of internal conversion electrons and the close proximity between the energy standard and the detector. The spectrum measured at 4 K revealed the internal magnetic field of the nanoparticles was 3.4 ± 0.9 T, corresponding to a Ni atomic magnetic moment of 0.3 Bohr magneton. This differs from the value of Ni3C and the theoretically predicted value of hexagonal-close-packed (hcp)-Ni and suggested the nanoparticle possessed intermediate carbon content between hcp-Ni and Ni3C of approximately 10 atomic % of Ni. The improved 61Ni Mössbauer absorption measurement system is also applicable to various Ni materials without 61Ni enrichment, such as Ni hydride nanoparticles.

  3. 61Ni synchrotron radiation-based Mössbauer spectroscopy of nickel-based nanoparticles with hexagonal structure

    PubMed Central

    Masuda, Ryo; Kobayashi, Yasuhiro; Kitao, Shinji; Kurokuzu, Masayuki; Saito, Makina; Yoda, Yoshitaka; Mitsui, Takaya; Hosoi, Kohei; Kobayashi, Hirokazu; Kitagawa, Hiroshi; Seto, Makoto

    2016-01-01

    We measured the synchrotron-radiation (SR)-based Mössbauer spectra of Ni-based nanoparticles with a hexagonal structure that were synthesised by chemical reduction. To obtain Mössbauer spectra of the nanoparticles without 61Ni enrichment, we developed a measurement system for 61Ni SR-based Mössbauer absorption spectroscopy without X-ray windows between the 61Ni84V16 standard energy alloy and detector. The counting rate of the 61Ni nuclear resonant scattering in the system was enhanced by the detection of internal conversion electrons and the close proximity between the energy standard and the detector. The spectrum measured at 4 K revealed the internal magnetic field of the nanoparticles was 3.4 ± 0.9 T, corresponding to a Ni atomic magnetic moment of 0.3 Bohr magneton. This differs from the value of Ni3C and the theoretically predicted value of hexagonal-close-packed (hcp)-Ni and suggested the nanoparticle possessed intermediate carbon content between hcp-Ni and Ni3C of approximately 10 atomic % of Ni. The improved 61Ni Mössbauer absorption measurement system is also applicable to various Ni materials without 61Ni enrichment, such as Ni hydride nanoparticles. PMID:26883185

  4. Surface segregation in Cu-Ni alloys

    NASA Astrophysics Data System (ADS)

    Good, Brian; Bozzolo, Guillermo; Ferrante, John

    1993-12-01

    Monte Carlo simulation is used to calculate the composition profiles of surface segregation of Cu-Ni alloys. The method of Bozzolo, Ferrante, and Smith [Phys. Rev. B 45, 493 (1992)] is used to compute the energetics of these systems as a function of temperature, crystal face, and bulk concentration. The predictions are compared with other theoretical and experimental results.

  5. Interfacial Reactions in Sn/Ni- xW Couples

    NASA Astrophysics Data System (ADS)

    Yen, Yee-Wen; Chiu, Chao-Wei; Chen, Chih-Ming; Lai, Mei-Ting; Dai, Jia-Ying

    2015-03-01

    Solid/solid and liquid/solid reaction couple techniques were applied to investigate the interfacial reactions in the Sn/Ni- xW systems ( x = 0 wt.%, 1.0 wt.%, 5.0 wt.%, and 7.5 wt.%) at 160°C to 300°C for various reaction times. The results indicate that only the Ni3Sn4 phase was formed in the Sn/Ni-1 wt.%W couple. The Ni3Sn4 phase and ternary Ni37-42Sn48W10-15 phase (T1) were formed at the Sn/Ni-5 wt.%W interface. After 400 h of aging at 210°C, the Ni26-31Sn59W10-15 phase (T2) with a discontinuous layered structure was formed in the Ni3Sn4 layer. The results in the Sn/Ni-7.5 wt.%W couple were similar to those in the Sn/Ni-5W couple. A multilayer structure, T1/Ni3Sn4/T2/Ni3Sn4, was formed after 100 h of aging at 210°C. When the reaction temperature was increased to 225°C, a new ternary phase composed of Ni5-15Sn50W35-45 (T3) was formed. T1, T2, and T3 phases were likely to be metastable phases with an amorphous structure composed of nanocrystal grains. The liquid/solid-state interfacial reactions in the Sn/Ni- xW couples are different from those in the solid-state reactions. The T1 phase was formed between the Ni3Sn4 phase and Ni- xW alloys when the W content was greater than 5 wt.%. According to the transmission electron microscopy analysis results the T1, T2, and T3 phases were likely to be metastable phases with an amorphous structure composed of nanocrystal grains.

  6. Rapid identification of areas of interest in thin film materials libraries by combining electrical, optical, X-ray diffraction, and mechanical high-throughput measurements: a case study for the system Ni-Al.

    PubMed

    Thienhaus, S; Naujoks, D; Pfetzing-Micklich, J; König, D; Ludwig, A

    2014-12-01

    The efficient identification of compositional areas of interest in thin film materials systems fabricated by combinatorial deposition methods is essential in combinatorial materials science. We use a combination of compositional screening by EDX together with high-throughput measurements of electrical and optical properties of thin film libraries to determine efficiently the areas of interest in a materials system. Areas of interest are compositions which show distinctive properties. The crystallinity of the thus determined areas is identified by X-ray diffraction. Additionally, by using automated nanoindentation across the materials library, mechanical data of the thin films can be obtained which complements the identification of areas of interest. The feasibility of this approach is demonstrated by using a Ni-Al thin film library as a reference system. The obtained results promise that this approach can be used for the case of ternary and higher order systems.

  7. Chalcophile element (Ni, Cu, PGE, and Au) variations in the Tamarack magmatic sulfide deposit in the Midcontinent Rift System: implications for dynamic ore-forming processes

    NASA Astrophysics Data System (ADS)

    Taranovic, Valentina; Ripley, Edward M.; Li, Chusi; Rossell, Dean

    2016-03-01

    The Tamarack magmatic sulfide deposit is hosted by the Tamarack Intrusive Complex (1105.6 ± 1.2 Ma) in the Midcontinent Rift System. The most important sulfide mineralization in the Complex occurs in the northern part, which consists of two separate intrusive units: an early funnel-shaped layered peridotite body containing relatively fine-grained olivine (referred to as the FGO Intrusion) at the top, and a late gabbro-troctolite-peridotite dike-like body containing relatively coarse-grained olivine (referred to as the CGO Intrusion) at the bottom. Disseminated, net-textured, and massive sulfides occur in the base of the FGO Intrusion as well as in the upper part of the CGO Intrusion. The widest part of the CGO Intrusion also hosts a large semi-massive (net-textured) sulfide ore body locally surrounded by disseminated sulfide mineralization. Small massive sulfide veins occur in the footwall of the FGO Intrusion and in the wall rocks of the CGO dike. The sulfide mineralization is predominantly composed of pyrrhotite, pentlandite, and chalcopyrite, plus minor magnetite. Pyrrhotite containing the highest Ni and Co contents occurs in the FGO disseminated sulfides and in the CGO semi-massive sulfide ores, respectively. The most important platinum-group minerals associated with the base metal sulfides are sperrylite (PtAs2), sudburyite (PdSb), and michenerite (PdBiTe). Nickel shows a strong positive correlation with S in all types of sulfide mineralization, and Cu shows a strong positive correlation with S in the disseminated sulfide mineralization. At a given S content, the concentrations of Pt, Pd, and Au in the CGO disseminated sulfides are significantly higher than those in the FGO disseminated sulfides. The semi-massive sulfide ores are characterized by significantly higher IPGE (Ir, Os, Ru, and Rh) concentrations than most of the massive sulfide ores. With few exceptions, all of the various textural types of sulfide mineralization collectively show a good positive

  8. Chalcophile element (Ni, Cu, PGE, and Au) variations in the Tamarack magmatic sulfide deposit in the Midcontinent Rift System: implications for dynamic ore-forming processes

    NASA Astrophysics Data System (ADS)

    Taranovic, Valentina; Ripley, Edward M.; Li, Chusi; Rossell, Dean

    2016-10-01

    The Tamarack magmatic sulfide deposit is hosted by the Tamarack Intrusive Complex (1105.6 ± 1.2 Ma) in the Midcontinent Rift System. The most important sulfide mineralization in the Complex occurs in the northern part, which consists of two separate intrusive units: an early funnel-shaped layered peridotite body containing relatively fine-grained olivine (referred to as the FGO Intrusion) at the top, and a late gabbro-troctolite-peridotite dike-like body containing relatively coarse-grained olivine (referred to as the CGO Intrusion) at the bottom. Disseminated, net-textured, and massive sulfides occur in the base of the FGO Intrusion as well as in the upper part of the CGO Intrusion. The widest part of the CGO Intrusion also hosts a large semi-massive (net-textured) sulfide ore body locally surrounded by disseminated sulfide mineralization. Small massive sulfide veins occur in the footwall of the FGO Intrusion and in the wall rocks of the CGO dike. The sulfide mineralization is predominantly composed of pyrrhotite, pentlandite, and chalcopyrite, plus minor magnetite. Pyrrhotite containing the highest Ni and Co contents occurs in the FGO disseminated sulfides and in the CGO semi-massive sulfide ores, respectively. The most important platinum-group minerals associated with the base metal sulfides are sperrylite (PtAs2), sudburyite (PdSb), and michenerite (PdBiTe). Nickel shows a strong positive correlation with S in all types of sulfide mineralization, and Cu shows a strong positive correlation with S in the disseminated sulfide mineralization. At a given S content, the concentrations of Pt, Pd, and Au in the CGO disseminated sulfides are significantly higher than those in the FGO disseminated sulfides. The semi-massive sulfide ores are characterized by significantly higher IPGE (Ir, Os, Ru, and Rh) concentrations than most of the massive sulfide ores. With few exceptions, all of the various textural types of sulfide mineralization collectively show a good positive

  9. Ni-Al2O3 and Ni-Al composite high-aspect-ratio microstructures

    NASA Astrophysics Data System (ADS)

    Wang, Tao; Sorrell, Melford; Kelly, Kevin W.; Ma, Evan

    1998-09-01

    High-aspect-ratio microstructures (HARMs) have a variety of potential applications in heat transfer, fluid mechanics, catalysts and other microelectromechanical systems (MEMS). The aim of this work is to demonstrate the feasibility to fabricate high performance particulate metal-matrix composite and intermetallic micromechanical structures using the LIGA process. Well-defined functionally graded Ni-Al2O3 and Ni-Al high-aspect-ratio microposts were electroformed into lithographically patterned PMMA holes from a nickel sulfamate bath containing submicron alumina and a diluted Watts bath containing microsized aluminum particles, respectively. SEM image analysis showed that the volume fraction of the alumina reached up to around 30% in the Ni-Al2O3 deposit. The Vickers microhardness of these composites is in the range of 418 through 545, which is higher than those of nickel microstructures from a similar particle-free bath and other Ni-based electrodeposits. In the work on Ni-Al electroplating, a newly developed diluted Watts bath was used to codeposit micron-sized aluminum particles. The intermetallic compound Ni3Al was formed by the reaction of nickel matrices and aluminum particles through subsequent annealing at 630 degrees Celsius. WDS and XRD analyses confirmed that the annealed coating is a two-phase (Ni-Ni3Al) composite. The maximum aluminum volume fraction reached 19% at a cathode current density of 12 mA cm-2, and the Vickers microhardness of the as-deposited coatings is in the range 392 - 515 depending on the amount of aluminum incorporated.

  10. The oxidation of Ni-rich Ni-Al intermetallics

    NASA Technical Reports Server (NTRS)

    Doychak, Joseph; Smialek, James L.; Barrett, Charles A.

    1988-01-01

    The oxidation of Ni-Al intermetallic alloys in the beta-NiAl phase field and in the two phase beta-NiAl/gamma'-Ni3Al phase field has been studied between 1000 and 1400 C. The stoichiometric beta-NiAl alloy doped with Zr was superior to other alloy compositions under cyclic and isothermal oxidation. The isothermal growth rates did not increase monotonically as the alloy Al content was decreased. The characteristically ridged alpha-Al2O3 scale morphology, consisting of cells of thin, textured oxide with thick growth ridges at cell boundaries, forms on oxidized beta-NiAl alloys. The correlation of scale features with isothermal growth rates indicates a predominant grain boundary diffusion growth mechanism. The 1200 C cyclic oxidation resistance decreases near the lower end of the beta-NiAl phase field.

  11. First-principles study of the magnetism of Ni-doped MoS2 monolayer

    NASA Astrophysics Data System (ADS)

    Luo, Min; Hao Shen, Yu; Hao Chu, Jun

    2016-09-01

    The magnetic properties of Ni-doped monolayer MoS2 are investigated using the density function theory. The results show that two Ni-doped systems of the nearest-neighbor configuration are ferromagnetic. The p-d hybridization between the Ni dopant and its neighboring S atoms results in the splitting of energy levels near the Fermi energy. These results suggest the p-d hybridization mechanism for the magnetism of the Ni-doped MoS2 monolayer. The magnetic moment disappears with increasing Ni-Ni distance. Our studies predict the nearest two-Ni-doped MoS2 monolayers to be candidates for thin dilute magnetic semiconductors. Moreover, the formation energy calculations indicate that it would be easier to incorporate Ni atoms into a S-rich MoS2 monolayer in the experiment.

  12. Endothermic reactions of Ni + with H 2, HD and D 2

    NASA Astrophysics Data System (ADS)

    Armentrout, P. B.; Beauchamp, J. L.

    1980-08-01

    An ion-beam apparatus is employed to study the reaction of Ni + with H 2, HD, and D 2 as a function of kinetic energy. These reactions lead to the endothermic formation of NiH +, NiH + and NiD +, and NiD +, respectively. Interpretation of the threshold for these processes yields the average bond energies, D0(Ni +H) = 1.86 ± 0.09 eV and D0(Ni +D) = 1.90 ± 0.14 eV. The total reaction cross sections for all three systems are similar; however, a striking isotope effect is observed for Ni + reacting with HD. The dependence of the cross sections on relative kinetic energy is discussed in terms of simple models for reaction.

  13. Role of defect coordination environment on point defects formation energies in Ni-Al intermetallic alloys

    NASA Astrophysics Data System (ADS)

    Tennessen, Emrys; Rondinelli, James

    We present a relationship among the point defect formation energies and the bond strengths, lengths, and local coordination environment for Ni-Al intermetallic alloys based on density functional calculations, including Ni3Al, Ni5Al3, NiAl,Ni3Al4, Ni2Al3 and NiAl3. We find the energetic stability of vacancy and anti-site defects for the entire family can be attributed primarily to changes in interactions among first nearest neighbors, owing to spatially localized charge density reconstructions in the vicinity of the defect site. We also compare our interpretation of the local coordination environment with a DFT-based cluster expansion and discuss the performance of each approach in predicting defect stability in the Ni-Al system.

  14. Chemical bonding and charge redistribution - Valence band and core level correlations for the Ni/Si, Pd/Si, and Pt/Si systems

    NASA Technical Reports Server (NTRS)

    Grunthaner, P. J.; Grunthaner, F. J.; Madhukar, A.

    1982-01-01

    Via a systematic study of the correlation between the core and valence level X-ray photoemission spectra, the nature of the chemical bonding and charge redistribution for bulk transition metal silicides has been examined. Particular emphasis is placed on Pt2Si and PtSi. It is observed that the strength of the metal (d)-silicon (p) interaction increases in the order Ni2Si, Pd2Si, Pt2Si. It is also observed that both the metal and silicon core lines shift to higher binding energy as the silicides are formed. The notion of charge redistribution for metallic bonds is invoked to explain these data.

  15. Mechanism of the α-to-β phase transformation in the LaNi5-H2 system

    SciTech Connect

    Gray, E. MacA.; Blach, T. P.; Pitt, M. P.; Cookson, D. J.

    2014-09-24

    High-energy synchrotron in situ X-ray powder diffraction has been used to elucidate the mechanism of the hydriding phase transformation in a LaNi5 model hydrogen storage intermetallic in real time. The transformation proceeds at 10 ºC via the transient growth of an interfacial phase, the {gamma} phase, with lattice parameters intermediate between those of the α (dilute solid solution) and β (concentrated hydride) phases. The γ phase forms to partially accommodate the 24% change in unit cell volume between the α and β phases during hydriding and dehydriding. The α, γ and β phases coexist at the nanoscopic level.

  16. Magnetic, transport and magnetoresistance behavior of Ni doped La{sub 0.67}Sr{sub 0.33}Mn{sub 1−x}Ni{sub x}O{sub 3} (0.00≤x≤0.09) system

    SciTech Connect

    Gupta, Maneesha; Kotnala, R.K.; Khan, Wasi; Azam, Ameer; Naqvi, A.H.

    2013-08-15

    The magnetic, electrical and magnetoresistance behavior of Ni doped La{sub 2/3}Sr{sub 1/3}Mn{sub 1−x}Ni{sub x}O{sub 3} (0.00≤x≤0.09) samples have been studied systematically. Rietveld analysis of XRD shows the formation of pure crystalline phase with rhombohedral symmetry. It has been found that with increasing Ni concentration, magnetization, resistivity, magnetoresistance (MR), Curie temperature (T{sub c}) and metal–insulator transition temperature of the samples changes drastically. Doping of Ni at Mn site shows an inverse behavior of %MR at 300 K and 77 K. Further study revealed that all samples show a low field magnetoresistance at low temperature (77 K) which found to increase with the increase of Ni doping. Further, X-ray photoelectron spectrum (XPS) confirms the ionic state of Ni to be Ni{sup 2+}. In the light of this study, we can say that Ni doped La{sub 0.67}Sr{sub 0.33}MnO{sub 3} can be synthesized with fine tuning of the dopant ion to bring down T{sub c} further for its application in Magnetic Hyperthermia. - Graphical abstract: The magnetic, electrical and magnetoresistance behavior of Nickel doped La{sub 2/3}Sr{sub 1/3}Mn{sub 1−x}Ni{sub x}O{sub 3} (0.00≤x≤0.09) samples have been studied systematically. Highlights: • Ni doped La{sub 2/3}Sr{sub 1/3}Mn{sub 1−x}Ni{sub x}O{sub 3} samples synthesized by solid state reaction route. • Studied the magnetic, electrical and magnetoresistance behavior of the samples. • T{sub c} of the samples decreases whereas resistivity increases with Ni doping. • Samples show excellent properties for magnetic Hyperthermia application.

  17. Dielectric and Magnetic Properties of Two-Phase Composite System: Mn-Zn or Ni-Zn ferrites in Dielectric Matrices

    NASA Astrophysics Data System (ADS)

    Salem, Mohamed M.; Morchenko, Alexander T.; Panina, Larissa V.; Kostishyn, Vladimir G.; Andreev, Valery G.; Bibikov, Sergey B.; Nikolaev, Alexey N.

    The development of novel electromagnetic materials for various applications largely depends on ferrite composites with optimal combination of constituent elements. The evaluation of their dielectric and magnetic properties is important in understanding the physical properties and potential for specific use. In this work, permittivity and permeability spectra of composite materials based on granulated soft magnetic Mn-Zn and Ni-Zn ferrites in paraffin, polyvinyl acetate glue and silicone sealant matrices were investigated for different ferrite phase concentrations and ferrite granule sizes. Mn-Zn ferrites are characterized by a relatively large conductivity and their composites show unusual behavior for the real part of the permittivity which can be essentially higher than the values observed for bulk ferrite samples, especially at low frequencies. The permittivity spectra also demonstrate a strong frequency dispersion which is not seen for bulk ceramic ferrites. Ni-Zn ferrite composites with very large electrical resistance do not show these effects and their microwave properties are consistent with the behavior of the constituent phases. The observed permittivity enhancement is explained on the basis of the conductive properties of the ferrite granules and the equivalent capacitance effect. The effective permittivity calculated from an equivalent capacitor circuit gives a qualitative agreement with the experimental data at lower frequencies. However, the origin of the frequency dispersion remains unclear. The developed composites have a potential for applications in broadband absorbers since they combine magnetic and electric losses along with a strong frequency dispersion of the permittivity.

  18. Electromagnetic properties of Fe53Ni47 and Fe53Ni47/Cu granular composite materials in the microwave range

    NASA Astrophysics Data System (ADS)

    Massango, Herieta; Tsutaoka, Takanori; Kasagi, Teruhiro

    2016-09-01

    The electromagnetic proprieties of Fe53Ni47 granular composite materials and Fe53Ni47/Cu hybrid granular composites have been studied by measuring the relative complex permeability and permittivity spectra as well as the ac electrical conductivity. In the Fe53Ni47 composite, the variation of the ac conductivity at 1 kHz with the particle volume content shows an insulator-metal transition at the percolation threshold at 61 vol% particle content. A negative permeability spectrum due to the magnetic resonance in Fe53Ni47 particles was observed in the 85 vol% composite. Meanwhile, the negative permittivity spectrum caused by the plasmoinc state of the percolated Fe53Ni47 particle clusters appears at 90 vol%. The Fe53Ni47/Cu hybrid composite containing 85 vol% of Fe53Ni47/Cu hybrid particle as filers shows the percolative metallic properties; the ac conductivity increases with increasing the Cu particle volume fraction in the Fe53Ni47/Cu particle system. The negative permittivity spectrum appears above the Cu particle volume fraction of 0.16; the double negative characteristic was observed at that of 0.20 and 0.24 hybrid composites in the frequency range from 300 MHz to 1.8 GHz in the absence of the external magnetic field.

  19. Electromagnetic properties of Fe53Ni47 and Fe53Ni47/Cu granular composite materials in the microwave range

    NASA Astrophysics Data System (ADS)

    Massango, Herieta; Tsutaoka, Takanori; Kasagi, Teruhiro

    2016-09-01

    The electromagnetic proprieties of Fe53Ni47 granular composite materials and Fe53Ni47/Cu hybrid granular composites have been studied by measuring the relative complex permeability and permittivity spectra as well as the ac electrical conductivity. In the Fe53Ni47 composite, the variation of the ac conductivity at 1 kHz with the particle volume content shows an insulator–metal transition at the percolation threshold at 61 vol% particle content. A negative permeability spectrum due to the magnetic resonance in Fe53Ni47 particles was observed in the 85 vol% composite. Meanwhile, the negative permittivity spectrum caused by the plasmoinc state of the percolated Fe53Ni47 particle clusters appears at 90 vol%. The Fe53Ni47/Cu hybrid composite containing 85 vol% of Fe53Ni47/Cu hybrid particle as filers shows the percolative metallic properties; the ac conductivity increases with increasing the Cu particle volume fraction in the Fe53Ni47/Cu particle system. The negative permittivity spectrum appears above the Cu particle volume fraction of 0.16; the double negative characteristic was observed at that of 0.20 and 0.24 hybrid composites in the frequency range from 300 MHz to 1.8 GHz in the absence of the external magnetic field.

  20. Fabrication and optical properties of a self-organized ferromagnetic Ni/Si-nanocomposite

    NASA Astrophysics Data System (ADS)

    Rumpf, K.; Granitzer, P.; Pölt, P.; Reichmann, A.; Krenn, H.

    2007-09-01

    A mesoscopic composite consisting of porous silicon (PS) and two kinds of Ni precipitations is investigated by FTIR-spectroscopy and SQUID-magnetometry, respectively. The electrochemically produced PS/Ni-composite system consists of wires and non-spherical particles with a diameter around 60 nm and a one-dimensional extension of a few tens of micrometers, which imposes a significant out of plane magnetic anisotropy. Transmission in the mid-infrared is found near 10% for both, bare PS and the Ni-filled system. The transmission spectra of unprocessed Si and PS are similar, apart from the Si-H x vibration modes due to the PS template. In the presence of Ni a broad absorbance structure at wavenumbers of 3500 cm -1 is found, caused by NiO x or Schottky barrier absorption across the Si/Ni-interface between Ni nanoparticles/wires and the silicon skeleton.

  1. Truncated octahedral LiNi0.5Mn1.5O4 cathode material for ultralong-life lithium-ion battery: Positive (100) surfaces in high-voltage spinel system

    NASA Astrophysics Data System (ADS)

    Liu, Haidong; Kloepsch, Richard; Wang, Jun; Winter, Martin; Li, Jie

    2015-12-01

    So far, it has not yet reached an agreement that (111) surfaces or (100) surfaces are more positive to electrochemical performance in the spinel system. Herein, we present the synthesis of regular truncated octahedral high-voltage spinel LiNi0.5Mn1.5O4 single crystals with preferred growth of (100) surfaces, which incredibly exhibit the best long-term cycling stability compared with the state-of-art spinel material. The capacity retention is about 90% after 2000 cycles at 1 C. The extraordinary performance is mostly attributed to the highly regular truncated octahedral microstructure with large portions of stable (100) facets, which can stabilize the spinel structure to effectively suppress the side reactions with the electrolyte at high operating voltage and are also orientated to support Li+ transport kinetics. Therefore, our work further promotes the practical application of LiNi0.5Mn1.5O4 cathode material in next generation Lithium-ion batteries with high energy density and power performance.

  2. Magnetic properties of Ni/NiO nanocomposites synthesized by one step solution combustion method

    NASA Astrophysics Data System (ADS)

    Ganeshchandra Prabhu, V.; Shajira, P. S.; Lakshmi, N.; Junaid Bushiri, M.

    2015-12-01

    Ni/NiO nanocomposites were synthesized using solution combustion method and characterized with X-ray diffraction (XRD), transmission electron microscopy (TEM), selected area electron diffraction (SAED), scanning electron microscopy (SEM), energy dispersive X-ray spectroscopy (EDAX) and carbon, hydrogen, nitrogen (CHN) analyser. The Ni or NiO content in Ni/NiO nanocomposites vary with the quantity of HNO3 used for the synthesis. Magnetic coercivity (Hc) of Ni/NiO nanocomposites is found to be 413 Oe which can be used in magnetic applications. A feeble exchange bias of 7 Oe is seen from the NiO rich Ni/NiO.

  3. Elastic scattering measurement for the system 17O + 58Ni at Coulomb barrier energies with silicon strip detectors exploiting ASIC electronics

    NASA Astrophysics Data System (ADS)

    Signorini, C.; Mazzocco, M.; Molini, P.; Pierroutsakou, D.; Boiano, C.; Manea, C.; Strano, E.; Torresi, D.; Di Meo, P.; Nicoletto, M.; Boiano, A.; Glodariu, T.; Grebosz, J.; Guglielmetti, A.; La Commara, M.; Parascandolo, C.; Parascandolo, L.; Sandoli, M.; Soramel, F.; Stroe, L.; Toniolo, N.; Veronese, F.

    2013-03-01

    The quasi elastic scattering of a 17O projectile from a 58Ni target has been studied at beam energies ranging from 42.5 to 55.0 MeV in 2.5 MeV steps. The total reaction cross sections were derived from the measured angular distributions by using an optical model fit within the coupled-channel code FRESCO. These cross sections are very similar to those measured for 17F (loosely bound by 0.6 MeV), mirror nucleus of 17O (tightly bound by 4.14 MeV). This outcome points out that, in this energy range, the small binding energy of the 17F valence proton has negligible influence onto the reactivity of such a loosely bound projectile, contrary to simple expectations, and to what observed for other loosely bound nuclei. The reaction dynamics seems to be influenced mainly by the Coulomb interaction which is similar for both mirror projectiles.

  4. Exchange bias of CoO1-δ/(NiFe,Fe) system with blocking temperature beyond Néel temperature of bulk CoO

    NASA Astrophysics Data System (ADS)

    Ding, S. L.; Wu, R.; Fu, J. B.; Wen, X.; Du, H. L.; Liu, S. Q.; Han, J. Z.; Yang, Y. C.; Wang, C. S.; Zhou, D.; Yang, J. B.

    2015-10-01

    The exchange bias effects in pulsed laser deposited CoO1-δ/(NiFe,Fe) bilayers were investigated. An anomalously high blocking temperature (TB) of 325 K was obtained for the as-deposited CoO1-δ/ferromagnet bilayers, which is 33 K higher than the Néel temperature of the bulk CoO (TN = 292 K). The amount of oxygen vacancies δ in the CoO1-δ film can be controlled by a post-annealing treatment in the O2 atmosphere. The TB of the CoO1-δ/ferromagnet bilayers increases with an increasing δ from δ = 0 to δ = 0.16. Our results indicate that the high TB of CoO1-δ/ferromagnet bilayers originates from the enhancement of the magnetic interaction in the CoO1-δ layer owing to O2- vacancies.

  5. Field-dependent magneto-optical Kerr effect spectroscopy applied to the magnetic component diagnosis of a rubrene/Ni system.

    PubMed

    Li, Wen; Fronk, Michael; Albrecht, Manfred; Franke, Mechthild; Zahn, Dietrich R T; Salvan, Georgeta

    2014-07-28

    Polar magneto-optical Kerr effect (MOKE) spectroscopy in the energy range from 1.75 eV to 5 eV at different magnetic field strength was applied to study Ni nanostructures formed on rubrene nanoislands. The magnetic hysteresis curves measured by MOKE change the shape depending on the photon energy and therefore deviate from those measured by superconducting quantum interference device (SQUID) magnetometry. Similar optical effects were previously observed in inorganic heterostructures. Our observations show that it correlates to the change in lineshape of the MOKE rotation and ellipticity spectra as a function of magnetic field strength. We show that this spectral dependence on magnetic field can be exploited to separate the contributions of two magnetic components to the magneto-optical spectra and hysteresis. The proposed model does not require the a priori knowledge of the (magneto-)optical constants of the heterostructure and its components. PMID:25089464

  6. Fusion reactions of Ni,6458+124Sn

    NASA Astrophysics Data System (ADS)

    Jiang, C. L.; Stefanini, A. M.; Esbensen, H.; Rehm, K. E.; Almaraz-Calderon, S.; Avila, M. L.; Back, B. B.; Bourgin, D.; Corradi, L.; Courtin, S.; Fioretto, E.; Galtarossa, F.; Goasduff, A.; Haas, F.; Mazzocco, M. M.; Montanari, D.; Montagnoli, G.; Mijatovic, T.; Sagaidak, R.; Santiago-Gonzalez, D.; Scarlassara, F.; Strano, E. E.; Szilner, S.

    2015-04-01

    Measurements of fusion excitation functions of 58Ni+124Sn and 64Ni+124Sn are extended towards lower energy to cross sections of 1 μ b and are compared to detailed coupled-channels calculations. The calculations clearly show the importance of including transfer reactions in a coupled-channels treatment for such heavy systems. This result is different from the conclusion made in a previous article which claimed that the influence of transfer on fusion is not important for fusion reactions of Ni +Sn . In the energy region studied in this experiment no indication of fusion hindrance has been observed, which is consistent with a systematic study of this behavior.

  7. Computer Simulations of Martensitic Transformations in FeNi and NiAl alloys

    NASA Astrophysics Data System (ADS)

    Meyer, Ralf; Kadau, Kai; Entel, Peter

    1998-03-01

    We have studied the martensitic transformation in FeNi and NiAl alloys by molecular dynamics simulations. The simulations have been done with the help of embedded-atom method potentials which made it possible for us to run simulations with up to 250000 atoms. Our results show the formation of a microstructure during the structural phase transition which possesses a characteristic length-scale leading to significant finite-size effects. Moreover we present phonon spectra and free energy curves obtained from the molecular dynamics simulations of smaller systems.

  8. The first principle study of Ni{sub 2}ScGa and Ni{sub 2}TiGa

    SciTech Connect

    Özduran, Mustafa; Turgut, Kemal; Arikan, Nihat; İyigör, Ahmet; Candan, Abdullah

    2014-10-06

    We computed the electronic structure, elastic moduli, vibrational properties, and Ni{sub 2}TiGa and Ni{sub 2}ScGa alloys in the cubic L2{sub 1} structure. The obtained equilibrium lattice constants of these alloys are in good agreement with available data. In cubic systems, there are three independent elastic constants, namely C{sub 11}, C{sub 12} and C{sub 44}. We calculated elastic constants in L2{sub 1} structure for Ni{sub 2}TiGa and Ni{sub 2}ScGa using the energy-strain method. The electronic band structure, total and partial density of states for these alloys were investigated within density functional theory using the plane-wave pseudopotential method implemented in Quantum-Espresso program package. From band structure, total and projected density of states, we observed metallic characters of these compounds. The electronic calculation indicate that the predominant contributions of the density of states at Fermi level come from the Ni 3d states and Sc 3d states for Ni{sub 2}TiGa, Ni 3d states and Sc 3d states for Ni{sub 2}ScGa. The computed density of states at Fermi energy are 2.22 states/eV Cell for Ni{sub 2}TiGa, 0.76 states/eV Cell for Ni{sub 2}ScGa. The vibrational properties were obtained using a linear response in the framework at the density functional perturbation theory. For the alloys, the results show that the L2{sub 1} phase is unstable since the phonon calculations have imagine modes.

  9. Diffusion of Ni, Ga, and As in the surface layer of GaAs and characteristics of the Ni/GaAs contact

    SciTech Connect

    Uskov, V.A.; Fedotov, A.B.; Erofeeva, E.A.; Rodionov, A.I.; Dzhumakulov, D.T.

    1987-07-01

    The authors investigate the low-temperature codiffusion of Ni, Ga, and As in the surface layer of gallium arsenide and study its effect on the current-voltage characteristics of a Ni/GaAs rectifier contact. The concentration distribution of atoms in the function layer of a Ni-GaAs system was investigated by the methods of layerwise radiometric and neutron-activation analyses. It was found that interdiffusion of components takes place in the Ni-GaAs system in an elastic stress field, generated by the differences in the lattice parameters and thermal-expansion coefficients of Ni, GaAs, and the intermetallic compound which form. The form and parameters of the current-voltage characteristics of a Ni/GaAs contact are determined by the phase composition and the structure of the junction layer.

  10. Physisorption mechanism in graphene/noble metal (111)/Ni(111) heterostructures: An ab-initio study

    NASA Astrophysics Data System (ADS)

    Moaddeli, Mohammad; Salehi, Hamdollah; Amiri, Peiman

    2016-08-01

    The 3D stacking of various 2D systems is an intelligent way of aiming to overcome the limitations usually faced by 2D systems. We study the adsorption of graphene on noble metal monolayers upon Ni (111) substrate, using density functional theory. The bonding mechanism at noble metal-graphene and noble metal-Ni interfaces is found to be physisorption and chemisorption, respectively. The bonding of graphene to Cu, Ag, and Au (111) monolayers is so weak that the conical shape of the Dirac point is preserved. The doping effects of a substrate lead to a small opening gap for gr/Cu/Ni and gr/Ag/Ni systems. These predictions are in agreement with experimental results. The intercalation of a noble metal monolayer between graphene and Ni (111) substrate changes the magnetic response from Ni surface and causes the formation of a ferrimagnetic system.

  11. Structures and energetics of Ni24-Ni55 clusters

    NASA Astrophysics Data System (ADS)

    Wetzel, Thiele L.; DePristo, Andrew E.

    1996-07-01

    We predict stable geometrical structures and interaction energies of Ni clusters using non self-consistent electron density functional based corrected effective medium (CEM) and MD/MC-CEM methods. A plot of the reaction energies for the atomic ejection process, NiN+1→NiN+Ni, for Ni24-Ni55 displays a number of informative characteristics: (a) peaks and valleys represent internal structural rearrangement in which the number of core atoms increases by at least one and; (b) a plateau at N=50-54 is associated with the closing of the second MacKay icosahedron at Ni55. The lowest energy structures of NiN clusters for N=24-55 are dissimilar generally to those of both rare gas clusters and fragments of the bulk crystal lattice except where a stable icosahedral or bulk core is present. The growth scheme for N<50 is determined by the stability and structure of the changing number of core atoms. By contrast, the growth scheme for 51≤N≤55 is determined by the addition of surface atoms to a very stable and invariant 13-atom icosahedral core. The theoretical predictions are compared to available model growth schemes and experimental data.

  12. Double dumbbell shaped AgNi alloy by pulsed electrodeposition

    SciTech Connect

    Dhanapal, K.; Vasumathi, M.; Santhi, Kalavathy; Narayanan, V. Stephen, A.

    2014-01-28

    Silver-Nickel is the well-known thermally immiscible system that makes them quite complex for the formation of alloy. This kind of alloy can be attained from electrodeposition method. In the present work, AgNi alloy was synthesized by pulsed electrodeposition in a single bath two electrode system with the use of anodic alumina membrane. The prepared AgNi alloy and pure Ag were characterized with X-ray Diffraction (XRD) for structural confirmation, Scanning Electron Microscopy (SEM) for morphological, and magnetic properties by Vibrating Sample Magnetometer, respectively. The X-ray Diffraction study shows the formation of cubic structure for pure Ag. SEM analysis reveals the double dumbbell morphology for AgNi alloy and spherically agglomeration for pure silver. Hysteresis behaviour from VSM measurement indicates that the AgNi alloy have good ferro-magnetic properties.

  13. Conductive microemulsions for template CoNi electrodeposition.

    PubMed

    Serrà, Albert; Gómez, Elvira; Calderó, Gabriela; Esquena, Jordi; Solans, Conxita; Vallés, Elisa

    2013-09-21

    Microemulsions have been revealed as feasible templates to grow magnetic nanostructures using an electrodeposition method. Reducing agents are not required and the applied potential has been used as driving force of the nanostructure growth. A systematic study of conductive microemulsion systems to allow the CoNi electrodeposition process has been performed. Different surfactants and organic components have been tested to form microemulsions with a CoNi electrolytic bath as an aqueous component in order to define the microemulsions showing enough conductivity to perform an electrodeposition process from the aqueous component. By using microemulsions of the aqueous electrolyte solution-Triton X-100-diisopropyl adipate system, CoNi electrodeposition has been achieved, the structure of the deposits being dependent on the composition and structure of the microemulsion, which can act as a soft-template to obtain different discontinuous deposits. The magnetic properties of the CoNi deposits vary with their structure.

  14. Solid-state synthesis and phase transformations in Ni/Fe films: Structural and magnetic studies

    NASA Astrophysics Data System (ADS)

    Myagkov, V. G.; Zhigalov, V. C.; Bykova, L. E.; Bondarenko, G. N.

    2006-10-01

    We have used X-ray diffraction, volume magnetocrystalline anisotropy constant and resistance measurements to study solid-state synthesis in Ni(0 0 1)/Fe(0 0 1), Ni/Fe(0 0 1) and Ni/Fe thin films with the atomic ratio between Fe and Ni of 1:1 (1Fe:1Ni), and 3:1 (3Fe:1Ni). We have found that the formation of Ni 3Fe and NiFe phases in the 1Fe:1Ni films takes place at temperatures ˜620 and ˜720 K, correspondingly. In the case of the 3Fe:1Ni films the solid-state synthesis starts with Ni 3Fe and NiFe phase formation at the same temperatures as for the 1Fe:1Ni films. The increasing of annealing temperature above 820 K leads to the nucleation of a paramagnetic γpar phase at the FeNi/Fe interface. The final products of solid-state synthesis in the Ni(0 0 1)/Fe(0 0 1) thin films are crystallites which consist of the epitaxially intergrown NiFe and γpar phases according to the [1 0 0](0 0 1)NiFe||[1 0 0](0 0 1) γpar orientation relationship. The crystalline perfection and epitaxial growth of the (NiFe+ γpar) crystallites on the MgO(0 0 1) surface allow to distinguish (0 0 2) γpar and (0 0 2)NiFe X-ray peaks (the cell parameters are: a( γpar)=0.3600±0.0005 nm and a(NiFe)=0.3578±0.0005 nm, correspondingly). At low temperatures the paramagnetic γpar phase undergoes the martensite γ→α' phase transition which can be hindered by thermal and epitaxial strains and epitaxial clamping with a MgO substrate. On the basis of the studies of the thin-film solid-state synthesis we predict the existence of two novel structural phase transformations at the temperatures of about 720 and 820 K for alloys of the invar region of the Fe-Ni system.

  15. Homogeneous Electrocatalytic Reduction of Carbon Dioxide to Carbon Monoxide by Ni(cyclam)

    NASA Astrophysics Data System (ADS)

    Froehlich, Jesse Dan

    The homogeneous electrochemical reduction of CO2 by the molecular catalyst [Ni(cyclam)]2+ was studied by electrochemistry and infrared spectroelectrochemistry. This catalyst has been previously shown to have increased CO2 reduction activity when adsorbed on a mercury electrode. The homogeneous reactivity, without a mercury electrode, was often ignored in the literature. Ni(cyclam) was found to efficiently and selectively produce CO at moderate overpotentials in both aqueous and mixed organic solvent systems in a homogenous fashion at an inert glassy carbon electrode. Methylated analogs of Ni(cyclam) were also studied and observed to have more positive reduction potentials and attenuated CO2 reduction activity. The electrochemical kinetics were probed by varying CO2 substrate and proton concentrations. Products of CO2 reduction are observed in infrared spectra obtained from spectroelectrochemical experiments. The two major species observed were a Ni(I) carbonyl, [Ni(cyclam)(CO)]+, and a Ni(II) coordinated bicarbonate, [Ni(cyclam)(CO2OH)] +. The rate-limiting step during electrocatalysis was determined to be CO loss from the deactivated species, [Ni(cyclam)(CO)]+, to produce the active catalyst, [Ni(cyclam)]+. Another macrocyclic complex, [Ni(TMC)]+, was deployed as a CO scavenger in order to inhibit the deactivation of [Ni(cyclam)] + by CO. Addition of the CO scavenger was shown to dramatically increase the catalytic current observed for CO2 reduction by [Ni(cyclam)] +. Evidence for the [Ni(TMC)]+ acting as a CO scavenger includes the observation of [Ni(TMC)(CO)]+ by IR. Density functional theory calculations, probing the optimized geometry of the [Ni(cyclam)(CO)] + species, are also presented. These findings have implications on the increased activity for CO2 reduction when [Ni(cyclam)] + is adsorbed on a mercury electrode. The [Ni(cyclam)(CO)] + structure has significant distortion of the Ni center out of the plane of the cyclam nitrogens. This distortion

  16. Ni-cd Battery Life Expectancy in Geosynchronous Orbit

    NASA Technical Reports Server (NTRS)

    Broderick, R. J.

    1984-01-01

    The feasibility of using nickel cadmium batteries as an alternate if flight qualified NiH2 batteries are not available is explored. Battery life expectancy data being a key element of power system design, an attempt is made to review the literature, life test data and in orbit performance data to develop an up to date estimate of life expectancy for NiCd batteries in a geosynchronous orbit.

  17. Dilute NiPt alloy interactions with Si

    NASA Astrophysics Data System (ADS)

    Corni, F.; Grignaffini Gregorio, B.; Ottaviani, G.; Queirolo, G.; Follegot, J. P.

    1993-11-01

    The reaction between a dilute Ni 95Pt 5 alloy and <111>Si has been investigated as a function of the annealing temperature and time, and the film thickness. Contrary to the concentrate alloys the first phase formed is Ni 2Si and the growth kinetics in the initial steps are similar to the case of pure Ni. Pt segregates in the alloy and its presence slows down the silicide growth rate suggesting that a new mechanism, namely the release of Ni from the alloy, is competing with the diffusion process in the silicide. In all the cases here considered NiSi starts to form only when all the Ni is reacted, indicating that the Pt never reaches high enough concentrations to inhibit the Ni 2Si growth. The further evolution of the system is similar to the ones reported for bilayers and non-dilute alloys. The I-V characteristics measured after annealing give a barrier height of 0.70 ± 0.01 eV.

  18. [Radioactivity of phosphorus implanted TiNi alloy].

    PubMed

    Zhao, Xingke; Cai, Wei; Zhao, Liancheng

    2003-09-01

    Exposed to neutron flow, the phosphorus implanted TiNi alloy gets radioactive. This radioactive material is used in vascular stent for prevention and cure of restenosis. Phosphorus implantation is carried out in a plasma immerged ion implantation system, and the dose of phosphorus implantation is in the range of 2-10 x 10(17) cm-2. After ion implantation, the alloy is exposed to the slow neutron flow in a nuclear reactor, the dose of the slow neutron is 1.39-5.88 x 10(19) n/cm2. The radioactivity of the TiNi alloy was measured by liquid scintillation spectrometry and radio-chromic-film dosimetry. The result shows that whether the phosphorus is implanted or not, the TiNi alloy comes to be radioactive after exposure to neutron flow. Just after neutron irradiation, the radiation dose of phosphorus implanted TiNi alloy is about one hundred times higher than that of un-phosphorus implanted TiNi alloy. The radiation difference between phosphorus and un-phosphorus implanted alloy decreases as time elapses. Within three months after neutron irradiation, the average half-decay period of phosphorus implanted TiNi alloy is about 62 days. The radiation ray penetration of phosphorus implanted TiNi alloy is deeper than that of pure 32P; this is of benefit to making radiation uniformity between stent struts and reducing radiation grads beyond the edge of stent.

  19. Mesoscale assembly of NiO nanosheets into spheres

    SciTech Connect

    Zhang Meng; Yan Guojin; Hou Yonggai; Wang Chunhua

    2009-05-15

    NiO solid/hollow spheres with diameters about 100 nm have been successfully synthesized through thermal decomposition of nickel acetate in ethylene glycol at 200 deg. C. These spheres are composed of nanosheets about 3-5 nm thick. Introducing poly(vinyl pyrrolidone) (PVP) surfactant to reaction system can effectively control the products' morphology. By adjusting the quantity of PVP, we accomplish surface areas-tunable NiO assembled spheres from {approx}70 to {approx}200 m{sup 2} g{sup -1}. Electrochemical tests show that NiO hollow spheres deliver a large discharge capacity of 823 mA h g{sup -1}. Furthermore, these hollow spheres also display a slow capacity-fading rate. A series of contrastive experiments demonstrate that the surface area of NiO assembled spheres has a noticeable influence on their discharge capacity. - Graphical abstract: The mesoscale assembly of NiO nanosheets into spheres have been achieved by a solvothermal method. N{sub 2} adsorption/desorption isotherms show the S{sub BET} of NiO is tunable. NiO spheres show large discharge capacity and slow capacity-fading rate.

  20. Features of phase and structure formation in high-entropy alloys of the AlCrFeCoNiCu x system ( x = 0, 0.5, 1.0, 2.0, 3.0)

    NASA Astrophysics Data System (ADS)

    Krapivka, N. A.; Firstov, S. A.; Karpets, M. V.; Myslivchenko, A. N.; Gorban', V. F.

    2015-05-01

    Alloys of the AlCrFeCoNiCu x system ( x = 0, 0.5, 1.0, 2.0, 3.0) were smelted by argon-arc smelting in pure argon. The phase composition and structure of fabricated alloys are investigated and their mechanical properties are determined. The results showed that an increase in the amount of copper in alloys leads to a change in the phase composition from single phase (bcc) to three phase (bcc + fcc1 + fcc2), which is accompanied by the structural change from coarse-grain polygonal structure to complex dendritic structure (primary dendrites (DR) + secondary dendrites (SDR) + interdendrite phase (ID)). The region of electron concentrations of alloys, in which bcc and fcc phases are present simultaneously, is determined. The limiting electron concentration of stability of the bcc lattice is found experimentally. Microhardness is measured and Young moduli of alloys over the entire range of varying the copper concentration are determined.

  1. Aqueous phase reforming of glycerol over Ni-based catalysts for hydrogen production.

    PubMed

    Cho, Su Hyun; Moon, Dong Ju

    2011-08-01

    Aqueous phase reforming of glycerol over Ni-based catalysts for hydrogen production was carried out at 225 degrees C, 23 bar and LHSV = 4 h(-1). The Ni-based catalyst was prepared by an incipient wetness impregnation method. The catalysts before and after the reaction were characterized by N2 physisorption, CO chemisorption, XRD, TPR, SEM and TEM techniques. It was found that Ni(20 wt%)-Co(3 wt%)/gamma-Al2O3 catalyst showed higher glycerol conversion and hydrogen selectivity than Ni(20 wt%)/gamma-Al2O3 catalyst. There are no major changes in Ni particles after the reaction over Ni-Co/gamma-Al2O3 catalyst. The results suggest that the Ni-Co/gamma-Al2O3 catalyst can be applied to the hydrogen production system using APR of glycerol. PMID:22103184

  2. Thermoelectric properties of Co(x)Ni(4-x)Sb(12-y)Sn(y) ternary skutterudites

    NASA Technical Reports Server (NTRS)

    Mackey, Jon A.; Dynys, Frederick W.; Sehirlioglu, Alp

    2014-01-01

    Thermoelectric materials based on the skutterudite crystal structure have demonstrated enhanced performance (ZT greater than 1), along with good thermal stability and favorable mechanical properties. Binary skutterudites, with single and multiple fillers, have been intensively studied in recent years. Compared to binary skutterudites, the ternary systems have received less attention, e.g. Ni4Sb8Sn4. Ternary skutterudites are isoelectronic variants of binary skutterudites; cation substitutions appear to be isostructural to their binary analogues. In general, ternary skutterudites exhibit lower thermal conductivity. Ternary systems of Ni4Bi8Ge4, Ni4Sb8Ge4, and Ni4Sb8Sn4 were investigated using combined solidification and sintering steps. Skutterudite formation was not achieved in the Ni4Bi8Ge4 and Ni4Sb8Ge4 systems; skutterudite formation occurred in Ni4Sb8Sn4 system. P-type material was achieved by Co substitution for Ni. Thermoelectric properties were measured from 298 K to 673 K for Ni4Sb8Sn4, Ni4 Sb7Sn5 and Co2Ni2Sb7Sn5. N-type Ni4Sb8Sn4 exhibit the highest figure of merit of 0.1 at 523 K.

  3. Fabrication of Ni-Ti-O nanotube arrays by anodization of NiTi alloy and their potential applications

    PubMed Central

    Hang, Ruiqiang; Liu, Yanlian; Zhao, Lingzhou; Gao, Ang; Bai, Long; Huang, Xiaobo; Zhang, Xiangyu; Tang, Bin; Chu, Paul K.

    2014-01-01

    Nickel-titanium-oxide (Ni-Ti-O) nanotube arrays (NTAs) prepared on nearly equiatomic NiTi alloy shall have broad application potential such as for energy storage and biomedicine, but their precise structure control is a great challenge because of the high content of alloying element of Ni, a non-valve metal that cannot form a compact electronic insulating passive layer when anodized. In the present work, we systemically investigated the influence of various anodization parameters on the formation and structure of Ni-Ti-O NTAs and their potential applications. Our results show that well controlled NTAs can be fabricated during relatively wide ranges of the anodization voltage (5–90 V), electrolyte temperature (10–50°C) and electrolyte NH4F content (0.025–0.8 wt%) but within a narrow window of the electrolyte H2O content (0.0–1.0 vol%). Through modulating these parameters, the Ni-Ti-O NTAs with different diameter (15–70 nm) and length (45–1320 nm) can be produced in a controlled manner. Regarding potential applications, the Ni-Ti-O NTAs may be used as electrodes for electrochemical energy storage and non-enzymic glucose detection, and may constitute nanoscaled biofunctional coating to improve the biological performance of NiTi based biomedical implants. PMID:25520180

  4. Fabrication of Ni-Ti-O nanotube arrays by anodization of NiTi alloy and their potential applications

    NASA Astrophysics Data System (ADS)

    Hang, Ruiqiang; Liu, Yanlian; Zhao, Lingzhou; Gao, Ang; Bai, Long; Huang, Xiaobo; Zhang, Xiangyu; Tang, Bin; Chu, Paul K.

    2014-12-01

    Nickel-titanium-oxide (Ni-Ti-O) nanotube arrays (NTAs) prepared on nearly equiatomic NiTi alloy shall have broad application potential such as for energy storage and biomedicine, but their precise structure control is a great challenge because of the high content of alloying element of Ni, a non-valve metal that cannot form a compact electronic insulating passive layer when anodized. In the present work, we systemically investigated the influence of various anodization parameters on the formation and structure of Ni-Ti-O NTAs and their potential applications. Our results show that well controlled NTAs can be fabricated during relatively wide ranges of the anodization voltage (5-90 V), electrolyte temperature (10-50°C) and electrolyte NH4F content (0.025-0.8 wt%) but within a narrow window of the electrolyte H2O content (0.0-1.0 vol%). Through modulating these parameters, the Ni-Ti-O NTAs with different diameter (15-70 nm) and length (45-1320 nm) can be produced in a controlled manner. Regarding potential applications, the Ni-Ti-O NTAs may be used as electrodes for electrochemical energy storage and non-enzymic glucose detection, and may constitute nanoscaled biofunctional coating to improve the biological performance of NiTi based biomedical implants.

  5. Infrared Absorption Spectra of Jahn-Teller Systems: Application to the Transition-Metal Trifluorides MnF3 and NiF3.

    PubMed

    Mondal, Padmabati; Domcke, Wolfgang

    2014-05-14

    The theory for the calculation of vibronic absorption spectra within a Jahn-Teller (JT) active electronic state from first principles has been developed. The infrared absorption spectra of the (5)E' ground state, the low-lying (5)E″ excited state of MnF3, and the (4)E' state of NiF3 have been computed and analyzed. Dipole moment derivatives have been determined by a linear-plus-quadratic expansion of nuclear dipole moment functions in the JT-active coordinates. Electronic transition dipole moments have been taken into account in the Condon approximation in the diabatic representation. The initial and final vibronic states have been expanded in a product of diabatic electronic states and vibrational basis functions. The effect of spin-orbit coupling on the vibronic infrared spectra of these molecules in their JT-active electronic states has been investigated, by employing the Breit-Pauli spin-orbit operator. The effect of temperature on the vibronic infrared spectra has also been explored. These results represent the first theoretical study of vibronic infrared spectra of JT-active states in transition metal compounds.

  6. 57Fe Mössbauer and electrical studies of the (NiO)-(Cr2O3) x-(Fe2O3)2-x system

    NASA Astrophysics Data System (ADS)

    Fayek, M. K.; Ata-Allah, S. S.

    2003-08-01

    From 57Fe Mössbauer measurements carried out on the spinel ferrite under study, the ratio of the integrated intensities of 57Fe A- and B-site subspectra can be evaluated. The composition of the ferrite has been established as (Fe3+)[Ni2+Cr3+xFe3+1-x] for 0.0 ≤ x ≤ 0.6. The composition dependence of the Mössbauer hyperfine parameters (center shift and quadrupole splitting) displays no features in this composition range that would result from a qualitative change in electronic structure. The ac conductivity measurements re-veal a semiconducting behavior with a transition in the conductivity versus temperature curve. The transi-tion temperature is found to decrease linearly with increasing Cr concentration x. The dielectric parameters (and loss (tan δ)) of the studied samples exhibit dipolar relaxation effects. The results of conductivity and dielectric parameters are explained in the light of hopping conduction at the octahedral B sites.

  7. Microstructural Investigations On Ni-Ta-Al Ternary Alloys

    SciTech Connect

    Negache, M.; Souami, N.

    2010-01-05

    The Ni-Al-Ta ternary alloys in the Ni-rich part present complex microstructures. They are composed of multiple phases that are formed according to the nominal composition of the alloy, primary Ni(gamma), Ni{sub 3}Al(gamma'), Ni{sub 6}AlTa(tau{sub 3}), Ni{sub 3}Ta(delta) or in equilibrium: two solid phases (gamma'-tau{sub 3}), (tau{sub 3}-delta), (tau{sub 3}-gamma), (gamma-delta) or three solid phases (gamma'-tau{sub 3}-delta). The nature and the volume fraction of these phases give these alloys very interesting properties at high temperature, and this makes them attractive for specific applications. We have developed a series of ternary alloys in electric arc furnace, determining their solidification sequences using Differential Thermal Analysis (DTA), characterized by SEM-EDS, X-ray diffraction and by a microhardness tests. The follow-up results made it possible to make a correlation between the nature of the formed phases and their solidifying way into the Ni{sub 75}Al{sub x}Ta{sub y} (x+y = 25at.%) system, which are varied and complex. In addition to the solid solution Ni (gamma), the formed intermetallics compounds (gamma', tau{sub 3} and delta) has been identified and correlated with a complex balance between phases.We noticed that the hardness increases with the tantalum which has a hardening effect and though the compound Ni{sub 3}Ta(delta) is the hardest. The below results provide a better understanding of the complex microstructure of these alloys.

  8. The Origin of Ferromagnetism in Ni-DOPED ZnO and SnO2

    NASA Astrophysics Data System (ADS)

    Felner, I.; Herber, R.; Acharya, Somobrata; Awana, V. P. S.

    We present a detailed study of the ferromagnetism in nano-Ni-doped SnO2 and ZnO. It is shown that the ferromagnetic behavior is not an intrinsic property of the systems but rather associated with the presence of nNi particles in both matrices. The ferromagnetic transition of all Ni-doped samples is at 631(2) K, the same as the TC value for bulk Ni and nano-Ni powder. The saturation moments of the nano-Ni-doped samples scale with the Ni concentration and are much lower than that of pure Ni. This is due to the large surface area of nano-Ni particles which are partially oxidized due to nano-NiO. 119Sn Mössbauer spectroscopy studies on Sn0.96Ni0.04O2 do not show any transferred hyperfine field on the Sn nuclei, confirming that the magnetic properties stem from a different phase.

  9. A New Perspective on El Niño Diversity and Its Genesis

    NASA Astrophysics Data System (ADS)

    Chen, D.

    2015-12-01

    El Niño is by far the most energetic and influential interannual fluctuation in the Earth's climate system. Despite the tremendous progress in the theory, observation and prediction of El Niño over the past three decades, there is still considerable debate on the classification of El Niño diversity and on the genesis of such diversity. This uncertainty renders El Niño prediction a continuously challenging task. Here we provide a unified perspective on El Niño diversity as well as its causes, based on a fuzzy clustering analysis and model experiments. Specifically, the interannual variability of the tropical Pacific sea surface temperature can be generally classified into three warm patterns and one cold pattern, which together constitute a canonical El Niño/La Niña cycle and its different flavors. Whereas the genesis of the canonical cycle can be readily explained by classic theories, the asymmetry, irregularity and extremes of El Niño may well result from westerly wind bursts, a type of state-dependent atmospheric perturbation in the equatorial Pacific, which strongly affects El Niño but not La Niña due to its unidirectional nature. This suggests that properly accounting for the interplay between the canonical cycle and westerly wind bursts may improve El Niño prediction.

  10. 90° magnetic coupling in a NiFe/FeMn/biased NiFe multilayer spin valve component investigated by polarized neutron reflectometry

    SciTech Connect

    Callori, S. J. Bertinshaw, J.; Cortie, D. L.; Cai, J. W. Zhu, T.; Le Brun, A. P.; Klose, F.

    2014-07-21

    We have observed 90° magnetic coupling in a NiFe/FeMn/biased NiFe multilayer system using polarized neutron reflectometry. Magnetometry results show magnetic switching for both the biased and free NiFe layers, the latter of which reverses at low applied fields. As these measurements are only capable of providing information about the total magnetization within a sample, polarized neutron reflectometry was used to investigate the reversal behavior of the NiFe layers individually. Both the non-spin-flip and spin-flip neutron reflectometry signals were tracked around the free NiFe layer hysteresis loop and were used to detail the evolution of the magnetization during reversal. At low magnetic fields near the free NiFe coercive field, a large spin-flip signal was observed, indicating magnetization aligned perpendicular to both the applied field and pinned layer.

  11. Graphene on Ni(111): Electronic Corrugation and Dynamics from Helium Atom Scattering

    PubMed Central

    2015-01-01

    Using helium atom scattering, we have studied the structure and dynamics of a graphene layer prepared in situ on a Ni(111) surface. Graphene/Ni(111) exhibits a helium reflectivity of ∼20% for a thermal helium atom beam and a particularly small surface electron density corrugation ((0.06 ± 0.02) Å peak to peak height). The Debye–Waller attenuation of the elastic diffraction peaks of graphene/Ni(111) and Ni(111) was measured at surface temperatures between 150 and 740 K. A surface Debye temperature of θD = (784 ± 14) K is determined for the graphene/Ni(111) system and θD = (388 ± 7) K for Ni(111), suggesting that the interlayer interaction between graphene and the Ni substrate is intermediary between those for strongly interacting systems like graphene/Ru(0001) and weakly interacting systems like graphene/Pt(111). In addition we present measurements of low frequency surface phonon modes on graphene/Ni(111) where the phonon modes of the Ni(111) substrate can be clearly observed. The similarity of these findings with the graphene/Ru(0001) system indicates that the bonding of graphene to a metal substrate alters the dynamic properties of the graphene surface strongly and is responsible for the high helium reflectivity of these systems. PMID:26617683

  12. The achievement of low contact resistance to indium phosphide: The roles of Ni, Au, Ge, and combinations thereof

    NASA Technical Reports Server (NTRS)

    Fatemi, Navid S.; Weizer, Victor G.

    1992-01-01

    We have investigated the electrical and metallurgical behavior of Ni, Au-Ni, and Au-Ge-Ni contacts on n-InP. We have found that very low values of contact resistivity rho(sub c) in the E-7 omega-sq cm range are obtained with Ni-only contacts. We show that the addition of Au to Ni contact metallization effects an additional order of magnitude reduction in rho(sub c). Ultra-low contact resistivities in the E-8 omega-sq cm range are obtained with both the Au-Ni and the Au-Ge-Ni systems, effectively eliminating the need for the presence of Ge in the Au-Ge-Ni system. The formation of various nickel phosphides at the metal-InP interface is shown to be responsible for the observed rho(sub c) values in the Ni and Au-Ni systems. We show, finally, that the order in which the constituents of Au-Ni and Au-Ge-Ni contacts are deposited has a significant bearing on the composition of the reaction products formed at the metal-InP interface and therefore on the contact resistivity at that interface.

  13. Voltammetry as a virtual potentiometric sensor in modelling of a metal-ligand system and refinement of stability constants. Part 4. An electrochemical study of NiII complexes with methylene diphosphonic acid.

    PubMed

    Cukrowski, Ignacy; Mogano, Daniel M; Zeevaart, Jan Rijn

    2005-12-01

    The Ni(II)-MDP-OH system (MDP=methylene diphosphonic acid) and stability constants of complexes formed at ionic strength 0.15M at 298K were established by direct current polarography (DCP) and glass electrode potentiometry (GEP). The final M-L-OH model could only be arrived to by employing recent concept of virtual potentiometry (VP). VP-data were generated from non-equilibrium and dynamic DC polarographic technique. The VP and GEP data were refined simultaneously by software dedicated to potentiometric studies of metal complexes. Species distribution diagrams that were generated for different experimental conditions employed in this work assisted in making the final choice regarding the metal-ligand model. The model established contains ML, ML(2), ML(OH) and ML(OH)(2) with stability constants, as logbeta, 7.94+/-0.02, 13.75+/-0.02, 12.04 (fixed value), and 16.75+/-0.05, respectively. It has been demonstrated that virtual potential must be used in modelling operations (predictions of species formed) when a polarographic signal decreases significantly due to the formation of polarographically inactive species (or formation of inert complexes). The linear free energy relationships that included stability constant logK(1) for Ni(II)-MDP established in this work together with other available data were used to predict logK(1) values for Sm(III) and Ho(III) with MDP. The logK(1) values for Sm(III)-MDP and Ho(III)-MDP were estimated to be 9.65+/-0.10 and 9.85+/-0.10, respectively. PMID:16213588

  14. Effects of NiO nanoparticles on the magnetic properties and diffuse phase transition of BZT/NiO composites

    NASA Astrophysics Data System (ADS)

    Jarupoom, Parkpoom; Eitssayeam, Sukum; Pengpat, Kamonpan; Tunkasiri, Tawee; Cann, David P.; Rujijanagul, Gobwute

    2012-01-01

    A new composite system, Ba(Zr0.07Ti0.93)O3 (BZT93) ceramic/NiO nanoparticles, was fabricated to investigate the effect of NiO nanoparticles on the properties of these composites. M-H hysteresis loops showed an improvement in the magnetic behavior for higher NiO content samples plus modified ferroelectric properties. However, the 1 vol.% samples showed the optimum ferroelectric and ferromagnetic properties. Examination of the dielectric spectra showed that the NiO additive promoted a diffuse phase transition, and the two phase transition temperatures, as observed for BZT93, merged into a single phase transition temperature for the composite samples.

  15. Effects of NiO nanoparticles on the magnetic properties and diffuse phase transition of BZT/NiO composites

    PubMed Central

    2012-01-01

    A new composite system, Ba(Zr0.07Ti0.93)O3 (BZT93) ceramic/NiO nanoparticles, was fabricated to investigate the effect of NiO nanoparticles on the properties of these composites. M-H hysteresis loops showed an improvement in the magnetic behavior for higher NiO content samples plus modified ferroelectric properties. However, the 1 vol.% samples showed the optimum ferroelectric and ferromagnetic properties. Examination of the dielectric spectra showed that the NiO additive promoted a diffuse phase transition, and the two phase transition temperatures, as observed for BZT93, merged into a single phase transition temperature for the composite samples. PMID:22221698

  16. Effects of NiO nanoparticles on the magnetic properties and diffuse phase transition of BZT/NiO composites.

    PubMed

    Jarupoom, Parkpoom; Eitssayeam, Sukum; Pengpat, Kamonpan; Tunkasiri, Tawee; Cann, David P; Rujijanagul, Gobwute

    2012-01-01

    A new composite system, Ba(Zr0.07Ti0.93)O3 (BZT93) ceramic/NiO nanoparticles, was fabricated to investigate the effect of NiO nanoparticles on the properties of these composites. M-H hysteresis loops showed an improvement in the magnetic behavior for higher NiO content samples plus modified ferroelectric properties. However, the 1 vol.% samples showed the optimum ferroelectric and ferromagnetic properties. Examination of the dielectric spectra showed that the NiO additive promoted a diffuse phase transition, and the two phase transition temperatures, as observed for BZT93, merged into a single phase transition temperature for the composite samples.

  17. Domino-cyclisation and hydrogenation of citronellal to menthol over bifunctional Ni/Zr-Beta and Zr-beta/Ni-MCM-41 catalysts.

    PubMed

    Nie, Yuntong; Chuah, Gaik-Khuan; Jaenicke, Stephan

    2006-02-21

    The one-pot conversion of (+/-)-citronellal to menthol can be selectively catalysed by either a bifunctional Ni/Zr-zeolite beta catalyst or a dual catalyst system of Zr-beta and Ni/MCM-41, giving a high diastereoselectivity to (+/-)-menthol of 90-94%.

  18. Synthesis and electrochemical behavior of nanostructured cauliflower-shape Co-Ni/Co-Ni oxides composites

    SciTech Connect

    Gupta, Vinay Kawaguchi, Toshikazu; Miura, Norio

    2009-01-08

    Nanostructured Co-Ni/Co-Ni oxides were electrochemically deposited onto stainless steel electrode by electrochemical method and characterized for their structural and supercapacitive properties. The SEM images indicated that the obtained Co-Ni/Co-Ni oxides had cauliflower-type nanostructure. The X-ray diffraction pattern showed the formation of Co{sub 3}O{sub 4}, NiO, Co and Ni. The EDX elemental mapping images indicated that Ni, Co and O are distributed uniformly. The deposited Co-Ni/Co-Ni oxides showed good supercapacitive characteristics with a specific capacitance of 331 F/g at 1 mA/cm{sup 2} current density in 1 M KOH electrolyte. A mechanism of the formation of cauliflower-shape Co-Ni/Co-Ni oxides was proposed. A variety of promising applications in the fields such as energy storage devices and sensors can be envisioned from Co-Ni/Co-Ni oxides.

  19. NiO nanoparticles induce apoptosis through repressing SIRT1 in human bronchial epithelial cells

    SciTech Connect

    Duan, Wei-Xia; He, Min-Di; Mao, Lin; Qian, Feng-Hua; Li, Yu-Ming; Pi, Hui-Feng; Liu, Chuan; Chen, Chun-Hai; Lu, Yong-Hui; Cao, Zheng-Wang; Zhang, Lei; Yu, Zheng-Ping; Zhou, Zhou

    2015-07-15

    With application of nano-sized nickel-containing particles (Nano-Ni) expanding, the health concerns about their adverse effects on the pulmonary system are increasing. However, the mechanisms for the pulmonary toxicity of these materials remain unclear. In the present study, we focused on the impacts of NiO nanoparticles (NiONPs) on sirtuin1 (SIRT1), a NAD-dependent deacetylase, and investigated whether SIRT1 was involved in NiONPs-induced apoptosis. Although the NiONPs tended to agglomerate in fluid medium, they still entered into the human bronchial epithelial cells (BEAS-2B) and released Ni{sup 2+} inside the cells. NiONPs at doses of 5, 10, and 20 μg/cm{sup 2} inhibited the cell viability. NiONPs' produced cytotoxicity was demonstrated through an apoptotic process, indicated by increased numbers of Annexin V positive cells and caspase-3 activation. The expression of SIRT1 was markedly down-regulated by the NiONPs, accompanied by the hyperacetylation of p53 (tumor protein 53) and overexpression of Bax (Bcl-2-associated X protein). However, overexpression of SIRT1 through resveratrol treatment or transfection clearly attenuated the NiONPs-induced apoptosis and activation of p53 and Bax. Our results suggest that the repression of SIRT1 may underlie the NiONPs-induced apoptosis via p53 hyperacetylation and subsequent Bax activation. Because SIRT1 participates in multiple biologic processes by deacetylation of dozens of substrates, this knowledge of the impact of NiONPs on SIRT1 may lead to an improved understanding of the toxic mechanisms of Nano-Ni and provide a molecular target to antagonize Nano-Ni toxicity. - Highlights: • NiONPs were taken up by BEAS-2B cells and released Ni{sup 2+}. • NiONPs produced cytotoxicity was demonstrated through an apoptotic process. • NiONPs repressed SIRT1 expression and activated p53 and Bax. • Overexpression of SIRT1 attenuated NiONPs-induced apoptosis via deacetylation p53.

  20. Theoretical study on the mechanism of Ni-catalyzed alkyl-alkyl Suzuki cross-coupling.

    PubMed

    Li, Zhe; Jiang, Yuan-Ye; Fu, Yao

    2012-04-01

    Ni-catalyzed cross-coupling of unactivated secondary alkyl halides with alkylboranes provides an efficient way to construct alkyl-alkyl bonds. The mechanism of this reaction with the Ni/L1 (L1=trans-N,N'-dimethyl-1,2-cyclohexanediamine) system was examined for the first time by using theoretical calculations. The feasible mechanism was found to involve a Ni(I)-Ni(III) catalytic cycle with three main steps: transmetalation of [Ni(I)(L1)X] (X=Cl, Br) with 9-borabicyclo[3.3.1]nonane (9-BBN)R(1) to produce [Ni(I)(L1)(R(1))], oxidative addition of R(2) X with [Ni(I)(L1)(R(1))] to produce [Ni(III)(L1)(R(1))(R(2))X] through a radical pathway, and C-C reductive elimination to generate the product and [Ni(I)(L1)X]. The transmetalation step is rate-determining for both primary and secondary alkyl bromides. KOiBu decreases the activation barrier of the transmetalation step by forming a potassium alkyl boronate salt with alkyl borane. Tertiary alkyl halides are not reactive because the activation barrier of reductive elimination is too high (+34.7 kcal mol(-1)). On the other hand, the cross-coupling of alkyl chlorides can be catalyzed by Ni/L2 (L2=trans-N,N'-dimethyl-1,2-diphenylethane-1,2-diamine) because the activation barrier of transmetalation with L2 is lower than that with L1. Importantly, the Ni(0)-Ni(II) catalytic cycle is not favored in the present systems because reductive elimination from both singlet and triplet [Ni(II)(L1)(R(1))(R(2))] is very difficult.

  1. Insight into the active phase of CO oxidation on Ni/Pt and NiO1 - x/Pt model catalysts from a first principles investigation

    NASA Astrophysics Data System (ADS)

    Wang, Chen; Lv, Yong-kang; Wang, Gui-Chang

    2013-08-01

    CO oxidation on bimetallic and metal oxide has drawn much attention in the past years due to its importance both technologically and theoretically, but the active phase as well as the detailed reaction mechanism on the bimetallic surface oxide (i.e., a sandwich-like surface structure) are still unclear. In this work, the CO oxidation on the various Pt-Ni model catalysts [including Pt(111), Pt/Ni/Pt(111), Ni/Pt(111), NiO1 - x/Pt(111) and NiO1 - x/Pt/Ni/Pt(111)] was studied by performing the density functional theory calculations. It was found that the CO oxidation reaction would process with a higher reaction barrier on metals at lower oxygen coverage via the Langmuir-Hinshelwood (L-H) mechanism, whereas CO oxidation reaction would take place with a lower barrier at higher oxygen coverage on metals or in the presence of molecular oxygen/CO (on NiO1 - x-like systems) via the Eley-Rideal mechanism. The calculation results show that the activation energy of CO oxidation follows the order: Pt(111) (0.75 eV) > Pt/Ni/Pt(111) (0.69 eV) > Ni/Pt(111) (0.47 eV at 1 ML oxygen), which is in general agreement with the experimental observations. On the surface oxide NiO1 - x/Pt(111) and NiO1 - x/Pt/Ni/Pt(111) systems, it was found that the molecular CO can subtract the surface lattice oxygen to form CO2 spontaneously through the Eley-Rideal mechanism on NiO1 - x/Pt/Ni/Pt(111), whereas such kinetic behavior cannot occur on the NiO1 - x/Pt(111) system, suggesting the high reactivity of CO oxidation on NiO1 - x/Pt/Ni/Pt(111). The possible reason was analyzed by the magnitude of surface oxygen vacancy formation energy, namely NiO1 - x/Pt/M/Pt(111) with relatively low vacancy formation energy as compared to that of NiO1 - x/Pt(111) (3.46 vs 4.51 eV). Moreover, we extend the above study to a more general case in which the subsurface metals in NiO1 - x/Pt/M/Pt(111) system including VIII group metals like Fe/Co/Ni and the IB group metals like Cu, and it was found that the molecular CO

  2. Effective interactions and atomic ordering in Ni-rich Ni-Re alloys

    NASA Astrophysics Data System (ADS)

    He, Shuang; Peng, Ping; Gorbatov, Oleg I.; Ruban, Andrei V.

    2016-07-01

    Interatomic interactions and ordering in fcc Ni-rich Ni-Re alloys are studied by means of first-principles methods combined with statistical mechanics simulations based on the Ising Hamiltonian. First-principles calculations are employed to obtain effective chemical and strain-induced interactions, as well as ordering energies and enthalpies of formation of random and ordered Ni-Re alloys. Based on the nonmagnetic enthalpies of formation, we speculate that the type of ordering can be different in alloys with Re content less than 10 at.%. We demonstrate that effective chemical interactions in this system are quite sensitive to the alloy composition, atomic volume, and magnetic state. In statistical thermodynamic simulations, we have used renormalized interactions, which correctly reproduce ordering energies obtained in the direct total energy calculations. Monte Carlo simulations for Ni0.91Re0.09 alloy show that there exists a strong ordering tendency of the (1 1/2 0 ) type leading to precipitation of the D1 a ordered structure at about 940 K. Our results for the atomic short-range order indicate, however, that the presently applied theory overestimates the strength of the ordering tendency compared to that observed in the experiment.

  3. Eutectic superalloys strengthened by sigma, Ni3CB lamellae and gamma prime, Ni3Al precipitates

    NASA Technical Reports Server (NTRS)

    Lemkey, F. D.

    1973-01-01

    By means of a screening and solidification optimization study of certain alloys located on the gamma-sigma liquidus surface within the Ni-Cb-Cr-Al system, alloys with high temperature properties superior to those of all known superalloys were defined. One alloy, Ni - 19.7w/o Cb - 6.0w/o Cr - 2.5w/o Al, directionally solidified at 3 cm/hr met or exceeded each program goal. A second alloy, Ni-21.75 w/o Cb-2.55 w/o Al, although deficient in its inherent oxidation resistance, met the other program goals and combined a remarkable insensitivity of composite microstructure to solidification parameters with excellent low temperature toughness. This investigation demonstrated that useful properties for gas turbine airfoil application have been achieved by reinforcing a strong and tough gamma solid solution matrix containing precipitated gamma prime by a lamellar intermetallic compound Ni3 Cb having greater strength at elevated temperature.

  4. Effect of Thermal Treatments on Ni-Mn-Ga and Ni-Rich Ni-Ti-Hf/Zr High-Temperature Shape Memory Alloys

    NASA Astrophysics Data System (ADS)

    Santamarta, Ruben; Evirgen, Alper; Perez-Sierra, Aquilina M.; Pons, Jaume; Cesari, Eduard; Karaman, Ibrahim; Noebe, Ron D.

    2015-11-01

    Among all the promising high-temperature shape memory alloys (HTSMAs), the Ni-Mn-Ga and the Ni-Ti-Hf/Zr systems exhibit interesting shape memory and superelastic properties that may place them in a good position for potential applications. The present work shows that thermal treatments play a crucial role in controlling the martensitic phase transformation characteristics of both systems, but in different ways. On one hand, the equilibrium phase diagram of the Ni-Mn-Ga family allows selecting compositions with high transformation temperatures and outstanding thermal stability at relatively high temperatures in air, showing no significant changes in the transformation behavior for continuous aging up to ˜5 years at 500 °C. Moreover, the excellent thermal stability correlates with a good thermal cyclic stability and an exceptional oxidation resistance of the parent phase. On the other hand, precipitation processes controlled by thermal treatments are needed to manipulate the transformation temperatures, mechanical properties, and thermal stability of Ni-rich Ni-Ti-Hf/Zr alloys to become HTSMAs. These changes in the functional properties are a consequence of the competition between the mechanical and compositional effects of the precipitates on the martensitic transformation.

  5. Release of Ni from birnessite during transformation of birnessite to todorokite: Implications for Ni cycling in marine sediments

    NASA Astrophysics Data System (ADS)

    Atkins, Amy L.; Shaw, Samuel; Peacock, Caroline L.

    2016-09-01

    crystallinity of the neo-formed todorokite phase, but does not alter the mechanism and pathway of todorokite formation, compared to a Ni-free system. Furthermore, in systems tending towards todorokite as the final diagenetic product, we see that up to 50% of the Ni originally sequestered by birnessite is released to solution during the transformation. Our work indicates that the transformation of birnessite to todorokite in oxic marine sediments likely provides a significant source of Ni to marine sedimentary porewaters and potentially a hitherto unrecognized benthic flux of Ni to seawater.

  6. NiCr etching in a reactive gas

    SciTech Connect

    Ritter, J.; Boucher, R.; Morgenroth, W.; Meyer, H. G.

    2007-05-15

    The authors have etched NiCr through a resist mask using Cl/Ar based chemistry in an electron cyclotron resonance etch system. The optimum gas mixture and etch parameters were found for various ratios of Ni to Cr, based on the etch rate, redeposits, and the etch ratio to the mask. The introduction of O{sub 2} into the chamber, which is often used in the etching of Cr, served to both increase and decrease the etch rate depending explicitly on the etching parameters. Etch rates of >50 nm min{sup -1} and ratios of >1 (NiCr:Mask) were achieved for NiCr (80:20). Pattern transfer from the mask into the NiCr was achieved with a high fidelity and without redeposits for a Cl/Ar mix of 10% Ar (90% Cl{sub 2}) at an etch rate of {approx_equal}50 nm min{sup -1} and a ratio of 0.42 (NiCr:ZEP 7000 e-beam mask)

  7. Structural transformations in NiTi shape memory alloy nanowires

    NASA Astrophysics Data System (ADS)

    Mirzaeifar, Reza; Gall, Ken; Zhu, Ting; Yavari, Arash; DesRoches, Reginald

    2014-05-01

    Martensitic phase transformation in bulk Nickle-Titanium (NiTi)—the most widely used shape memory alloy—has been extensively studied in the past. However, the structures and properties of nanostructured NiTi remain poorly understood. Here, we perform molecular dynamics simulations to study structural transformations in NiTi nanowires. We find that the tendency to reduce the surface energy in NiTi nanowires can lead to a new phase transformation mechanism from the austenitic B2 to the martensitic B19 phase. We further show that the NiTi nanowires exhibit the pseudoelastic effects during thermo-mechanical cycling of loading and unloading via the B2 and B19 transformations. Our simulations also reveal the unique formation of compound twins, which are expected to dominate the patterning of the nanostructured NiTi alloys at high loads. This work provides the novel mechanistic insights into the martensitic phase transformations in nanostructured shape memory alloy systems.

  8. Electronic structure of Co-Ni-Ga Heusler alloys studied by resonant photoemission

    SciTech Connect

    Baral, Madhusmita Banik, Soma Ganguli, Tapas Chakrabarti, Aparna Deb, S. K.; Thamizhavel, A.; Wadikar, Avinash; Phase, D. M.

    2014-04-24

    The electronic structures of Co{sub 2.01}Ni{sub 1.05}Ga{sub 0.94} and Co{sub 1.76}Ni{sub 1.46}Ga{sub 0.78} Heusler alloys have been investigated by resonant photoemission spectroscopy across the 3p-3d transition of Co and Ni. For the Ni excess composition Co{sub 1.76}Ni{sub 1.46}Ga{sub 0.78}, the valence band peak shows a shift of 0.25 eV as compared to the near stoichiometric composition Co{sub 2.01}N1{sub 1.05}Ga{sub 0.94}. Also an enhancement is observed in the Ni related satellite features in the valence band for the Ni excess composition. Due to hybridization of Co and Ni 3d states in these systems, the Co and Ni 3p-3d resonance energies are found to be higher as compared to Co and Ni metals. Theoretical first principle calculation is performed to understand the features in the valence band and the shape of the resonance profile.

  9. Organic amendments for improving biomass production and metal yield of Ni-hyperaccumulating plants.

    PubMed

    Álvarez-López, V; Prieto-Fernández, Á; Cabello-Conejo, M I; Kidd, P S

    2016-04-01

    Ni phytomining is a promising technology for Ni recovery from low-grade ores such as ultramafic soils. Metal-hyperaccumulators are good candidates for phytomining due to their extraordinary capacity for Ni accumulation. However, many of these plants produce a low biomass, which makes the use of agronomic techniques for improving their growth necessary. In this study, the Ni hyperaccumulators Alyssum serpyllifolium ssp. lusitanicum, A. serpyllifolium ssp. malacitanum, Alyssum bertolonii and Noccaea goesingense were evaluated for their Ni phytoextraction efficiency from a Ni-rich serpentine soil. Effects of soil inorganic fertilisation (100:100:125kgNPKha(-1)) and soil organic amendment addition (2.5, 5 or 10% compost) on plant growth and Ni accumulation were determined. All soil treatments greatly improved plant growth, but the highest biomass production was generally found after addition of 2.5 or 5% compost (w/w). The most pronounced beneficial effects were observed for N. goesingense. Total Ni phytoextracted from soils was significantly improved using both soil treatments (inorganic and organic), despite the decrease observed in soil Ni availability and shoot Ni concentrations in compost-amended soils. The most promising results were found using intermediate amount of compost, indicating that these types of organic wastes can be incorporated into phytomining systems. PMID:26803735

  10. Organic amendments for improving biomass production and metal yield of Ni-hyperaccumulating plants.

    PubMed

    Álvarez-López, V; Prieto-Fernández, Á; Cabello-Conejo, M I; Kidd, P S

    2016-04-01

    Ni phytomining is a promising technology for Ni recovery from low-grade ores such as ultramafic soils. Metal-hyperaccumulators are good candidates for phytomining due to their extraordinary capacity for Ni accumulation. However, many of these plants produce a low biomass, which makes the use of agronomic techniques for improving their growth necessary. In this study, the Ni hyperaccumulators Alyssum serpyllifolium ssp. lusitanicum, A. serpyllifolium ssp. malacitanum, Alyssum bertolonii and Noccaea goesingense were evaluated for their Ni phytoextraction efficiency from a Ni-rich serpentine soil. Effects of soil inorganic fertilisation (100:100:125kgNPKha(-1)) and soil organic amendment addition (2.5, 5 or 10% compost) on plant growth and Ni accumulation were determined. All soil treatments greatly improved plant growth, but the highest biomass production was generally found after addition of 2.5 or 5% compost (w/w). The most pronounced beneficial effects were observed for N. goesingense. Total Ni phytoextracted from soils was significantly improved using both soil treatments (inorganic and organic), despite the decrease observed in soil Ni availability and shoot Ni concentrations in compost-amended soils. The most promising results were found using intermediate amount of compost, indicating that these types of organic wastes can be incorporated into phytomining systems.

  11. Formation and Stability of Ni-Al Hydroxide Phases in Soils

    SciTech Connect

    Peltier, E.; Van Der Lelie, D; Sparks, D

    2010-01-01

    The formation of mixed metal-aluminum hydroxide surface precipitates is a potentially significant uptake route for trace metals (including Co, Ni, and Zn) in environmental systems. This paper investigates the effect of mixed Ni-Al hydroxide precipitate formation and aging on Ni solubility and bioavailability in laboratory contaminated soils. Two Delaware agricultural soils were reacted with a 3 mM Ni solution for 12 months at pH's above and below the threshold for mixed Ni-Al hydroxide formation. Ni speciation was determined at 1, 6, and 12 months using X-ray absorption spectroscopy (XAS). Precipitate solubility was examined through desorption experiments using HNO{sub 3} and EDTA as desorbing agents, whereas metal bioavailability was assessed using a Ni-specific bacterial biosensor. For both soils, the formation of Ni-Al hydroxide surface precipitates resulted in a reduction in the fraction of desorbed and bioavailable Ni. However, precipitate dissolution was greater, particularly with EDTA, than in published studies on isolated soil clay fractions, and less affected by aging processes. These results suggest that mixed Ni-Al hydroxide phases forming in real world environments may be both longer-lasting and more susceptible to ligand-promoted dissolution than previously expected.

  12. Interdiffusion behavior of Pt-modified γ-Ni + γ'-Ni3Al alloys coupled to Ni-Al-based alloys

    NASA Astrophysics Data System (ADS)

    Hayashi, Shigenari; Wang, Wen; Sordelet, Daniel J.; Gleeson, Brian

    2005-07-01

    The effect of platinum addition on the interdiffusion behavior of γ-Ni + γ'-Ni3Al alloys was studied by using diffusion couples comprised of a Ni-Al-Pt alloy mated to a Ni-Al, Ni-Al-Cr, or Ni-based commercial alloy. The commercial alloys studied were CMSX-4 and CMSX-10. Diffusion annealing was at 1150 °C for up to 100 hours. An Al-enriched γ'-layer often formed in the interdiffusion zone of a given couple during diffusion annealing due to the uphill diffusion of Al. This uphill diffusion was ascribed to Pt addition decreasing the chemical activity of aluminum in the γ + γ' alloys. For a given diffusion couple end member, the thickening kinetics of the γ' layer that formed increased with increasing Pt content in the Ni-Al-Pt γ + γ' alloy. The γ'-layer thickening kinetics in diffusion couples with Cr showed less of a dependence on Pt concentration. Inference of a negative effect of Pt and positive effect of Cr on the Al diffusion in this system enabled explanation of the observed interdiffusion behaviors. There was no or minimal formation of detrimental topologically close-packed (TCP) phases in the interdiffusion zone of the couples with CMSX-4 or CMSX-10. An overlay Pt-modified γ + γ' coating on CMSX-4 showed excellent oxidation resistance when exposed to air for 1000 hours at 1150 °C. Moreover, the Al content in the coating was maintained at a relatively high level due to Al replenishment from the CMSX-4 substrate.

  13. The role of NiOx overlayers on spontaneous growth of NiSix nanowires from Ni seed layers.

    PubMed

    Kang, Kibum; Kim, Sung-Kyu; Kim, Cheol-Joo; Jo, Moon-Ho

    2008-02-01

    We report a controllably reproducible and spontaneous growth of single-crystalline NiSix nanowires using NiOx/Ni seed layers during SiH4 chemical vapor deposition (CVD). We provide evidence that upon the reactions of SiH4 (vapor)-Ni seed layers (solid), the presence of the NiOx overlayer on Ni seed layers plays the key role to promote the spontaneous one-dimensional growth of NiSix single crystals without employing catalytic nanocrystals. Specifically, the spontaneous nanowire formation on the NiOx overlayer is understood within the frame of the SiH4 vapor-phase reaction with out-diffused Ni from the Ni underlayers, where the Ni diffusion is controlled by the NiOx overlayers for the limited nucleation. We show that single-crystalline NiSix nanowires by this self-organized fashion in our synthesis display a narrow diameter distribution, and their average length is set by the thickness of the Ni seed layers. We argue that our simple CVD method employing the bilayers of transition metal and their oxides as the seed layers can provide implication as the general synthetic route for the spontaneous growth of metal-silicide nanowires in large scales.

  14. Glass nanoimprint using amorphous Ni-P mold etched by focused-ion beam

    SciTech Connect

    Mekaru, Harutaka; Kitadani, Takeshi; Yamashita, Michiru; Takahashi, Masaharu

    2007-07-15

    The authors succeeded in glass-nanoimprint lithography of micropatterns and nanopatterns using an amorphous Ni-P alloy mold. Glasslike carbon has been used as a mold material to mold not only Pyrex glass but also quartz, because it is still stable at a temperature of 1650 deg. C. However, it is difficult to process glasslike carbon substrates into arbitrary shapes by machining. They thought that amorphous Ni-P alloy could be used as a mold material for industrial glass molding. If Ni is electroless plated when mixed with suitable amount of P on a Si wafer, the Ni-P alloy layer becomes amorphous. An appropriate ratio of Ni and P was determined by the results of x-ray-diffraction measurements. The optimized composition ratio of Ni-P was Ni:P=92:8 wt %. Moreover, line and space patterns and dot arrays with linewidths of as little as 500 nm were etched on the mold using focused-ion beam (FIB) and the processing accuracy for the amorphous Ni-P layer was compared with that for the pure Ni layer. The result was that patterns of 500 nm width were etched to a depth of 2 {mu}m on an amorphous Ni-P alloy mold and the processed surfaces were smooth. In contrast, in the case of the pure Ni layer, the processing line was notched and the sidewalls were very rough. The crystal grain seems to hinder the processing of the nanopattern. After FIB etching, the amorphous Ni-P alloy was thermally treated at 400 deg. C to improve the hardness. Finally, line and space patterns and dot arrays on the amorphous Ni-P alloy mold were nanoimprinted on Pyrex glass using a glass-nanoimprint system (ASHE0201) that National Institute of Advanced Industrial Science and Technology developed.

  15. Accessing Ni(III)-thiolate versus Ni(II)-thiyl bonding in a family of Ni-N2S2 synthetic models of NiSOD.

    PubMed

    Broering, Ellen P; Dillon, Stephanie; Gale, Eric M; Steiner, Ramsey A; Telser, Joshua; Brunold, Thomas C; Harrop, Todd C

    2015-04-20

    Superoxide dismutase (SOD) catalyzes the disproportionation of superoxide (O2(• -)) into H2O2 and O2(g) by toggling through different oxidation states of a first-row transition metal ion at its active site. Ni-containing SODs (NiSODs) are a distinct class of this family of metalloenzymes due to the unusual coordination sphere that is comprised of mixed N/S-ligands from peptide-N and cysteine-S donor atoms. A central goal of our research is to understand the factors that govern reactive oxygen species (ROS) stability of the Ni-S(Cys) bond in NiSOD utilizing a synthetic model approach. In light of the reactivity of metal-coordinated thiolates to ROS, several hypotheses have been proffered and include the coordination of His1-Nδ to the Ni(II) and Ni(III) forms of NiSOD, as well as hydrogen bonding or full protonation of a coordinated S(Cys). In this work, we present NiSOD analogues of the general formula [Ni(N2S)(SR')](-), providing a variable location (SR' = aryl thiolate) in the N2S2 basal plane coordination sphere where we have introduced o-amino and/or electron-withdrawing groups to intercept an oxidized Ni species. The synthesis, structure, and properties of the NiSOD model complexes (Et4N)[Ni(nmp)(SPh-o-NH2)] (2), (Et4N)[Ni(nmp)(SPh-o-NH2-p-CF3)] (3), (Et4N)[Ni(nmp)(SPh-p-NH2)] (4), and (Et4N)[Ni(nmp)(SPh-p-CF3)] (5) (nmp(2-) = dianion of N-(2-mercaptoethyl)picolinamide) are reported. NiSOD model complexes with amino groups positioned ortho to the aryl-S in SR' (2 and 3) afford oxidized species (2(ox) and 3(ox)) that are best described as a resonance hybrid between Ni(III)-SR and Ni(II)-(•)SR based on ultraviolet-visible (UV-vis), magnetic circular dichroism (MCD), and electron paramagnetic resonance (EPR) spectroscopies, as well as density functional theory (DFT) calculations. The results presented here, demonstrating the high percentage of S(3p) character in the highest occupied molecular orbital (HOMO) of the four-coordinate reduced form of NiSOD (Ni

  16. Diffusion bonding of commercially pure Ni using Cu interlayer

    SciTech Connect

    Rahman, A.H.M.E. Cavalli, M.N.

    2012-07-15

    The concentration dependence of diffusivity in a multi-component diffusion system makes it complicated to predict the concentration profiles of diffusing species. This so called chemical diffusivity can be expressed as a function of thermodynamic and kinetic data. DICTRA software can calculate the concentration profiles using appropriate mobility and thermodynamic data. It can also optimize the diffusivity data using experimental diffusivity data. Then the optimized diffusivity data is stored as mobility data which is a linear function of temperature. In this work, diffusion bonding of commercially pure Ni using Cu interlayers is reported. The mobility parameters of Ni-Cu alloy binary systems were optimized using DICTRA/Thermocalc software from the available self-, tracer and chemical diffusion coefficients. The optimized mobility parameters were used to simulate concentration profiles of Ni-Cu diffusion joints using DICTRA/Thermocalc software. The calculated and experimental concentration profiles agreed well at 1100 Degree-Sign C. Agreement between the simulated and experimental profiles was less good at 1050 Degree-Sign C due to the grain boundary contribution to the overall diffusion. - Highlights: Black-Right-Pointing-Pointer The concentration profiles of Cu in Ni-Cu diffusion joints are modeled. Black-Right-Pointing-Pointer Interdiffusion coefficients in Ni-Cu system are optimized. Black-Right-Pointing-Pointer Optimized interdiffusion coefficients are expressed as mobility parameters. Black-Right-Pointing-Pointer Simulated profiles are comparable with experimental profiles.

  17. Design of Heusler Precipitation Strengthened NiTi- and PdTi-Base SMAs for Cyclic Performance

    NASA Astrophysics Data System (ADS)

    Frankel, Dana J.; Olson, Gregory B.

    2015-06-01

    For a wide range of actuation applications, the performance of NiTi-based shape memory alloys is limited by cyclic instability associated with accommodation slip. For medical applications, low-Ni compositions are also desirable. Increasing yield strength via precipitation of a coherent nanoscale Ni2TiAl-type Heusler phase from a supersaturated B2 matrix is an effective approach for eliminating slip in order to improve the stability of the functional response and increase the structural fatigue life. Quaternary additions that partition into the L21 Heusler phase, such as Zr or Pd, are favorable for reducing interphase misfit and maintaining coherency during aging. Phase relations and precipitation kinetics in quaternary Ni(TiZrAl), low-Ni (PdNi)(TiAl), and Ni-free (PdFe)(TiAl) systems are summarized from TEM and atom probe tomography data in the literature. Strengthening behavior during isothermal aging is compared in the NiTiZrAl and PdNiTiAl systems, and recent work characterizing a high-strength, low-Ni "Hybrid" (PdNi)(TiZrAl) alloy is presented. A systems design approach is taken in which an optimal microstructure for peak strengthening is identified while other property objectives such as transformation temperature, misfit, radiopacity, and biocompatibility are satisfied.

  18. The wetting characteristics and surface tension of some Ni-based alloys on yttria, hafnia, alumina, and zirconia substrates

    NASA Technical Reports Server (NTRS)

    Kanetkar, C. S.; Kacar, A. S.; Stefanescu, D. M.

    1988-01-01

    The surface tension and wetting characteristics of four commercial Ni-based alloys (UD718, Waspaloy, UD720, and UD520), pure Ni, and three special alloys (Ni-20 percent Cr, Ni-20 percent Cr-1 percent Al, and Ni-20 percent Cr-4 percent Al) on various ceramic substrates (including alumina, zirconia, hafnia, and yttria) were investigated using sessile drop experiments. Most of the systems studied exhibited a nonwetting behavior. Wetting improved with holding time at a given temperature to the point that some systems, such as Ni-20Cr on alumina, Ni-20Cr-4Al on alumina and on yttria, became marginally wetting. Wetting characteristics were apparently related to constitutional undercooling, which in turn could be affected by the metal dissolving some of the substrate during measurements.

  19. On the discontinuous precipitation reaction and solute redistribution in a Cu-15%Ni-8%Sn alloy

    SciTech Connect

    Alili, B.; Bradai, D.; Zieba, P.

    2008-10-15

    Optical and transmission electron microscopy studies have been undertaken in order to clarify some morphological aspects of the discontinuous precipitation (DP) reaction in a Cu-15Ni-8Sn (wt.%) alloy in the temperature range 800-950 K. The DP reaction proceeds in the ternary Cu-Ni-Sn system relatively fast (in binary Cu-Ni alloy is not present) with typical morphological features like change of growth direction, appearance and disappearance of solute-rich {gamma} lamellae. A fine continuous precipitation of single Ni and Sn-rich phase was also evidenced within the solute-depleted {alpha} lamellae. An energy-dispersive X-ray analysis showed the level of partitioning of the alloying elements. Most of the Ni and Sn is located in the {gamma} lamellae. However, the formula of the {gamma} lamellae is still close to (Cu{sub 3}Sn), which indicates that some Cu atoms are replaced by Ni.

  20. Mössbauer comparison of Fe(100)/Ni and Fe(110)/Ni heterostructures grown by molecular beam epitaxy (abstract)

    NASA Astrophysics Data System (ADS)

    Gutierrez, C. J.; Wieczorek, M. D.; Qiu, Z. Q.; Tang, H.; Walker, J. C.

    1990-05-01

    Epitaxial Fe(100)/Ni and Fe(110)/Ni heterostructures were grown using a Perkin-Elmer PHI 430B molecular-beam-epitaxy system equipped with (RHEED) and quadrupole mass analysis. The growth system typically achieved a base pressure of less than 5×10-10 Torr, and a growth pressure of less than 3×10-9 Torr. Typical growth rates were 3 Å/min for Fe and 2 Å/min for Ni. For all the heterostructures, the Ni thickness was held at 14 Å, the number of repetitions varied between 8 and 15 cycles, and growth always began with the Fe bilayer. Protective Ag covers were grown on all films. Three Fe (100)/Ni heterostructures were grown on 5-kÅ single-crystal Ag(100) bases grown on NaCl(001).1 The single-crystal Fe(100) bilayer thicknesses were 3, 8, or 12 monolayers (ML). The substrate growth temperature for this series was ramped from 40 to 80 °C due to radiant heating from the effusion cells. Four Fe(110)/Ni heterostructures were grown with Fe bilayer thicknesses of 2, 4, 8, and 12 ML. These heterostructures were grown on 5-kÅ Ag(111) single-crystal bases grown on single-crystal natural muscovite mica. An intervening epilayer of NaCl (150 Å) deposited between the mica and Ag base facilitated film removal from the Fe-contaminated mica for ex situ transmission 57Fe Mössbauer analysis. The substrate growth temperature for this series was held at 180 °C, since this appears to be optimal for Fe(110) growth on Ag(111).2 Note that the resultant Fe(110) growth is mosaic with Fe[001] parallel to Ag<110> (threefold symmetry). The RHEED observation of the growth of Ni on Fe(100) always resulted in the Ni RHEED pattern closely following that of the Fe (100) pattern, with broader Ni RHEED lines apparent. The characteristic behavior of our Ni RHEED patterns mimicked that observed by Heinrich et al. for bcc Ni(100),3 and did not match that of fcc Ni. The Ni-on-Fe(110) growth was analogous in RHEED characteristics to that of the (100) case. The Ni RHEED patterns again closely matched

  1. Molecular dynamics modeling using ab initio interatomic potentials for thermal properties of Ni-rich alloys

    SciTech Connect

    Mei, J.; Cooper, B.R.; Hao, Y.G.; Scoy, F.L. Van

    1994-12-31

    Molecular dynamics simulations have been performed to study thermal expansions of Ni-rich (fcc structure) Ni/Cr alloys (which serve as the basis for practical superalloy systems). This has been done using ab initio interatomic potentials with no experimental input. The coefficient of thermal expansion (CTE) as a function of temperature has been calculated. By admixing Re and Me atoms into fee Ni and the fee alloy system Ni/Cr, additive effects on the thermal expansion have been predicted. While addition of Cr lowers the CTE of Ni, and moderate addition of Mo lowers the CTE of Ni over a wide temperature range, moderate addition of Re raises the CTE of both Ni and Ni/Cr alloys over a significant temperature range. An explanation for the contrasting effect of additive Re on the CTE, based on a one-dimensional atomic chain model, is that the trade-off, between atomic volume effects increasing the CTE over that of pure Ni and pair-potential effects (exemplified by the Grueneisen parameter) decreasing the CTE from that of pure nickel, changes for Re compared to Cr and Mo.

  2. Hydrothermal Ni Prospectivity Analysis of Tasmania, Australia

    NASA Astrophysics Data System (ADS)

    Gonzalez-Alvarez, I.; Porwal, A.; McCuaig, T. C.; Maier, W.

    2009-04-01

    Tasmania contains the largest hydrothermal Ni deposit in Australia: Avebury (118,000 Ni metal tonnes). This Devonian deposit was discovered in 1998 in the Dundas geological region, and consists of a system of hydrothermal Ni ore bodies. They are hosted by an intensely altered and serpentinized Cambrian ultramafic suite in close proximity to major structural features. The mineralization is considered to be the result of hydrothermal scavenging and remobilization of the original nickel content of mafic/ultramafic rocks in the area, and subsequent re-deposition in favourable structural traps. This is based on the low sulphur, low Cu and Platinum element content of the mineralization. The mineralization is spatially (at the edge) and temporally related to a large granitic intrusion, the Heemskirk Granite, which is considered to be the source of the hydrothermal fluids as well as the necessary thermal gradients for the circulation of the fluids. Tasmania is largely covered by the Jurassic Ferrar continental flood basalt province in the East and constrains a number of early Cambrian ultramafic-mafic complexes in the West. The Ferrar large igneous province (LIP) extends over to Antarctica and is temporally and genetically related to the Karoo igneous province in southern Africa that comprises tholeiitic lava flows, sills, and dyke swarms. The Ferrar and Karoo igneous provinces were associated with the same thermal anomaly that was responsible for the break up of eastern Gondwana at ca 180 Ma. Despite of timeframe differences between the Avebury Ni deposits and the Ferrar LIP emplacement, similar geological settings to the Avebury could be duplicated along the Ferrar LIP. The presence of mafic/ultramafic rocks in favourable lithological packages and/or structural traps along the margins of the province indicate that this LIP could represent a possible exploration target for Ni hydrothermal deposits. Based on this background, a prospectivity analysis for hydrothermal Ni

  3. Direct growth of single-layer graphene on Ni surface manipulated by Si barrier

    NASA Astrophysics Data System (ADS)

    Wang, Gang; Li, Jinhua; Chen, Da; Zheng, Li; Zheng, Xiaohu; Guo, Qinglei; Wei, Xing; Ding, Guqiao; Zhang, Miao; Di, Zengfeng; Liu, Su

    2014-05-01

    Pure Ni film is the first metal catalyst that can generate graphene with small domains and variable thickness across the film. The lack of control over layer number is attributed to the high carbon solubility of Ni. We designed a combinatorial Ni/Si system, which enables the direct growth of monolayer graphene via chemical vapor deposition method. In this system, Si was introduced as the carbon diffusion barriers to prevent carbon diffusing into Ni film. The designed system fully overcomes the fundamental limitations of Ni and provides a facile and effective strategy to yield homogenous monolayer graphene over large area. The field effect transistors were fabricated and characterized to determine the electrical properties of the synthesized graphene film. Furthermore, this technique can utilize standard equipments available in semiconductor technology.

  4. Two Dimensional Antiferromagnetic Chern Insulator: NiRuCl6

    NASA Astrophysics Data System (ADS)

    Zhou, P.; Sun, C. Q.; Sun, L. Z.

    2016-10-01

    Based on DFT and Berry curvature calculations, we predict that quantum anomalous hall effect (QAHE) can be realized in two dimensional anti-ferromagnetic (AFM) NiRuCl6 with zero net magnetic moment. By tuning spin-orbits coupling (SOC), we find that the topological properties of NiRuCl6 come from its energy band reversal. The results indicate that NiRuCl6 behaves as AFM Chern insulator and its spin-polarized electronic structure and strong spin-orbits coupling (SOC) are the origin of QAHE. Considering the compatibility between AFM and insulator, AFM Chern insulator is more suitable to realize high temperature QAHE because generally Neel temperature of AFM systems is more easily improved than Curie temperature of ferromagnetic (FM) systems. Due to the different magnetic coupling mechanism between FM and AFM Chern insulator, AFM Chern insulator provides a new way to archive high temperature QAHE in experiments.

  5. Influence of hot isostatic pressing on the structure and properties of an innovative low-alloy high-strength aluminum cast alloy based on the Al-Zn-Mg-Cu-Ni-Fe system

    NASA Astrophysics Data System (ADS)

    Akopyan, T. K.; Padalko, A. G.; Belov, N. A.

    2015-11-01

    Hot isostatic pressing (HIP) is applied for treatment of castings of innovative low-ally high-strength aluminum alloy, nikalin ATs6N0.5Zh based on the Al-Zn-Mg-Cu-Ni-Fe system. The influence of HIP on the structure and properties of castings is studied by means of three regimes of barometric treatment with different temperatures of isometric holding: t 1 = 505 ± 2°C, p 1 = 100 MPa, τ1 = 3 h (HIP1); t 2 = 525 ± 2°C, p 2 = 100 MPa, τ2 = 3 h (HIP2); and t 3 = 545 ± 2°C, p 3 = 100 MPa, τ3 = 3 h (HIP3). It is established that high-temperature HIP leads to actually complete elimination of porosity and additional improvement of the morphology of second phases. Improved structure after HIP provides improvement properties, especially of plasticity. In particular, after heat treatment according of regime HIP2 + T4 (T4 is natural aging), the alloy plasticity is improved by about two times in comparison with the initial state (from ~6 to 12%). While applying regime HIP3 + T6 (T6 is artificial aging for reaching the maximum strength), the plasticity has improved by more than three times in comparison with the initial state, as after treatment according to regimes HIP1 + T6 and HIP2 + T6 (from ~1.2 to ~5.0%), which are characterized by a lower HIP temperature.

  6. Staggering in S+Ni collisions

    NASA Astrophysics Data System (ADS)

    Morelli, L.; Dagostino, M.; Bruno, M.; Gulminelli, F.; Baiocco, G.; Barlini, S.; Casini, G.; Gramegna, F.; Kravchuk, V. L.; Marchi, T.; Raduta, Ad. R.

    2012-07-01

    Odd-even effects in fragment production have been studied since a long time and never quantitatively understood. The odd-even anomaly was reported in the literature [1,2] to be more pronounced in reactions involving Ni projectile and targets, in particular in n-poor systems. In some experiments [1, 2] the magnitude of the odd-even effect is found to be related to the isospin of the projectile and/or the target. From a theoretical point of view, odd-even effects in fragmentation reactions are clearly linked to the pairing residual interaction and its dependence on temperature.

  7. Mechanical properties of NiTi and CuNiTi wires used in orthodontic treatment. Part 2: Microscopic surface appraisal and metallurgical characteristics

    PubMed Central

    Gravina, Marco Abdo; Canavarro, Cristiane; Elias, Carlos Nelson; Chaves, Maria das Graças Afonso Miranda; Brunharo, Ione Helena Vieira Portella; Quintão, Cátia Cardoso Abdo

    2014-01-01

    Objective This research aimed at comparing the qualitative chemical compositions and the surface morphology of fracture regions of eight types of Nickel (Ni) Titanium (Ti) conventional wires, superelastic and heat-activated (GAC, TP, Ormco, Masel, Morelli and Unitek), to the wires with addition of copper (CuNiTi 27ºC and 35ºC, Ormco) after traction test. Methods The analyses were performed in a scanning electronic microscope (JEOL, model JSM-5800 LV) with EDS system of microanalysis (energy dispersive spectroscopy). Results The results showed that NiTi wires presented Ni and Ti as the main elements of the alloy with minimum differences in their composition. The CuNiTi wires, however, presented Ni and Ti with a significant percentage of copper (Cu). As for surface morphology, the wires that presented the lowest wire-surface roughness were the superelastic ones by Masel and Morelli, while those that presented the greatest wire-surface roughness were the CuNiTi 27ºC and 35ºC ones by Ormco, due to presence of microcavity formed as a result of pulling out some particles, possibly of NiTi.4 The fracture surfaces presented characteristics of ductile fracture, with presence of microcavities. The superelastic wires by GAC and the CuNiTi 27ºC and the heat-activated ones by Unitek presented the smallest microcavities and the lowest wire-surface roughness with regard to fracture, while the CuNiTi 35ºC wires presented inadequate wire-surface roughness in the fracture region. Conclusion CuNiTi 35ºC wires did not present better morphologic characteristics in comparison to the other wires with regard to surfaces and fracture region. PMID:24713562

  8. Interdiffusion in Ni-rich, Ni-Cr-Al alloys at 1100 and 1200 C. I - Diffusion paths and microstructures. II - Diffusion coefficients and predicted concentration profiles

    NASA Technical Reports Server (NTRS)

    Nesbitt, J. A.; Heckel, R. W.

    1987-01-01

    Interdiffusion in Ni-rich Ni-Cr-Al alloys is investigated experimentally after annealing at 1100 and 1200 C using gamma/gamma, gamma/gamma+beta, gamma/gamma+gamma prime, and gamma/gamma+alpha diffusion couples. The amount and location of Kirkendall porosity suggests that Al diffuses more rapidly than Cr which diffuses more rapidly than Ni in the gamma phase of Ni-Cr-Al alloys. The location and extent of maxima and minima in the concentration profiles of the diffusion couples indicate that both cross-term diffusion coefficients are positive. Measurements are also presented of the ternary interdiffusion coefficients of the gamma phase in the Ni-Cr-Al system. It is shown that the interdiffusion coefficients can be accurately predicted by using a ternary finite-difference interdiffusion model.

  9. Live 107Pd in Some Group II and III Irons and the Time-Scales of Fe-Ni Segregations in the Early Solar System

    NASA Astrophysics Data System (ADS)

    Chen, J. H.; Wasserburg, G. J.

    1996-03-01

    In a recent report, we presented evidence for excesses (*) of ^107Ag* due to ^107Pd decay (tau bar = 6.5 Ma) in a wide variety of iron meteorites, some pallasites and mesosiderites. They provide unambiguous evidence of the in situ decay of ^107Pd in planetary differentiates. A key problem of early solar system chronologies has been the ability to interrelate different short-lived and long-lived chronometers. Evidence for the presence of both live ^107Pd and ^53Mn (tau bar = 5.3 Ma) in the early solar system has been found in several meteorites. However, there appear to be major discrepancies between the ^107Pd and ^53Mn chronometers. New Re-Os data on iron meteorites seem to support the small time differences for formation of iron meteorites as inferred by the Pd-Ag system. In this study, we selected samples on which Re-Os data were available. These include Coahuila (IIA) metal and Tres Castillos (IIIA) metal and sulfide.

  10. Pt-Ni bilayers on n-type silicon: Metallurgical and electrical behavior

    NASA Astrophysics Data System (ADS)

    Mantovani, S.; Nava, F.; Nobili, C.; Queirolo, G.; Celotti, G.

    1984-02-01

    Silicide formation in the Ni-Pt-Si system has been investigated mainly by megaelectronvolt backscattering spectrometry, glancing-angle x-ray diffraction, and Auger electron spectroscopy as a function of heat treatment (200-850 °C). Schottky-barrier values have been used to identify the kinds of metals present at the silicide/silicon interface. Pt/Ni/Si and Ni/Pt/Si structures have been prepared by e-gun deposition of thin Pt and Ni films on <100> n-type silicon single crystals. The reaction starts by forming the silicide, Ni2Si or Pt2Si, of the metal in contact with silicon and proceeds until all the inner-metal film has reacted. At about 300 °C for 30 min the outer metal starts to diffuse through the already formed silicide and builds up at the silicon surface. Further annealing enhances the reaction and there is evidence also of silicon diffusion towards the outside layer. At 400 °C for 30 min and in both structures, NiSi starts to form and pushes out the Pt from the silicon surface. The conversion of Ni2Si into NiSi provides the driving force for mass transport. The structures become laterally nonuniform and the changes are difficult to follow. The transformation of Pt2Si into PtSi, at about 500 °C, is accompanied by the transport of Pt through NiSi towards the silicon surface. Most Pt remains in the outside layer and both structures assume the configuration PtSi/NiSi/Si. At higher temperatures PtSi and NiSi intermix and there is no evidence of contribution from the silicon underneath. At 750 °C an almost uniform layer is formed with a Si1(NiPt)1 composition. The barrier height measurements reflect the mass transport in the silicides at the silicide/silicon interface.

  11. Formation of Intermetallic Compounds Between Liquid Sn and Various CuNi x Metallizations

    NASA Astrophysics Data System (ADS)

    Vuorinen, V.; Yu, H.; Laurila, T.; Kivilahti, J. K.

    2008-06-01

    Interfacial reactions between liquid Sn and various Cu-Ni alloy metallizations as well as the subsequent phase transformations during the cooling were investigated with an emphasis on the microstructures of the reaction zones. It was found that the extent of the microstructurally complex reaction layer (during reflow at 240°C) does not depend linearly on the Ni content of the alloy metallization. On the contrary, when Cu is alloyed with Ni, the rate of thickness change of the total reaction layer first increases and reaches a maximum at a composition of about 10 at.% Ni. The reaction layer is composed of a relatively uniform continuous (Cu,Ni)6Sn5 reaction layer (a uniphase layer) next to the NiCu metallizations and is followed by the two-phase solidification structures between the single-phase layer and Sn matrix. The thickness of the two-phase layer, where the intermetallic tubes and fibers have grown from the continuous interfacial (Cu,Ni)6Sn5 layer, varies with the Ni-to-Cu ratio of the alloy metallization. In order to explain the formation mechanism of the reaction layers and their observed kinetics, the phase equilibria in the Sn-rich side of the SnCuNi system at 240°C were evaluated thermodynamically utilizing the available data, and the results of the Sn/Cu x Ni1- x diffusion couple experiments. With the help of the assessed data, one can also evaluate the minimum Cu content of Sn-(Ag)-Cu solder, at which (Ni,Cu)3Sn4 transforms into (Cu,Ni)6Sn5, as a function of temperature and the composition of the liquid solders.

  12. Strain mediated coupling in magnetron sputtered multiferroic PZT/Ni-Mn-In/Si thin film heterostructure

    SciTech Connect

    Singh, Kirandeep; Kaur, Davinder; Singh, Sushil Kumar

    2014-09-21

    The strain mediated electrical and magnetic properties were investigated in PZT/Ni-Mn-In heterostructure deposited on Si (100) by dc/rf magnetron sputtering. X-ray diffraction pattern revealed that (220) orientation of Ni-Mn-In facilitate the (110) oriented tertragonal phase growth of PZT layer in PZT/Ni-Mn-In heterostructure. A distinctive peak in dielectric constant versus temperature plots around martensitic phase transformation temperature of Ni-Mn-In showed a strain mediated coupling between Ni-Mn-In and PZT layers. The ferroelectric measurement taken at different temperatures exhibits a well saturated and temperature dependent P-E loops with a highest value of P{sub sat}~55 μC/cm² obtained during martensite-austenite transition temperature region of Ni-Mn-In. The stress induced by Ni-Mn-In layer on upper PZT film due to structural transformation from martensite to austenite resulted in temperature modulated Tunability of PZT/Ni-Mn-In heterostructure. A tunability of 42% was achieved at 290 K (structural transition region of Ni-Mn-In) in these heterostructures. I-V measurements taken at different temperatures indicated that ohmic conduction was the main conduction mechanism over a large electric field range in these heterostructures. Magnetic measurement revealed that heterostructure was ferromagnetic at room temperature with a saturation magnetization of ~123 emu/cm³. Such multiferroic heterostructures exhibits promising applications in various microelectromechanical systems.

  13. Electrochemical transformation of thichloroethylene in groundwater by Ni-containing cathodes

    PubMed Central

    Rajic, Ljiljana; Fallahpour, Noushin; Oguzie, Emeka; Alshawabkeh, Akram

    2015-01-01

    In this study, we evaluate the use of different stainless steel (SS) materials as cost-effective cathode materials for electrochemical transformation of trichloroethylene (TCE) in contaminated groundwater. Ni, which is present in certain SS, has low hydrogen overpotential that promotes fast formation of atomic hydrogen and, therefore, its content can enhance hydrodechlorination (HDC). We a flow-through electrochemical reactor with a SS cathode followed by an anode. The performance of Ni containing foam cathodes (Fe/Ni and Ni foam) was also evaluated for electrochemical transformation of TCE in groundwater. SS type 316 (12% Ni) removed 61.7% of TCE compared to 52.6% removed by SS 304 (9.25% Ni) and 37.5% removed by SS 430 (0.75% Ni). Ni foam cathode produced the highest TCE removal rate (68.4%) compared with other cathodes. The slightly lower performance of SS type 316 mesh is balanced by the reduction in treatment costs for larger-scale systems. The results prove that Ni content in SS highly influences TCE removal rate. PMID:26538681

  14. Thermal modeling of NiH2 batteries

    NASA Technical Reports Server (NTRS)

    Ponthus, Agnes-Marie; Alexandre, Alain

    1994-01-01

    The following are discussed: NiH2 battery mission and environment; NiH2 cell heat dissipation; Nodal software; model development general philosophy; NiH2 battery model development; and NiH2 experimental developments.

  15. DSPRU Project at NSU: Evolution of Basic, Mantle-crust Granitoid Ore-magmatic Systems Resulting in Pt-Cu-Ni, Cu-Mo-porphiric and Epithermal Au-Ag Ore-bearing Mineralization.

    NASA Astrophysics Data System (ADS)

    Rakhmenkulova, I.; Sharapov, V.; Zhitova, L.

    2006-05-01

    Education and Human Resources are one of the most important priorities of the Russian Government policy nowadays. This work covers the principally new Project of the Ministry for Russian Science and Education: 'Development of Scientific Potential for Russian Universities' (DSPRU). The purposes of the Project are: 1) to involve university students to research in most urgent problems of fundamental science; 2) to enhance the professional development of Russian educators; 3) to interest the most perspective researches in education process at Russian universities; 4) to broaden the educational process involving to the Project foreign students, educators and researchers. All the State Universities in Russia could participate in the Project (with the exception of Moscow State University, whose employees were the Project experts). At Novosibirsk State University (NSU) research teams of 13 Departments applied for the Project. Only 5 Projects turned out to be successful. From the Department of Geology and Geophysics 9 Projects were applied and the only one won: 'Evolution of Basic, Mantle-crust Granitoid Ore-magmatic Systems Resulting in Pt-Cu-Ni, Cu-Mo-porphiric and Epithermal Au-Ag Ore-bearing Mineralization'. The team of the above-mentioned Project includes: - nine university educators - five researchers from the Institutes of Siberian Branch of Russian Academy of Sciences - four PhD students - eight undergraduate students. The expecting results of the Project are: 1) obtaining new data for natural objects covered by the Project (Siberia, Mongolia, China, South Africa, Morocco); 2) creation of mathematical models of evolution for fluid ore-magmatic systems of various geochemical character and productivity; 3) improving the education process at the Department of Geology and Geophysics of NSU (creation of new courses and publications, professional development of the educators, participation of students and young researchers in scientific conferences). The work was

  16. Comprehensive theoretical studies on the low-lying electronic states of NiF, NiCl, NiBr, and NiI.

    PubMed

    Zou, Wenli; Liu, Wenjian

    2006-04-21

    The low-lying electronic states of the nickel monohalides, i.e., NiF, NiCl, NiBr, and NiI, are investigated by using multireference second-order perturbation theory with relativistic effects taken into account. For the energetically lowest 11 lambda-S states and 26 omega states there into, the potential energy curves and corresponding spectroscopic constants (vertical and adiabatic excitation energies, equilibrium bond lengths, vibrational frequencies, and rotational constants) are reported. The calculated results are grossly in very good agreement with those solid experimental data. In particular, the ground state of NiI is shown to be different from those of NiF, NiCl, and NiBr, being in line with the recent experimental observation. Detailed analyses are provided on those states that either have not been assigned or have been incorrectly assigned by previous experiments.

  17. Monte Carlo simulation of specific heat of liquid Ni Mo alloys

    NASA Astrophysics Data System (ADS)

    Yao, W. J.; Wang, N.

    2008-11-01

    The Monte Carlo method with embedded-atom method (EAM) potential is applied to simulate the specific heat Cp of a liquid Ni-Mo binary alloy system. The simulated Cp value of liquid Ni at the melting temperature is 22.79 J mol-1 K-1, indicating that the simulation method and EAM parameters in simulation are acceptable. The simulated temperature coefficient of the specific heat for liquid Ni is -2.10 × 10-2 J mol-1 K-2. Based on the relationship between system energy and temperature, the various specific heats of liquid Ni-Mo alloys under different undercooling and compositions were determined. The dependence of the specific heat of liquid Ni-Mo alloys on the composition and undercooling is discussed.

  18. Eutectic bonding of a Ti sputter coated, carbon aerogel wafer to a Ni foil

    SciTech Connect

    Jankowski, A.F.; Hayes, J.P.; Kanna, R.L.

    1994-06-01

    The formation of high energy density, storage devices is achievable using composite material systems. Alternate layering of carbon aerogel wafers and Ni foils with rnicroporous separators is a prospective composite for capacitor applications. An inherent problem exists to form a physical bond between Ni and the porous carbon wafer. The bonding process must be limited to temperatures less than 1000{degrees}C, at which point the aerogel begins to degrade. The advantage of a low temperature eutectic in the Ni-Ti alloy system solves this problem. Ti, a carbide former, is readily adherent as a sputter deposited thin film onto the carbon wafer. A vacuum bonding process is then used to join the Ni foil and Ti coating through eutectic phase formation. The parameters required for successfld bonding are described along with a structural characterization of the Ni foil-carbon aerogel wafer interface.

  19. Interaction of Nickel and Manganese in Accumulation and Localization in Leaves of the Ni Hyperaccumulators Alyssum murale and Alyssum corsicum

    SciTech Connect

    Broadhurst, C.; Tappero, R; Maugel, T; Erbe, E; Sparks, D; Chaney, R

    2009-01-01

    The genus Alyssum contains >50 Ni hyperaccumulator species; many can achieve >2.5% Ni in dry leaf. In soils with normal Mn levels, Alyssum trichome bases were previously observed to accumulate Ni and Mn to high levels. Here we report concentration and localization patterns in A. murale and A. corsicum grown in soils with nonphytotoxic factorial additions of Ni and Mn salts. Four leaf type subsets based on size and age accumulated Ni and Mn similarly. The greatest Mn accumulation (10 times control) was observed in A. corsicum with 40 mmol Mn kg-1 and 40 mmol Ni kg-1 added to potting soil. Whole leaf Ni concentrations decreased as Mn increased. Synchrotron X-ray fluorescence mapping of whole fresh leaves showed localized in distinct high-concentration Mn spots associated with trichomes, Ni and Mn distributions were strongly spatially correlated. Standard X-ray fluorescence point analysis/mapping of cryofractured and freeze-dried samples found that Ni and Mn were co-located and strongly concentrated only in trichome bases and in cells adjacent to trichomes. Nickel concentration was also strongly spatially correlated with sulfur. Results indicate that maximum Ni phytoextraction by Alyssum may be reduced in soils with higher phytoavailable Mn, and suggest that Ni hyperaccumulation in Alyssum species may have developed from a Mn handling system.

  20. Determination of the “NiOOH” charge and discharge mechanisms at ideal activity

    SciTech Connect

    Merrill, Matthew; Worsley, Marcus; Wittstock, Arne; Biener, Juergen; Stadermann, Michael

    2014-01-24

    Here, optimization of electrodeposition conditions produced Ni(OH)2 deposits chargeable up to 1.84 ± 0.02 e per Ni on and the resulting nickel oxide/hydroxide active material could subsequently deliver 1.58 ± 0.02 e per Ni ion (462 mA h/g) over a potential range <0.2 V. The ability of the “NiOOH” active material to deliver an approximately ideal charge and discharge facilitated a coulometric and thermodynamic analysis through which the charge/discharge mechanisms were determined from known enthalpies of formation. The (dis)charge states were confirmed with in situ Raman spectroscopy. The mechanisms were additionally evaluated with respect to pH and potential dependence, charge quantities, hysteresis, and fluoride ion partial inhibition of the charge mechanism. The results indicate that the “NiOOH” (dis)charges as a solid-state system with mechanisms consistent with known nickel and oxygen redox reactions. A defect chemistry mechanism known for the LiNiO2 system also occurs for “NiOOH” to cause both high activity and hysteresis. Similar to other cation insertion nickel oxides, the activity of the “NiOOH” mechanism is predominantly due to oxygen redox activity and does not involve the Ni4+ oxidation state. The “NiOOH” was produced from cathodic electrodeposition of Ni(OH)2 from nickel nitrate solutions onto highly oriented pyrolytic graphite at ideal electrodeposition current efficiencies and the deposition mechanism was also characterized.

  1. Determination of the “NiOOH” charge and discharge mechanisms at ideal activity

    DOE PAGES

    Merrill, Matthew; Worsley, Marcus; Wittstock, Arne; Biener, Juergen; Stadermann, Michael

    2014-01-24

    Here, optimization of electrodeposition conditions produced Ni(OH)2 deposits chargeable up to 1.84 ± 0.02 e– per Ni on and the resulting nickel oxide/hydroxide active material could subsequently deliver 1.58 ± 0.02 e– per Ni ion (462 mA h/g) over a potential range <0.2 V. The ability of the “NiOOH” active material to deliver an approximately ideal charge and discharge facilitated a coulometric and thermodynamic analysis through which the charge/discharge mechanisms were determined from known enthalpies of formation. The (dis)charge states were confirmed with in situ Raman spectroscopy. The mechanisms were additionally evaluated with respect to pH and potential dependence, chargemore » quantities, hysteresis, and fluoride ion partial inhibition of the charge mechanism. The results indicate that the “NiOOH” (dis)charges as a solid-state system with mechanisms consistent with known nickel and oxygen redox reactions. A defect chemistry mechanism known for the LiNiO2 system also occurs for “NiOOH” to cause both high activity and hysteresis. Similar to other cation insertion nickel oxides, the activity of the “NiOOH” mechanism is predominantly due to oxygen redox activity and does not involve the Ni4+ oxidation state. The “NiOOH” was produced from cathodic electrodeposition of Ni(OH)2 from nickel nitrate solutions onto highly oriented pyrolytic graphite at ideal electrodeposition current efficiencies and the deposition mechanism was also characterized.« less

  2. Ternary Pt-Ru-Ni catalytic layers for methanol electrooxidation prepared by electrodeposition and galvanic replacement

    PubMed Central

    Papaderakis, Athanasios; Pliatsikas, Nikolaos; Prochaska, Chara; Papazisi, Kalliopi M.; Balomenou, Stella P.; Tsiplakides, Dimitrios; Patsalas, Panagiotis; Sotiropoulos, Sotiris

    2014-01-01

    Ternary Pt-Ru-Ni deposits on glassy carbon substrates, Pt-Ru(Ni)/GC, have been formed by initial electrodeposition of Ni layers onto glassy carbon electrodes, followed by their partial exchange for Pt and Ru, upon their immersion into equimolar solutions containing complex ions of the precious metals. The overall morphology and composition of the deposits has been studied by SEM microscopy and EDS spectroscopy. Continuous but nodular films have been confirmed, with a Pt ÷ Ru ÷ Ni % bulk atomic composition ratio of 37 ÷ 12 ÷ 51 (and for binary Pt-Ni control systems of 47 ÷ 53). Fine topographical details as well as film thickness have been directly recorded using AFM microscopy. The composition of the outer layers as well as the interactions of the three metals present have been studied by XPS spectroscopy and a Pt ÷ Ru ÷ Ni % surface atomic composition ratio of 61 ÷ 12 ÷ 27 (and for binary Pt-Ni control systems of 85 ÷ 15) has been found, indicating the enrichment of the outer layers in Pt; a shift of the Pt binding energy peaks to higher values was only observed in the presence of Ru and points to an electronic effect of Ru on Pt. The surface electrochemistry of the thus prepared Pt-Ru(Ni)/GC and Pt(Ni)/GC electrodes in deaerated acid solutions (studied by cyclic voltammetry) proves the existence of a shell consisting exclusively of Pt-Ru or Pt. The activity of the Pt-Ru(Ni) deposits toward methanol oxidation (studied by slow potential sweep voltammetry) is higher from that of the Pt(Ni) deposit and of pure Pt; this enhancement is attributed both to the well-known Ru synergistic effect due to the presence of its oxides but also (based on the XPS findings) to a modification effect of Pt electronic properties. PMID:24959530

  3. NMR studies on polyphosphide Ce6Ni6P17

    NASA Astrophysics Data System (ADS)

    Koyama, T.; Yamada, H.; Ueda, K.; Mito, T.; Aoyama, Y.; Nakano, T.; Takeda, N.

    2016-02-01

    We report the result of 31P nuclear magnetic resonance (NMR) studies on Ce6Ni6P17. The observed NMR spectra show a Lorentzian-type and an asymmetric shapes, reflecting the local symmetry around each P site in the cubic unit cell. We have identified the observed NMR lines corresponding to three inequivalent P sites and deduced the temperature dependence of the Knight shift for each site. The Knight shifts increase with decreasing temperature down to 1.5 K, indicating a localized spin system of Ce6Ni6P17. Antiferromagnetic correlation between 4f spins is suggested from the negative sign of the Weiss-temperature.

  4. The Te-ni-wo-ha: An Etymological Study.

    ERIC Educational Resources Information Center

    Jolly, Yukiko S.

    1972-01-01

    The designation of the Japanese word class "joshi" (in English known as particles, post-positional case markers, or relationals) by the term te-ni-wo-ha can be traced to the early superimposition of the Chinese writing system on Japanese speech. Because of the structural differences between the two languages and the existence of elements in…

  5. RAIRS observation of photoinduced dissociation of NO on Ni(111)

    NASA Astrophysics Data System (ADS)

    Magkoev, Tamerlan T.; Song, Moon-Bong; Fukutani, Katsuyuki; Murata, Yoshitada

    1995-06-01

    The properties of the {NO}/{Ni(111) } system under nanosecond ultraviolet laser light irradiation are studied by reflection absorption infrared spectroscopy. It is found that adsorbed NO molecules are dissociated by laser light. Dissociation proceeds effectively in a dilute NO layer, whereas it is suppressed in a saturated overlayer.

  6. Structure Properties of Ternary Hydrides Ni3AlHx

    NASA Astrophysics Data System (ADS)

    Pan, Yi-wei; Zhang, Wen-qing; Chen, Nan-xian

    1996-09-01

    The structure properties of the ternary hydrides Ni3AlHx are studied by use of the interatomic pair potentials obtained from the first principles electronic structure calculation and Chen-Mobius 3-dimensional lattice inversion method. The heat of formation and volume expansion of the hydrogenized systems are investigated.

  7. Hydrothermal Ni Prospectivity Analysis of Tasmania, Australia

    NASA Astrophysics Data System (ADS)

    Gonzalez-Alvalez, I.; Porwal, A.; McCuaig, T. C.

    2009-04-01

    Tasmania contains the largest hydrothermal Ni deposit in Australia: Avebury (118,000 Ni metal tonnes). This Devonian deposit was discovered in 1998 in the Dundas geological region, and represents an outstanding example of hydrothermal Nickel sulphide mineralization type. Avebury Ni deposit is a system of hydrothermal Ni ore bodies. It is hosted by an intensely altered and serpentinized Cambrian ultramafic suite in close proximity to major structural features. The mineralization is considered to be the result of hydrothermal scavenging and remobilization of the original nickel content of the mafic/ultramafic rocks in the area, and subsequent re-deposition in favourable structural traps. The mineralization is spatially and temporally related to a large granitic intrusion, the Heemskirk Granite, which is considered to be the source of the hydrothermal fluids as well as the necessary thermal gradients for the circulation of the fluids. Tasmania is largely covered by the Jurassic Ferrar Continental Flood basalt Province in the East and presents early Cambrian ultramafic-mafic complexes in the West. The Ferrar large igneous province (LIP) extends over to Antarctica and is related to the Karoo Province in southern Africa that comprises tholeiitic lava flows, sills, and dyke swarms. The Ferrar and Karoo provinces were associated with the same thermal anomaly that was involved in the break up of Gondwana. The presence of mafic/ultramafic rocks in favourable lithological packages and/or structural traps along the margins of the province, as well as several prospective reduced or reactive sedimentary packages within and around the Ferrar indicate that this LIP could represent a novel promising ground for Ni hydrothermal exploration. Based on this prospective geological background, a prospectivity analysis for hydrothermal Ni deposits was carried out on regional scale for the entire state of Tasmania. A conceptual model of hydrothermal nickel mineral system was used to

  8. Recycling Ni from Contaminated and Mineralized Soils.

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Rare plant species accumulate potentially valuable concentrations of some metals. Alyssum murale readily accumulates over 2% Ni in aboveground dry matter when grown on Ni-mineralized serpentine soils in Oregon, allowing production of “hay” biomass with at least 400 kg Ni ha-1 with low levels of fer...

  9. Evaluation of microcrack formation in root canals after instrumentation with different NiTi rotary file systems: a scanning electron microscopy study.

    PubMed

    Çiçek, Ersan; Koçak, Mustafa Murat; Sağlam, Baran Can; Koçak, Sibel

    2015-01-01

    The aim of this study was to evaluate the dentinal microcrack formation of ProTaper Universal, ProTaper Next, and WaveOne. Sixty extracted mandibular molars were selected. The mesial roots were resected and randomly divided into four groups (n = 15). The canals were prepared with hand files (group 1), ProTaper Universal (group 2), ProTaper Next (group 3), and WaveOne (group 4) instrument systems. The roots were separated horizontally at 3, 6, and 9 mm from the apex. Digital images were captured at ×40 magnification using scanning electron microscopy to detect microcrack formation. Statistical analysis was performed by Pearson Chi-square test. The prevalence of microcracks in group 2, group 3, and group 4 were significantly higher when compared to group 1 (p < 0.001). Group 2, group 3, and group 4 demonstrated similar prevalence of microcracks without significant difference (p > 0.05) in all sections. All instruments caused microcracks except for hand file. The highest percentage of microcrack was recorded in 3 mm section for all groups.

  10. Eruption combustion synthesis of NiO/Ni nanocomposites with enhanced properties for dye-absorption and lithium storage.

    PubMed

    Wen, Wei; Wu, Jin-Ming

    2011-10-01

    Large-scale energy-efficient productions of oxide nanoparticles are of great importance in energy and environmental applications. In nature, volcano eruptions create large amounts of volcano ashes within a short duration. Inspired by such phenomena, we report herein our first attempt to achieve an artificial volcano for mass productions of various oxide nanoparticles with enhanced properties for energy and environmental applications. The introduction of NaF into the solution combustion synthesis (SCS), which is a generally adopted synthetic route for mass productions of various oxide nanoparticles, results in better particle dispersity and a drastic increase in specific surface area compared to the conventional SCS. In a fixed dosage of NaF, a new eruption combustion pattern emerges, which may be contributed to the more gas evolution, lower apparent density, and weaker interparticle force. The novel eruption combustion pattern observed in SCS provides a versatile alternative for SCS to control combustion behavior, microstructure, and property of the products. NiO/Ni nanocomposite yielded by the new approach shows an ideal dye-absorption ability as well as lithium storage capacity. The new SCS pattern reported in this paper is versatile, emerging in various systems of Ni-Co-O, Co-O, La-O, Ni-Co-O, Zn-Co-O, and La-Ni-O.

  11. Eruption combustion synthesis of NiO/Ni nanocomposites with enhanced properties for dye-absorption and lithium storage.

    PubMed

    Wen, Wei; Wu, Jin-Ming

    2011-10-01

    Large-scale energy-efficient productions of oxide nanoparticles are of great importance in energy and environmental applications. In nature, volcano eruptions create large amounts of volcano ashes within a short duration. Inspired by such phenomena, we report herein our first attempt to achieve an artificial volcano for mass productions of various oxide nanoparticles with enhanced properties for energy and environmental applications. The introduction of NaF into the solution combustion synthesis (SCS), which is a generally adopted synthetic route for mass productions of various oxide nanoparticles, results in better particle dispersity and a drastic increase in specific surface area compared to the conventional SCS. In a fixed dosage of NaF, a new eruption combustion pattern emerges, which may be contributed to the more gas evolution, lower apparent density, and weaker interparticle force. The novel eruption combustion pattern observed in SCS provides a versatile alternative for SCS to control combustion behavior, microstructure, and property of the products. NiO/Ni nanocomposite yielded by the new approach shows an ideal dye-absorption ability as well as lithium storage capacity. The new SCS pattern reported in this paper is versatile, emerging in various systems of Ni-Co-O, Co-O, La-O, Ni-Co-O, Zn-Co-O, and La-Ni-O. PMID:21919510

  12. Solute pairing in solution-hardened Cu-Ni, Cu-Pd binary, and Cu-Ni-Pd ternary fcc alloys

    NASA Astrophysics Data System (ADS)

    Wong, Joe; Nixon, W. E.; Mitchell, J. W.; Laderman, S. S.

    1992-01-01

    The pairing of solute atoms in solution-hardened binary and ternary face-centered cubic (fcc) binary and ternary Cu alloys has been investigated with the EXAFS (extended x-ray-absorption fine structure) technique using synchrotron radiation. Two binary Cu alloys, one containing 6 at. % Ni and the other 6 at. % Pd and a ternary Cu alloy containing 3 at. % Ni and 3 at. % Pd alloy were studied. The solute concentration in each system was chosen below that (8.33 at. %) required for finding one solute-solute pair in the first coordination sphere in the fcc structure. Detailed simulations of the experimental EXAFS signal arising from the first coordination shell of the Ni and Pd solute atoms in these alloys give the following results: (i) In both binary and ternary alloys, Ni is coordinated by 12 Cu host atoms at a distance equal to sum of the Goldschmidt radii. There is little evidence for Ni-Ni pairing. (ii) On the other hand, Pd-Pd pairing is found in both the binary and ternary systems. In addition, chemical interaction with the Cu matrix is evident from the Pd-Cu separation of 2.60 Å which is ˜0.05 Å shorter than the sum of their Goldschmidt radii. (iii) Finally, there is no pairing of Ni-Pd solute atoms in the ternary alloy.

  13. El Niño and La Niña influence on droughts at different timescales in the Iberian Peninsula

    NASA Astrophysics Data System (ADS)

    Vicente-Serrano, Sergio M.

    2005-12-01

    This paper seeks to determine the impact of extreme phases of the Southern Oscillation (SO, El Niño/La Niña) on droughts in the Iberian Peninsula. For this purpose, 51 precipitation series (1910-2000) were used. A spatial classification based on monthly precipitation records was made to identify homogeneous regions and to analyze any spatial differences in the influence of these extreme phases. For each region a drought index was calculated (standardized precipitation index) at timescales of 1, 3, 6 and 12 months. El Niño and La Niña years were identified using the Southern Oscillation index (SOI), in line with studies conducted elsewhere. Mean values of the drought index were calculated each month for the four timescales during El Niño and La Niña years as well as for the year following these events. The statistical significance of any anomalies was evaluated by means of the nonparametric Wilcoxon Mann-Whitney test. The results indicate that extreme phases of the SO significantly affect the occurrence of droughts in the Iberian Peninsula. Moreover, spatial and temporal differences, depending on the timescale used, were identified. Large areas of the Iberian Peninsula are affected by significant negative values of SPI during the final months of La Niña years and the initial months of the following year. In contrast, other areas are affected by dry conditions during the first months of El Niño years as well as during the summers and autumns of the following year. The spatial differences in drought conditions during extreme phases of the SO are noticeable, and the drought signal is more consistent for La Niña than it is for El Niño years. Finally, the usefulness of these results for drought prediction and early warning systems is discussed.

  14. Kinetics of Ni sorption in soils: roles of soil organic matter and Ni precipitation.

    PubMed

    Shi, Zhenqing; Peltier, Edward; Sparks, Donald L

    2012-02-21

    The kinetics of Ni sorption to two Delaware agricultural soils were studied to quantitatively assess the relative importance of Ni adsorption on soil organic matter (SOM) and the formation of Ni layered double hydroxide (Ni-LDH) precipitates using both experimental studies and kinetic modeling. Batch sorption kinetic experiments were conducted with both soils at pH 6.0, 7.0, and 7.5 from 24 h up to 1 month. Time-resolved Ni speciation in soils was determined by X-ray absorption spectroscopy (XAS) during the kinetic experiments. A kinetics model was developed to describe Ni kinetic reactions under various reaction conditions and time scales, which integrated Ni adsorption on SOM with Ni-LDH precipitation in soils. The soil Ni speciation (adsorbed phases and Ni-LDH) calculated using the kinetics model was consistent with that obtained through XAS analysis during the sorption processes. Under our experimental conditions, both modeling and XAS results demonstrated that Ni adsorption on SOM was dominant in the short term and the formation of Ni-LDH precipitates accounted for the long-term Ni sequestration in soils, and, more interestingly, that the adsorbed Ni may slowly transfer to Ni-LDH phases with longer reaction times.

  15. Kinetics of Ni sorption in soils: roles of soil organic matter and Ni precipitation.

    PubMed

    Shi, Zhenqing; Peltier, Edward; Sparks, Donald L

    2012-02-21

    The kinetics of Ni sorption to two Delaware agricultural soils were studied to quantitatively assess the relative importance of Ni adsorption on soil organic matter (SOM) and the formation of Ni layered double hydroxide (Ni-LDH) precipitates using both experimental studies and kinetic modeling. Batch sorption kinetic experiments were conducted with both soils at pH 6.0, 7.0, and 7.5 from 24 h up to 1 month. Time-resolved Ni speciation in soils was determined by X-ray absorption spectroscopy (XAS) during the kinetic experiments. A kinetics model was developed to describe Ni kinetic reactions under various reaction conditions and time scales, which integrated Ni adsorption on SOM with Ni-LDH precipitation in soils. The soil Ni speciation (adsorbed phases and Ni-LDH) calculated using the kinetics model was consistent with that obtained through XAS analysis during the sorption processes. Under our experimental conditions, both modeling and XAS results demonstrated that Ni adsorption on SOM was dominant in the short term and the formation of Ni-LDH precipitates accounted for the long-term Ni sequestration in soils, and, more interestingly, that the adsorbed Ni may slowly transfer to Ni-LDH phases with longer reaction times. PMID:22283487

  16. Kinetics of Ni Sorption in Soils: Roles of Soil Organic Matter and Ni Precipitation

    SciTech Connect

    Shi, Zhenqing; Peltier, Edward; Sparks, Donald L.

    2012-12-10

    The kinetics of Ni sorption to two Delaware agricultural soils were studied to quantitatively assess the relative importance of Ni adsorption on soil organic matter (SOM) and the formation of Ni layered double hydroxide (Ni-LDH) precipitates using both experimental studies and kinetic modeling. Batch sorption kinetic experiments were conducted with both soils at pH 6.0, 7.0, and 7.5 from 24 h up to 1 month. Time-resolved Ni speciation in soils was determined by X-ray absorption spectroscopy (XAS) during the kinetic experiments. A kinetics model was developed to describe Ni kinetic reactions under various reaction conditions and time scales, which integrated Ni adsorption on SOM with Ni-LDH precipitation in soils. The soil Ni speciation (adsorbed phases and Ni-LDH) calculated using the kinetics model was consistent with that obtained through XAS analysis during the sorption processes. Under our experimental conditions, both modeling and XAS results demonstrated that Ni adsorption on SOM was dominant in the short term and the formation of Ni-LDH precipitates accounted for the long-term Ni sequestration in soils, and, more interestingly, that the adsorbed Ni may slowly transfer to Ni-LDH phases with longer reaction times.

  17. High thermoelectric performance in the multi-valley electronic system Zr{sub 3}Ni{sub 3−x}Co{sub x}Sb{sub 4} and the high-mobility Zr{sub 3}Ni{sub 3−x}Cu{sub x}Sb{sub 4}

    SciTech Connect

    Tamaki, H.; Kanno, T.; Sakai, A.; Takahashi, K.; Kusada, H.; Yamada, Y.

    2014-03-24

    We report synthesis and thermoelectric performance of the p-type Zr{sub 3}Ni{sub 3−x}Co{sub x}Sb{sub 4} and the n-type Zr{sub 3}Ni{sub 3−x}Cu{sub x}Sb{sub 4}, which are derived from the same parent semiconductor Zr{sub 3}Ni{sub 3}Sb{sub 4}. We found a high thermoelectric performance for both the p-type compound (the figure-of-merit ZT is 0.52 at 760 K) and the n-type compound (ZT = 0.41 at 670 K). ZT of the p-type compound exceeded the value of the p-type half-Heusler compounds consisting of similar elements. The Hall-coefficient measurements indicate that the high ZT in the n-type compounds is a consequence of the high electron mobility of 52.4 cm{sup 2}/Vs. In contrast, the p-type compounds showed higher ZT in spite of much lower mobility. We discuss the mechanism for the high ZT in the p-type compound from the viewpoint of the multi-valley band structure.

  18. Geographical distribution of the association between El Niño South Oscillation and dengue fever in the Americas: a continental analysis using geographical information system-based techniques.

    PubMed

    Ferreira, Marcos C

    2014-11-01

    El Niño South Oscillation (ENSO) is one climatic phenomenon related to the inter-annual variability of global meteorological patterns influencing sea surface temperature and rainfall variability. It influences human health indirectly through extreme temperature and moisture conditions that may accelerate the spread of some vector-borne viral diseases, like dengue fever (DF). This work examines the spatial distribution of association between ENSO and DF in the countries of the Americas during 1995-2004, which includes the 1997-1998 El Niño, one of the most important climatic events of 20(th) century. Data regarding the South Oscillation index (SOI), indicating El Niño-La Niña activity, were obtained from Australian Bureau of Meteorology. The annual DF incidence (AIy) by country was computed using Pan-American Health Association data. SOI and AIy values were standardised as deviations from the mean and plotted in bars-line graphics. The regression coefficient values between SOI and AIy (rSOI,AI) were calculated and spatially interpolated by an inverse distance weighted algorithm. The results indicate that among the five years registering high number of cases (1998, 2002, 2001, 2003 and 1997), four had El Niño activity. In the southern hemisphere, the annual spatial weighted mean centre of epidemics moved southward, from 6° 31' S in 1995 to 21° 12' S in 1999 and the rSOI,AI values were negative in Cuba, Belize, Guyana and Costa Rica, indicating a synchrony between higher DF incidence rates and a higher El Niño activity. The rSOI,AI map allows visualisation of a graded surface with higher values of ENSO-DF associations for Mexico, Central America, northern Caribbean islands and the extreme north-northwest of South America.

  19. Ni-Supported Pd Nanoparticles with Ca Promoter: A New Catalyst for Low-Temperature Ammonia Cracking

    PubMed Central

    Polanski, Jaroslaw; Bartczak, Piotr; Ambrozkiewicz, Weronika; Sitko, Rafal; Siudyga, Tomasz; Mianowski, Andrzej; Szade, Jacek; Balin, Katarzyna; Lelątko, Józef

    2015-01-01

    In this paper we report a new nanometallic, self-activating catalyst, namely, Ni-supported Pd nanoparticles (PdNPs/Ni) for low temperature ammonia cracking, which was prepared using a novel approach involving the transfer of nanoparticles from the intermediate carrier, i.e. nano-spherical SiO2, to the target carrier technical grade Ni (t-Ni) or high purity Ni (p-Ni) grains. The method that was developed allows a uniform nanoparticle size distribution (4,4±0.8 nm) to be obtained. Unexpectedly, the t-Ni-supported Pd NPs, which seemed to have a surface Ca impurity, appeared to be more active than the Ca-free (p-Ni) system. A comparison of the novel PdNPs/Ni catalyst with these reported in the literature clearly indicates the much better hydrogen productivity of the new system, which seems to be a highly efficient, flexible and durable catalyst for gas-phase heterogeneous ammonia cracking in which the TOF reaches a value of 2615 mmolH2/gPd min (10,570 molNH3/molPd(NP) h) at 600°C under a flow of 12 dm3/h (t-Ni). PMID:26308929

  20. Binary and ternary NiTi-based shape memory films deposited by simultaneous sputter deposition from elemental targets

    SciTech Connect

    Sanjabi, S.; Cao, Y.Z.; Sadrnezhaad, S.K.; Barber, Z.H.

    2005-09-15

    The most challenging requirement for depositing NiTi-based shape memory thin films is the control of film composition because a small deviation can strongly shift the transformation temperatures. This article presents a technique to control film composition via adjustment of the power supplied to the targets during simultaneous sputter deposition from separate Ni, Ti, and X (e.g., Hf) targets. After optimization of sputter parameters such as working gas pressure, target-substrate distance, and target power ratio, binary Ni{sub 100-x}Ti{sub x} thin films were fabricated and characterized by energy dispersive x-ray spectroscopy in a scanning electron microscope (to measure the film composition and uniformity), in situ x-ray diffraction (to identify the phase structures), and differential scanning calorimetry (to indicate the transformation and crystallization temperatures). To explore the possibility of depositing ternary shape memory NiTi-based thin films with a high temperature transformation >100 deg. C, a Hf target was added to the NiTi deposition system. Annealing was carried out in a high vacuum furnace slightly above the films' crystallization temperatures (500 and 550 deg. C for NiTi and NiTiHf films, respectively). Differential scanning calorimetry (DSC) results of free-standing films illustrated the dependence of transformation temperatures on film composition: Ap and Mp (referring to the austenitic and martensitic peaks in the DSC curve) were above room temperature in near equiatomic NiTi and Ti-rich films, but below it in Ni-rich films. In NiTiHf films, the transformation temperatures were a function of Hf content, reaching as high as 414 deg. C (Ap) at a Hf content of 24.4 at. %. Atomic force microscopy revealed nanostructure surface morphology of both NiTi and NiTiHf films. Detailed characterization showed that the film properties were comparable with those of NiTi and NiTiHf bulk alloys.

  1. Precipitation of heusler phase (Ni2TiAl) from B2-TiNi in Ni-Ti-Al and Ni-Ti-Al-X (X=Hf, Zr) alloys

    NASA Astrophysics Data System (ADS)

    Jung, J.; Ghosh, G.; Isheim, D.; Olson, G. B.

    2003-06-01

    The precipitation of Heusler phase (L21: Ni2TiAl) from a supersaturated B2 (TiNi-based) matrix at 600°C and 800°C is studied using transmission electron microscopy (TEM), analytical electron microscopy (AEM), and three-dimensional atom-probe (3DAP) microscopy in Ni-Ti-Al and Ni-Ti-Al-X (X=Hf and Zr) alloys. The B2/L21 two-phase system, with ordered structures based on the bcc lattice, is chosen for its microstructural analogy to the classical γ/ γ' system with an fcc lattice. Knowledge of the temperature-dependent partitioning of alloying elements and their atomic volumes in the B2-TiNi and L21 phases is desired to support design of high-performance shape-memory alloys (SMAs) with controlled misfit strain and transformation temperatures. After aging at 600°C for up to 2000 hours, the L21 precipitates remain fully coherent at a particle diameter of ˜20 nm. The observed effects of a misfit strain of -1.9 pct on the microstructure of the B2/L21 system are similar to those theoretically predicted and experimentally observed for the γ/ γ' system. The similarities are demonstrated in terms of the precipitate shape, spatial distribution, and minimum distance of separation between L21 precipitates. However, all these effects disappear after aging the alloys at 800°C for 1000 hours, when the L21 precipitates become semicoherent at particle diameters above ˜400 nm. A simple analysis of the size evolution of L21 precipitates after an isochronal aging (1000 hours) experiment suggests that they follow coarsening kinetics at 600°C and growth kinetics at 800°C, consistent with the Langer-Schwartz theory of precipitation kinetics, which predicts that a high supersaturation suppresses the growth regime. Microanalysis using AEM and 3DAP microscopy define the TiNi-Ni2TiAl phase boundaries at 800°C and 600°C. At 800°C, Hf and Zr partition to the B2-TiNi, while at 600°C, they partition slightly to the L21 phase, reducing the lattice misfit to -1.7 and -0.011 pct

  2. Discriminating different El Niño and La Niña phases from evolving climate networks

    NASA Astrophysics Data System (ADS)

    Wiedermann, Marc; Radebach, Alexander; Donges, Jonathan F.; Kurths, Jürgen; Donner, Reik V.

    2016-04-01

    The variability of the El Niño Southern Oscillation (ENSO) can roughly be categorized into El Niño (anomalously warm), La Niña (anomalously cold) and normal periods. Additionally, at least the El Niño exhibits into two different types (Eastern Pacific (EP) and central Pacific (CP)), which may be distinguished from each other by different signatures in the Pacific sea surface temperature field. However, up to now no generally applicable criterion to distinguish these different phases has been introduced. We present here a method based on complex network analysis to distinguish these EP and CP events by utilizing a simple scalar-valued measure (the so-called climate network transitivity) related to the third power of the cross-correlation matrix between grid points in a daily global surface air temperature field. From a one-year running window analysis we obtain the time-evolution of this measure and show that during EP events it displays a strong peak, whereas its value during CP events is close to the baseline formed by normal periods. This behavior is easily understood from the different impacts on the global climate system displayed by the two different El Niño flavors as well as the high synchronization of Pacific sea-surface temperatures during El Niño events. We compare our results with recent works on El Niño classifications and find that for the years 1970-2000 (the main time interval covered by most past studies) our method distinguishes correctly all existing events. By performing a network-based dimensionality reduction of the correlation matrix, we show that our findings also display high consistency with works that applied EOF analysis as a tool to discriminate between both El Niño flavors. Ultimately, we apply our framework to La Niña events and show that a similar discrimination into two types is not only possible but again in good accordance with the few existing previous works regarding this problem. Our framework provides a powerful

  3. Discriminating different El Niño and La Niña phases by evolving climate networks

    NASA Astrophysics Data System (ADS)

    Wiedermann, Marc; Radebach, Alexander; Donner, Reik V.; Donges, Jonathan F.; Kurths, Jürgen

    2015-04-01

    The El Niño Southern Oscillation (ENSO) can be observed, for example, in terms of surface air temperature anomalies in the Central and East Pacific Ocean and has a large impact on the global climate system. Its variability can roughly be categorized into El Niño (anomalously warm), La Niña (anomalously cold) and normal periods. In addition, the El Niño exhibits into two different types (Eastern-Pacific (EP) and central-Pacific (CP) type) which may be distinguished from each other by different signatures in the first empirical orthogonal function (EOF) computed over the respective years of its appearance. A similar proposition has been made recently regarding the existence of two different types of La Niña phases [1]. However, no generally applicable criterion to distinguish these different phases has been introduced so far. Here, we construct time-evolving climate networks from anomalized daily global surface air temperature fields and investigate the dynamics of their structural properties. For the El Niño phases, global network measures have been shown to naturally discriminate between the presence of EP and CP type [2]. Local network measures found during either of the two periods show high similarity with the results from classical EOF analysis with respect to their spatial patterns which strongly depend on the El Niño type. If the same concept is applied to La Niña periods, we find that an analogous categorization of events into two types is possible. Here, the spatial patterns of local network measures prove to be equivalent to those found for El Niño events. Our findings imply that each of the four different types of ENSO events displays unique signatures in the SAT field's correlation structure, which can be discriminated objectively with the tools of complex network theory at hand. Our findings demonstrate that evolving climate networks provide a powerful formalism to systematically detect and categorize different types of ENSO periods while at

  4. Scalable synthesis of urchin- and flowerlike hierarchical NiO microspheres and their electrochemical property for lithium storage.

    PubMed

    Pan, Jia Hong; Huang, Qizhao; Koh, Zhen Yu; Neo, Darren; Wang, Xing Zhu; Wang, Qing

    2013-07-10

    A nickel salt-urea-H2O ternary system has been developed for the large-scale synthesis of hierarchical α-Ni(OH)2 microspheres, the solid precursor for the subsequent topotactic transition to NiO upon calcination. In this facile synthetic system, hierarchical structure is self-assembled under the cooperative direction of urea and anions in nickel salts. Thus, simply tuning the Ni salts leads to the selective construction of urchin and flowerlike hierarchical α-Ni(OH)2 and NiO microspheres consisting of radial 1D nanowires and 2D nanoplates, respectively. The obtained NiO microspheres possessing accessible nanopores, excellent structural stability and large surface area up to 130 m(2)/g show promising electrochemical performance in anodic lithium storage for lithium-ion battery. PMID:23751248

  5. Defect Structure of Beta NiAl Using the BFS Method for Alloys

    NASA Technical Reports Server (NTRS)

    Bozzolo, Guillermo; Amador, Carlos; Ferrante, John; Noebe, Ronald D.

    1996-01-01

    The semiempirical BFS method for alloys is generalized by replacing experimental input with first-principles results thus allowing for the study of complex systems. In order to examine trends and behavior of a system in the vicinity of a given point of the phase diagram a search procedure based on a sampling of selected configurations is employed. This new approach is applied to the study of the beta phase of the Ni-Al system, which exists over a range of composition from 45-60 at.% Ni. This methodology results in a straightforward and economical way of reproducing and understanding the basic features of this system. At the stoichiometric composition, NiAl should exist in a perfectly ordered B2 structure. Ni-rich alloys are characterized by antisite point defects (with Ni atoms in the Al sites) with a decrease in lattice parameters. On the Al-rich side of stoichiometry there is a steep decrease in lattice parameter and density with increasing Al content. The presence of vacancies in Ni sites would explain such behavior. Recent X-ray diffraction experiments suggest a richer structure: the evidence, while strongly favoring the presence of vacancies in Ni sites, also suggests the possibility of some vacancies in Al sites in a 3:1 ratio. Moreover, local ordering of vacant sites may be preferred over a random distribution of individual point defects.

  6. Magnum(R) NiCd advanced nickel-cadmium battery cells

    NASA Technical Reports Server (NTRS)

    Scoles, Darren

    1995-01-01

    The Power Systems Department of Eagle-Picher Industries, Inc., located in Colorado Springs, Colorado, had developed a long-life advanced Nickel-Cadmium battery cell for aerospace applications. This battery cell, known as the MAGNUM NiCd cell, offers significant life expectancy increase over traditional NiCd battery cells. In addition, it offers significant cost reduction from the Super NiCd battery cell (developed by Hughes Aircraft Company and manufactured by the Power Systems Department of Eagle-Picher Industries, Inc.).

  7. Modulus measurements in ordered Co-Al, Fe-Al, and Ni-Al alloys

    NASA Technical Reports Server (NTRS)

    Harmouche, M. R.; Wolfenden, A.

    1985-01-01

    The composition and/or temperature dependence of the dynamic Young's modulus for the ordered B2 Co-Al, Fe-Al, and Ni-Al aluminides has been investigated using the piezoelectric ultrasonic composite oscillator technique (PUCOT). The modulus has been measured in the composition interval 48.49 to 52.58 at. pct Co, 50.87 to 60.2 at. pct Fe, and 49.22 to 55.95 at. pct Ni for Co-Al, Fe-Al, and Ni-Al, respectively. The measured values for Co-Al are in the temperature interval 300 to 1300 K, while those for the other systems are for ambient temperature only. The data points show that Co-Al is stiffer than Fe-Al, which is stiffer than Ni-Al. The data points for Fe-Al and Ni-Al are slightly higher than those reported in the literature.

  8. Structural response of Ni/ZrO2 to feed modulations during CH4 reforming reactions

    NASA Astrophysics Data System (ADS)

    Steib, M.; Jentys, A.; Lercher, J. A.

    2016-05-01

    Time resolved oxidation and reduction cycles of ZrO2-supported Ni catalysts for dry reforming of CH4 (CO2 + CH4 ↔ 2 CO + 2 H2) during feed modulations have been studied. Under reaction conditions (1073 K) Ni remains fully reduced, whereas switching the feed gas to pure CO2 results in a slow (25 sec) formation of a stable NiO phase. When switching back to reaction conditions the NiO phase is rapidly reduced (∼ 1 sec) to metallic Ni. In the context of this study, a novel capillary cell has been built, allowing the parallel treatment of 5 catalyst samples with different gas compositions and different pressures. A comparison of the capillary cell to conventional systems regarding the spectral quality and the kinetic data shows that the capillary cell can be used to obtain identical kinetic data and high quality X-ray absorption spectra.

  9. Early ⁵⁶Ni decay gamma rays from SN2014J suggest an unusual explosion.

    PubMed

    Diehl, Roland; Siegert, Thomas; Hillebrandt, Wolfgang; Grebenev, Sergei A; Greiner, Jochen; Krause, Martin; Kromer, Markus; Maeda, Keiichi; Röpke, Friedrich; Taubenberger, Stefan

    2014-09-01

    Type Ia supernovae result from binary systems that include a carbon-oxygen white dwarf, and these thermonuclear explosions typically produce 0.5 solar mass of radioactive (56)Ni. The (56)Ni is commonly believed to be buried deeply in the expanding supernova cloud. In SN2014J, we detected the lines at 158 and 812 kiloelectron volts from (56)Ni decay (time ~8.8 days) earlier than the expected several-week time scale, only ~20 days after the explosion and with flux levels corresponding to roughly 10% of the total expected amount of (56)Ni. Some mechanism must break the spherical symmetry of the supernova and at the same time create a major amount of (56)Ni at the outskirts. A plausible explanation is that a belt of helium from the companion star is accreted by the white dwarf, where this material explodes and then triggers the supernova event.

  10. Early ⁵⁶Ni decay gamma rays from SN2014J suggest an unusual explosion.

    PubMed

    Diehl, Roland; Siegert, Thomas; Hillebrandt, Wolfgang; Grebenev, Sergei A; Greiner, Jochen; Krause, Martin; Kromer, Markus; Maeda, Keiichi; Röpke, Friedrich; Taubenberger, Stefan

    2014-09-01

    Type Ia supernovae result from binary systems that include a carbon-oxygen white dwarf, and these thermonuclear explosions typically produce 0.5 solar mass of radioactive (56)Ni. The (56)Ni is commonly believed to be buried deeply in the expanding supernova cloud. In SN2014J, we detected the lines at 158 and 812 kiloelectron volts from (56)Ni decay (time ~8.8 days) earlier than the expected several-week time scale, only ~20 days after the explosion and with flux levels corresponding to roughly 10% of the total expected amount of (56)Ni. Some mechanism must break the spherical symmetry of the supernova and at the same time create a major amount of (56)Ni at the outskirts. A plausible explanation is that a belt of helium from the companion star is accreted by the white dwarf, where this material explodes and then triggers the supernova event. PMID:25081484

  11. Emergence of El Niño as an autonomous component in the climate network.

    PubMed

    Gozolchiani, A; Havlin, S; Yamasaki, K

    2011-09-30

    We construct and analyze a climate network which represents the interdependent structure of the climate in different geographical zones and find that the network responds in a unique way to El Niño events. Analyzing the dynamics of the climate network shows that when El Niño events begin, the El Niño basin partially loses its influence on its surroundings. After typically three months, this influence is restored while the basin loses almost all dependence on its surroundings and becomes autonomous. The formation of an autonomous basin is the missing link to understand the seemingly contradicting phenomena of the afore-noticed weakening of the interdependencies in the climate network during El Niño and the known impact of the anomalies inside the El Niño basin on the global climate system.

  12. Emergence of El Niño as an Autonomous Component in the Climate Network

    NASA Astrophysics Data System (ADS)

    Gozolchiani, A.; Havlin, S.; Yamasaki, K.

    2011-09-01

    We construct and analyze a climate network which represents the interdependent structure of the climate in different geographical zones and find that the network responds in a unique way to El Niño events. Analyzing the dynamics of the climate network shows that when El Niño events begin, the El Niño basin partially loses its influence on its surroundings. After typically three months, this influence is restored while the basin loses almost all dependence on its surroundings and becomes autonomous. The formation of an autonomous basin is the missing link to understand the seemingly contradicting phenomena of the afore-noticed weakening of the interdependencies in the climate network during El Niño and the known impact of the anomalies inside the El Niño basin on the global climate system.

  13. Long-term (30 days) toxicity of NiO nanoparticles for adult zebrafish Danio rerio

    PubMed Central

    Kovrižnych, Jevgenij A.; Zeljenková, Dagmar; Rollerová, Eva; Szabová, Elena

    2014-01-01

    Nickel oxide in the form of nanoparticles (NiO NPs) is extensively used in different industrial branches. In a test on adult zebrafish, the acute toxicity of NiO NPs was shown to be low, however longlasting contact with this compound can lead to its accumulation in the tissues and to increased toxicity. In this work we determined the 30-day toxicity of NiO NPs using a static test for zebrafish Danio rerio. We found the 30-day LC50 value to be 45.0 mg/L, LC100 (minimum concentration causing 100% mortality) was 100.0 mg/L, and LC0 (maximum concentration causing no mortality) was 6.25 mg/L for adult individuals of zebrafish. Considering a broad use of Ni in the industry, NiO NPs chronic toxicity may have a negative impact on the population of aquatic organisms and on food web dynamics in aquatic systems. PMID:26038672

  14. Microstructure and Thermal Analysis of As-Cast Ag-Bi-Ni alloys

    NASA Astrophysics Data System (ADS)

    Fima, Przemyslaw; Garzel, Grzegorz; Berent, Katarzyna

    2016-01-01

    The calculated liquidus projection of the Ag-Bi-Ni ternary system has been experimentally examined. Alloys were prepared by induction melting, and their microstructure studied by scanning electron microscopy coupled with energy dispersive x-ray spectroscopy. Of the primary solidification phases, (Ni) solidifies over the largest concentration range, although it was found to be narrower than calculated. The range in which Bi3Ni is the primary solidification phase was found to be broader than calculated. Also, the liquid miscibility gap is broader than predicted from assessed thermodynamic parameters. Differential thermal analysis was used to study temperatures of phase transitions of as-cast alloys, and recorded temperatures of melting of Bi3Ni and BiNi phases in ternary alloys agree well with those calculated.

  15. California Niño/Niña

    PubMed Central

    Yuan, Chaoxia; Yamagata, Toshio

    2014-01-01

    The present study shows the existence of intrinsic coastal air-sea coupled phenomenon in the coastal ocean off Baja California and California in boreal summer for the first time. It contributes significantly to the interannual sea surface temperature (SST) anomalies there. An initial decrease/increase in the equatorward alongshore surface winds weakens/strengthens the coastal upwelling and raises/lowers the coastal SSTs through oceanic mixed-layer processes. The resultant coastal warming/cooling, in turn, heats/cools the overlying atmosphere anomalously, decreases/increases the atmospheric pressure in the lower troposphere, generates an anomalous cross-shore pressure gradient, and thus reinforces or maintains the alongshore surface wind anomalies. The regional air-sea coupled phenomenon seems to be analogous to the well-known El Niño/Southern Oscillation (ENSO) in the tropical Pacific but with much smaller time and space scales, and may be referred to as California Niño/Niña in its intrinsic sense. PMID:24763062

  16. Exploring the influence of transfer channels on fusion reactions: The case of 40 Ca + 58,64 Ni

    DOE PAGES

    Bourgin, D.; Courtin, S.; Haas, F.; Goasduff, A.; Stefanini, A. M.; Montagnoli, G.; Montanari, D.; Corradi, L.; Huiming, J.; Scarlassara, F.; et al

    2015-01-29

    Fusion cross sections have been measured in the 40Ca + 58Ni and 40Ca + 64Ni systems at beam energies ranging from Elab = 104.75 MeV to 153.5 MeV using the Laboratori Nazionali di Legnaro electrostatic deflector. Distributions of barriers have been extracted from the experimental data. Preliminary coupled channel calculations were performed and hints of effects of neutron transfers on the fusion below the barrier in the 40Ca + 64Ni are discussed.

  17. Effect of phosphate and sulfate on Ni repartitioning during Fe(II)-catalyzed Fe(III) oxide mineral recrystallization

    NASA Astrophysics Data System (ADS)

    Hinkle, Margaret A. G.; Catalano, Jeffrey G.

    2015-09-01

    Dissolved Fe(II) activates coupled oxidative growth and reductive dissolution of Fe(III) oxide minerals, causing recrystallization and the repartitioning of structurally-compatible trace metals. Phosphate and sulfate, two ligands common to natural aquatic systems, alter Fe(II) adsorption onto Fe(III) oxides and affect Fe(III) oxide dissolution and precipitation. However, the effect of these oxoanions on trace metal repartitioning during Fe(II)-catalyzed Fe(III) oxide recrystallization is unclear. The effects of phosphate and sulfate on Ni adsorption and Ni repartitioning during Fe(II)-catalyzed Fe(III) oxide recrystallization were investigated as such repartitioning may be affected by both Fe(II)-oxoanion and metal-oxoanion interactions. In most systems examined, phosphate alters Ni repartitioning during Fe(II)-catalyzed recrystallization to a larger extent than sulfate. Phosphate substantially enhances Ni adsorption onto hematite but decreases (nearly inhibiting) Fe(II)-catalyzed Ni incorporation into and release from this mineral. In the goethite system, however, phosphate suppresses Ni release but enhances Ni incorporation in the presence of aqueous Fe(II). In contrast, sulfate has little effect on macroscopic Ni adsorption and release of Ni from Fe(III) oxides, but substantially enhances Ni incorporation into goethite. This demonstrates that phosphate and sulfate have unique, mineral-specific interactions with Ni during Fe(II)-catalyzed Fe(III) oxide recrystallization. This research suggests that micronutrient bioavailability at redox interfaces in hematite-dominated systems may be especially suppressed by phosphate, while both oxoanions likely have limited effects in goethite-rich soils or sediments. Phosphate may also exert a large control on contaminant fate at redox interfaces, increasing Ni retention on iron oxide surfaces. These results further indicate that trace metal retention by iron oxides during lithification and later repartitioning during

  18. Smear layer and debris removal using manual Ni-Ti files compared with rotary Protaper Ni- Ti files - An In-Vitro SEM study

    PubMed Central

    Reddy, J M V Raghavendra; Latha, Prasanna; Gowda, Basavana; Manvikar, Varadendra; Vijayalaxmi, D Benal; Ponangi, Kalyana Chakravarthi

    2014-01-01

    Background: Predictable successful endodontic therapy depends on correct diagnosis, effective cleaning, shaping and disinfection of the root canals and adequate obturation. Irrigation serves as a flush to remove debris, tissue solvent and lubricant from the canal irregularities; however these irregularities can restrict the complete debridement of root canal by mechanical instrumentation.Various types of hand and rotary instruments are used for the preparation of the root canal system to obtain debris free canals. The purpose of this study was to evaluate the amount of smear layer and debris removal on canal walls following the using of manual Nickel-Titanium (NiTi) files compared with rotary ProTaperNiTi files using a Scanning Electron Microscope in two individual groups. Materials & Methods: A comparative study consisting of 50 subjects randomized into two groups – 25 subjects in Group A (manual) and 25 subjects in Group B (rotary) was undertaken to investigate and compare the effects of smear layer and debris between manual and rotary NiTi instruments. Chi square test was used to find the significance of smear layer and debris removal in the coronal, middle and apical between Group A and Group B. Results: Both systems of Rotary ProTaperNiTi and manual NiTi files used in the present study, did not create completely clean root canals. Manual NiTi files produced significantly less smear layer and debris compared to Rotary ProTaperNiTi instruments. Rotary instruments were less time consuming when compared to manual instruments. Instrument separation was not found to be significant with both the groups. Conclusions: Both systems of Rotary ProTaperNiTi and manual NiTi files used did not produce completely clean root canals. Manual NiTi files produced significantly less smear layer and debris compared to Rotary protaper instruments. How to cite the article: Reddy JM, Latha P, Gowda B, Manvikar V, Vijayalaxmi DB, Ponangi KC. Smear layer and debris removal using manual

  19. Difference in charge transport properties of Ni-Nb thin films with native and artificial oxide

    SciTech Connect

    Trifonov, A. S.; Lubenchenko, A. V.; Polkin, V. I.; Pavolotsky, A. B.; Ketov, S. V.; Louzguine-Luzgin, D. V.

    2015-03-28

    Here, we report on the properties of native and artificial oxide amorphous thin film on a surface of an amorphous Ni-Nb sample. Careful measurements of local current-voltage characteristics of the system Ni-Nb / NiNb oxide/Pt, were carried out in contact mode of an atomic force microscope. Native oxide showed n-type conductivity, while in the artificial one exhibited p-type one. The shape of current-voltage characteristic curves is unique in both cases and no analogical behavior is found in the literature. X-ray photoelectron spectroscopy (XPS) measurements were used to detect chemical composition of the oxide films and the oxidation state of the alloy components. Detailed analysis of the XPS data revealed that the structure of natural Ni-Nb oxide film consists of Ni-NbO{sub x} top layer and nickel enriched bottom layer which provides n-type conductivity. In contrast, in the artificial oxide film Nb is oxidized completely to Nb{sub 2}O{sub 5}, Ni atoms migrate into bulk Ni-Nb matrix. Electron depletion layer is formed at the Ni-Nb/Nb{sub 2}O{sub 5} interface providing p-type conductivity.

  20. Effect of carbon on the Ni catalyzed methane cracking reaction: A DFT study

    NASA Astrophysics Data System (ADS)

    Li, Jingde; Croiset, Eric; Ricardez-Sandoval, Luis

    2014-08-01

    To understand the effects of carbon atoms on the Ni catalyzed methane cracking reactions, methane dissociation on clean, surface-carbon-covered, and subsurface-carbon-accumulated Ni(1 1 1) surfaces were investigated using density functional theory (DFT). The results show that the existence of surface and subsurface C atoms destabilized the adsorption of the surface hydrocarbon species when compared to the clean Ni(1 1 1) surface. The projected density state (PDOS) analysis shows that the deposition of C atoms on and into the Ni surface modified the electronic structure of the Ni surface, and thus reduced the catalytic activity of the bonded Ni atoms. Moreover, it was found that the presence carbon atoms increase the CHx (x = 4-1) species activation barriers especially on the surface carbon covered (1/4 ML) Ni(1 1 1) surface, where CHx (x = 4-1) species encounter highest energy barrier for dissociation due to the electronic deactivation induced by Csbnd Ni bonding and the strong repulsive carbon sbnd CHx interaction. The calculations also show that CHx dissociation barriers are not affected by its neighboring C atom at low surface carbon coverage (1/9 ML). This work can be used to estimate more realistic kinetic parameters for this system.

  1. Control of Surface Segregation in Bimetallic NiCr Nanoalloys Immersed in Ag Matrix

    PubMed Central

    Bohra, Murtaza; Singh, Vidyadhar; Grammatikopoulos, Panagiotis; Toulkeridou, Evropi; Diaz, Rosa E.; Bobo, Jean-François; Sowwan, Mukhles

    2016-01-01

    Cr-surface segregation is a main roadblock encumbering many magneto-biomedical applications of bimetallic M-Cr nanoalloys (where M = Fe, Co and Ni). To overcome this problem, we developed Ni95Cr5:Ag nanocomposite as a model system, consisting of non-interacting Ni95Cr5 nanoalloys (5 ± 1 nm) immersed in non-magnetic Ag matrix by controlled simultaneous co-sputtering of Ni95Cr5 and Ag. We employed Curie temperature (TC) as an indicator of phase purity check of these nanocomposites, which is estimated to be around the bulk Ni95Cr5 value of 320 K. This confirms prevention of Cr-segregation and also entails effective control of surface oxidation. Compared to Cr-segregated Ni95Cr5 nanoalloy films and nanoclusters, we did not observe any unwanted magnetic effects such as presence Cr-antiferromagnetic transition, large non-saturation, exchange bias behavior (if any) or uncompensated higher TC values. These nanocomposites films also lose their unique magnetic properties only at elevated temperatures beyond application requirements (≥800 K), either by showing Ni-type behavior or by a complete conversion into Ni/Cr-oxides in vacuum and air environment, respectively. PMID:26750659

  2. Control of Surface Segregation in Bimetallic NiCr Nanoalloys Immersed in Ag Matrix

    NASA Astrophysics Data System (ADS)

    Bohra, Murtaza; Singh, Vidyadhar; Grammatikopoulos, Panagiotis; Toulkeridou, Evropi; Diaz, Rosa E.; Bobo, Jean-François; Sowwan, Mukhles

    2016-01-01

    Cr-surface segregation is a main roadblock encumbering many magneto-biomedical applications of bimetallic M-Cr nanoalloys (where M = Fe, Co and Ni). To overcome this problem, we developed Ni95Cr5:Ag nanocomposite as a model system, consisting of non-interacting Ni95Cr5 nanoalloys (5 ± 1 nm) immersed in non-magnetic Ag matrix by controlled simultaneous co-sputtering of Ni95Cr5 and Ag. We employed Curie temperature (TC) as an indicator of phase purity check of these nanocomposites, which is estimated to be around the bulk Ni95Cr5 value of 320 K. This confirms prevention of Cr-segregation and also entails effective control of surface oxidation. Compared to Cr-segregated Ni95Cr5 nanoalloy films and nanoclusters, we did not observe any unwanted magnetic effects such as presence Cr-antiferromagnetic transition, large non-saturation, exchange bias behavior (if any) or uncompensated higher TC values. These nanocomposites films also lose their unique magnetic properties only at elevated temperatures beyond application requirements (≥800 K), either by showing Ni-type behavior or by a complete conversion into Ni/Cr-oxides in vacuum and air environment, respectively.

  3. Ultra-separation of nickel from copper metal for the measurement of 63Ni by AMS

    NASA Astrophysics Data System (ADS)

    Marchetti, A. A.; Hainsworth, L. J.; McAninch, J. E.; Leivers, M. R.; Jones, P. R.; Proctor, I. D.; Straume, T.

    1997-03-01

    Measurements of 63Ni (t{1}/{2} = 100 yr) produced by the reaction 63Cu(n,p)63Ni could be used in the assessment of fast-neutron fluence from the Hiroshima atomic bomb. Such measurements would add new information to help resolve the current discrepancy between measured thermal neutron activation values and those calculated with the DS86 dosimetry system. It has been estimated that the 63Ni production at 5 m from the hypocenter was (1.4 ± 0.1) × 107 atoms/g Cu. Because of its sensitivity, accelerator mass spectrometry (AMS) is ideal for measurements at this low level. However, 63Ni has to be separated from large amounts of stable atomic isobar 63Cu (69% of pure Cu). In this study, a procedure is presented for the electrochemical separation of ultra-low amounts of Ni from Cu. The method was developed using samples of electrical Cu wire that were irradiated with fission neutrons from a 252Cf source. The wire samples were electrochemically dissolved in a solution containing 1 mg of Ni carrier. The Cu was selectively deposited on a cathode at controlled potential. Measurements of total Ni after electroseparation indicate ˜ 100% carrier recovery. To prevent Cu contamination, AMS targets were prepared by nickel carbonyl generation. The AMS results show a successful quantitative separation of ˜ 107 atoms of 63Ni from 2-20 g samples of Cu.

  4. Influence of the reaction temperature and ph on the coordination modes of the 1,4-benzenedicarboxylate (BDC) ligand: a case study of the Ni(II)(BDC)/2,2'-bipyridine system.

    PubMed

    Go, Yong Bok; Wang, Xiqu; Anokhina, Ekaterina V; Jacobson, Allan J

    2005-11-14

    Three new Ni(BDC)/2,2'-bipy compounds, Ni2(BDC)(HBDC)2(2,2'-bipy)2 (2), Ni3(BDC)3(2,2'-bipy)2 (3), and Ni(BDC)(2,2-bipy)2.2H2O (5), in addition to the previously reported Ni(BDC)(2,2'-bipy).0.75H2BDC (1) and Ni(BDC)(2,2'-bipy)(H2O) (4) [BDC = 1,4-benzenedicarboxylate; 2,2'-bipy = 2,2'-bipyridine], have been synthesized by hydrothermal reactions. A systematic investigation of the effect of the reaction temperature and pH resulted in a series of compounds with different compositions and dimensionality. The diverse product slate illustrates the marked sensitivity of the structural chemistry of polycarboxylate aromatic ligands to synthesis conditions. Compound 1, which has a channel structure containing guest H2BDC molecules, is formed at the lowest pH. The guest H2BDC molecules are connected by hydrogen bonds and form extended chains. At a slightly higher pH, a dimeric molecular compound 2 is formed with a lower number of protonated carboxylate groups per nickel atom and per BDC ligand. Reactions at higher temperature and the same pH lead to the transformation of 1 and 2 into the two-dimensional, layered trinuclear compound 3. As the pH is increased, a one-dimensional polymer 4 is formed with a water molecule coordinated to Ni2+. Bis-monodentate and bischelating BDC ligands alternate along the chain to give a crankshaft rather than a regular zigzag arrangement. A further increase of the pH leads to the one-dimensional chain compound 5, which has two chelating 2,2'-bipy ligands. Crystal data: 2, triclinic, space group P, a = 7.4896(9) angstroms, b = 9.912(1) angstroms, c = 13.508(2) angstroms, alpha = 86.390(2) degrees , beta = 75.825(2) degrees, gamma = 79.612(2) degrees, Z = 2; 3, orthorhombic, space group Pbca, a = 9.626(2) angstroms, b = 17.980(3) angstroms, c = 25.131(5) angstroms, Z = 4; 5, orthorhombic, space group Pbcn, a = 14.266(2) angstroms, b = 10.692(2) angstroms, c = 17.171(2) angstroms, Z = 8. PMID:16270964

  5. Ni3S2@CoS core-shell nano-triangular pyramid arrays on Ni foam for high-performance supercapacitors.

    PubMed

    Li, Rui; Wang, Senlin; Wang, Jianpeng; Huang, Zongchuan

    2015-07-01

    In this study, we demonstrate a facile method to fabricate novel Ni3S2 nano-triangular pyramid (NTP) arrays on Ni foam through a hydrothermal process and build unique Ni3S2@CoS core-shell NTP arrays by electro-deposition. The obtained Ni3S2@CoS material displays twice the specific capacitance of the pure Ni3S2 material in both a three-electrode system (4.89 F cm(-2) at 4 mA cm(-2)) and asymmetric supercapacitor device (0.69 F cm(-2) at 1.43 mA cm(-2)). In addition, the asymmetric supercapacitor demonstrates the outstanding energy density of 28.24 W h kg(-1) at a power density of 134.46 W kg(-1), with a stable cycle life (98.83% retained after 2000 cycles). The unique structure of the Ni3S2@CoS core-shell NTP arrays, which provides an ultra-thin CoS shell to enlarge efficient areas, introduces good conductivity, and short transportation lengths for both ions and electrons, contributes most to its excellent performance. Moreover, the bare Ni3S2 NTP arrays can be used as a new template to build other potential electrode materials.

  6. Ni2P nanosheets/Ni foam composite electrode for long-lived and pH-tolerable electrochemical hydrogen generation.

    PubMed

    Shi, Yanmei; Xu, You; Zhuo, Sifei; Zhang, Jingfang; Zhang, Bin

    2015-02-01

    The continuous consumption of fossil fuels and accompanying environmental problems are driving the exploration of low-cost and effective electrocatalysts to produce clean hydrogen. A Ni2P nanosheets/Ni foam composite, as a non-noble metal electrocatalyst, has been prepared through a facile chemical conversion pathway using surface oxidized Ni foam as precursor and low concentration of trioctylphosphine (TOP) as a phosphorus source. Further investigation shows the oxidized layer of Ni foam can orient the formation of Ni2P nanosheets and facilitate the reaction with TOP. The Ni2P/Ni, acting as a robust 3D self-supported superaerophobic hydrogen-evolving cathode, shows superior catalytic performance, stability, and durability in aqueous media over a wide pH value of 0-14, making it a versatile catalyst system for hydrogen generation. Such highly active, stable, abundant, and low-cost materials hold enormously promising potential applications in the fields of catalysis, energy conversion, and storage. PMID:25564726

  7. INVESTIGATION OF NOVEL ALLOY TiC-Ni-Ni3Al FOR SOLID OXIDE FUEL CELL INTERCONNECT APPLICATIONS

    SciTech Connect

    Rasit Koc; Geoffrey Swift; Hua Xie

    2005-01-25

    Solid oxide fuel cell interconnect materials must meet stringent requirements. Such interconnects must operate at temperatures approaching 800 C while resisting oxidation and reduction, which can occur from the anode and cathode materials and the operating environment. They also must retain their electrical conductivity under these conditions and possess compatible coefficients of thermal expansion as the anode and cathode. Results are presented in this report for fuel cell interconnect candidate materials currently under investigation based upon nano-size titanium carbide (TiC) powders. The TiC is liquid phase sintered with either nickel (Ni) or nickel-aluminide (Ni{sub 3}Al) in varying concentrations. The oxidation resistance of the submicron grain TiC-metal materials is presented as a function weight change versus time at 700 C and 800 C for varying content of metal/intermetallic in the system. Electrical conductivity at 800 C as a function of time is also presented for TiC-Ni to demonstrate the vitality of these materials for interconnect applications. TGA studies showed that the weight gain was 0.8 mg/cm{sup 2} for TiC(30)-Ni(30wt.%) after 100 hours in wet air at 800 C and the weight gain was calculated to be 0.5205 mg/cm{sup 2} for TiC(30)- Ni(10 wt.%) after 100 hours at 700 C and 100 hours at 800 C. At room temperature the electrical conductivity was measured to be 2444 1/[ohm.cm] for TiC-Ni compositions. The electrical conductivities at 800 C in air was recorded to be 19 1/[ohm.cm] after 125 hours. Two identical samples were supplied to PNNL (Dr. Jeff Stevenson) for ASR testing during the pre-decision period and currently they are being tested there. Fabrication, oxidation resistance and electrical conductivity studies indicate that TiC-Ni-Ni{sub 3}Al ternary appears to be a very important system for the development of interconnect composition for solid oxide fuel cells.

  8. Magical NiTi expander

    PubMed Central

    Katti, Chandrika Girish; Katti, Girish; Kallur, Ravi; Ghali, Srinivas Rao

    2013-01-01

    A 24-year-old male patient was referred to our department for expansion of the constricted maxillary arch as a presurgical procedure for the correction of congenital facial disfigurement. On examination, the patient had a convex profile, increased interlabial gap, tongue thrust, limited mouth opening, posterior crossbite, asymmetric ‘V’-shaped maxillary arch with severe constriction, crowding of anterior teeth in the maxillary arch and a massive open bite. Radiographic investigations included orthopantomograph and occlusal radiographs. The patient photographs and models were analysed. On careful evaluation, the treatment for maxillary arch expansion was planned with a nickel titanium (NiTi) slow maxillary expander along with fixed mechanotherapy for alignment of teeth. An unexpectedly successful outcome was appreciated from the treatment. An emphasis should be laid on selecting and treating the case of constricted arches with a surgical or non-surgical approach, as expansion can be achieved orthodontically by using NiTi expanders. PMID:23867876

  9. Interaction of ultraviolet photons with {NO}/{Ni(111) }

    NASA Astrophysics Data System (ADS)

    Magkoev, Tamerlan T.; Song, Moon-Bong; Fukutani, Katsuyuki; Murata, Yoshitada

    1996-08-01

    The properties of the {NO}/{Ni(111) } system under exposure to ultraviolet photons of three different energies (6.4, 5.0, and 3.5 eV) generated by nanosecond pulsed excimer laser, have been studied by reflection-absorption infrared spectroscopy and thermal desorption spectroscopy. It was found that the photoinduced process depends on the adsorbed temperature of NO on Ni(111). In adsorption at 80 K for submonolayer NO coverage the dominant laser light-induced effect is dissociation of NO molecules, whereas for saturation coverage UV photons do not change the properties of the system. However, when a saturated layer is formed at a substrate temperature of 300 K, laser irradiation causes dramatic changes of RAIR spectra which can be attributed to the chemical changes in {NO}/{Ni(111) }. Different photoinduced behaviors at 80 and 300 K originate from the different initial states of {NO}/{Ni(111) } formed at different substrate temperatures. The photoinduced process is essentially the same for all photon energies used, although the cross section becomes lower as the photon energy decreases.

  10. Monoligated monovalent Ni: the 3d(Ni)9 manifold of states of NiCu and comparison to the 3d9 States of AlNi, NiH, NiCl, and NiF.

    PubMed

    Rothschopf, Gretchen K; Morse, Michael D

    2005-12-22

    A dispersed fluorescence investigation of the low-lying electronic states of NiCu has allowed the observation of four out of the five states that derive from the 3d(Ni)9 3d(Cu)10 sigma2 manifold. Vibrational levels of the ground X2delta(5/2) state corresponding to v = 0-11 are observed and are fit to provide omega(e) = 275.93 +/- 1.06 cm(-1) and omega(e)x(e) = 1.44 +/- 0.11 cm(-1). The v = 0 levels of the higher lying states deriving from the 3d(Ni)9 3d(Cu)10 sigma2 manifold are located at 912, 1466, and 1734 cm(-1), and these states are assigned to omega values of 3/2, 1/2, and 3/2, respectively. The last of these assignments is based on selection rules and is unequivocal; the first two are based on a comparison to ab initio and ligand field calculations and could conceivably be in error. It is also possible that the v = 0 level of the state found at 912 cm(-1) is not observed, so that T0 for the lowest excited state actually lies near 658 cm(-1). These results are modeled using a matrix Hamiltonian based on the existence of a ground manifold of states deriving from the 3d9 configuration on nickel. This matrix Hamiltonian is also applied to the spectroscopically well-known molecules AlNi, NiH, NiCl, and NiF. The term energies of the 2sigma+, 2pi, and 2delta states of these molecules, which all derive from a 3d9 configuration on the nickel atom, display a clear and understandable trend as a function of the electronegativity of the ligands.

  11. Thermochemical Analysis of Phases Formed at the Interface of a Mg alloy-Ni-plated Steel Joint during Laser Brazing

    NASA Astrophysics Data System (ADS)

    Nasiri, Ali M.; Chartrand, Patrice; Weckman, David C.; Zhou, Norman Y.

    2013-04-01

    The thermodynamic stability of precipitated phases at the steel-Ni-Mg alloy interface during laser brazing of Ni-plated steel to AZ31B magnesium sheet using AZ92 magnesium alloy filler wire has been evaluated using FactSage thermochemical software. Assuming local chemical equilibrium at the interface, the chemical activity-temperature-composition relationships of intermetallic compounds that might form in the steel-Ni interlayer-AZ92 magnesium alloy system in the temperature range of 873 K to 1373 K (600 °C to 1100 °C) were estimated using the Equilib module of FactSage. The results provided better understanding of the phases that might form at the interface of the dissimilar metal joints during the laser brazing process. The addition of a Ni interlayer between the steel and the Mg brazing alloy was predicted to result in the formation of the AlNi, Mg2Ni, and Al3Ni2 intermetallic compounds at the interface, depending on the local maximum temperature. This was confirmed experimentally by laser brazing of Ni electro-plated steel to AZ31B-H24 magnesium alloy using AZ92 magnesium alloy filler wire. As predicted, the formation of just AlNi and Mg2Ni from a monotectic and eutectic reaction, respectively, was observed near the interface.

  12. Interannual variations of North Equatorial Current transport in the Pacific Ocean during two types of El Niño

    NASA Astrophysics Data System (ADS)

    Wu, Guoli; Zhai, Fangguo; Hu, Dunxin

    2016-05-01

    Interannual variations of Pacific North Equatorial Current (NEC) transport during eastern-Pacific El Niños (EP-El Niños) and central-Pacific El Niños (CP-El Niños) are investigated by composite analysis with European Centre for Medium-Range Weather Forecast Ocean Analysis/Reanalysis System 3. During EP-El Niño, NEC transport shows significant positive anomalies from the developing to decay phases, with the largest anomalies around the mature phase. During CP-El Niño, however, the NEC transport only shows positive anomalies before the mature phase, with much weaker anomalies than those during EP-El Niño. The NEC transport variations are strongly associated with variations of the tropical gyre and wind forcing in the tropical North Pacific. During EP-El Niño, strong westerly wind anomalies and positive wind stress curl anomalies in the tropical North Pacific induce local upward Ekman pumping and westward-propagating upwelling Rossby waves in the ocean, lowering the sea surface height and generating a cyclonic gyre anomaly in the western tropical Pacific. During CP-El Niño, however, strength of the wind and associated Ekman pumping velocity are very weak. Negative sea surface height and cyclonic flow anomalies are slightly north of those during EP El Niño.

  13. Towards the photoreduction of CO{sub 2} with Ni(bpy){sub n}{sup 2+} complexes

    SciTech Connect

    Mori, Y.; Szalda, D.J.; Brunschwig, B.S.; Schwarz, H.A.; Fujita, E.

    1995-08-01

    When an acetonitrile solution containing Ni(bpy){sub 3}{sup 2+}, trithylamine and CO{sub 2} is irradiated at 313 nm, CO is produced with a quantum yield {approximately} 0.1% (defined as CO produced/photons absorbed). Flash photolysis, electrochemistry, and pulse radiolysis experiments provide evidence for the formation of Ni{sup I}(bpy){sub 2+}, as an intermediate, in the photochemical Ni(bpy){sub 3}{sup 2+}/TEA/CO{sub 2} system. Although Ni{sup 0}(bpy){sub 2} does react with CO{sub 2}, Ni{sup I}(bpy){sub 2+} seems unreactive toward CO{sub 2} addition. The x-ray structure of [Ni{sub 3}(bpy){sub 6}](ClO{sub 4}), which crystallize as blue-violet needles, reveals the existence of a dimer in the solid. UV-vis spectra also indicate that reduced Ni(bpy){sub 3}{sup 2+} solutions contain Ni{sup I}(bpy){sub 2+}, Ni{sup 0}(bpy){sub 2} and [Ni(bpy){sub 2}]{sub 2} complexes in equilibrium.

  14. Competitive removal of Cu-EDTA and Ni-EDTA via microwave-enhanced Fenton oxidation with hydroxide precipitation.

    PubMed

    Lin, Qintie; Pan, Hanping; Yao, Kun; Pan, Yonggang; Long, Wei

    2015-01-01

    Ethylenediaminetetraacetic acid (EDTA) can form very stable complexes with heavy metal ions, greatly inhibiting conventional metal-removal technologies used in water treatment. Both the oxidation of EDTA and the reduction of metal ions in metal-EDTA systems via the microwave-enhanced Fenton reaction followed by hydroxide precipitation were investigated. The Cu(II)-Ni(II)-EDTA, Cu(II)-EDTA and Ni(II)-EDTA exhibited widely different decomplexation efficiencies under equivalent conditions. When the reaction reached equilibrium, the chemical oxygen demand was reduced by a microwave-enhanced Fenton reaction in different systems and the reduction order from high to low was Cu(II)-Ni(II)-EDTA ≈ Cu(II)-EDTA > Ni(II)-EDTA. The removal efficiencies of both Cu(2+) and Ni(2+) in Cu-Ni-EDTA wastewaters were much higher than those in a single heavy metal system. The degradation efficiency of EDTA in Cu-Ni-EDTA was lower than that in a single metal system. In the Cu-Ni-EDTA system, the microwave thermal degradation and the Fenton-like reaction created by Cu catalyzed H2O2 altered the EDTA degradation pathway and increased the pH of the wastewater system, conversely inhibiting residual EDTA degradation. PMID:26398034

  15. Competitive removal of Cu-EDTA and Ni-EDTA via microwave-enhanced Fenton oxidation with hydroxide precipitation.

    PubMed

    Lin, Qintie; Pan, Hanping; Yao, Kun; Pan, Yonggang; Long, Wei

    2015-01-01

    Ethylenediaminetetraacetic acid (EDTA) can form very stable complexes with heavy metal ions, greatly inhibiting conventional metal-removal technologies used in water treatment. Both the oxidation of EDTA and the reduction of metal ions in metal-EDTA systems via the microwave-enhanced Fenton reaction followed by hydroxide precipitation were investigated. The Cu(II)-Ni(II)-EDTA, Cu(II)-EDTA and Ni(II)-EDTA exhibited widely different decomplexation efficiencies under equivalent conditions. When the reaction reached equilibrium, the chemical oxygen demand was reduced by a microwave-enhanced Fenton reaction in different systems and the reduction order from high to low was Cu(II)-Ni(II)-EDTA ≈ Cu(II)-EDTA > Ni(II)-EDTA. The removal efficiencies of both Cu(2+) and Ni(2+) in Cu-Ni-EDTA wastewaters were much higher than those in a single heavy metal system. The degradation efficiency of EDTA in Cu-Ni-EDTA was lower than that in a single metal system. In the Cu-Ni-EDTA system, the microwave thermal degradation and the Fenton-like reaction created by Cu catalyzed H2O2 altered the EDTA degradation pathway and increased the pH of the wastewater system, conversely inhibiting residual EDTA degradation.

  16. Magnetic Properties of Grain Boundaries of Nanocrystalline Ni and of Ni Precipitates in Nanocrystalline NiCu Alloys

    NASA Astrophysics Data System (ADS)

    Wolf, H.; Guan, Z.; Li, X.; Wichert, Th.

    2001-11-01

    Perturbed γγ-angular correlation spectroscopy (PAC) was used to investigate nanocrystalline Ni and NiCu alloys, which are prepared by pulsed electrodeposition (PED). Using diffusion for doping nanocrystalline Ni with 111In four different ordered grain boundary structures are observed, which are characterized by unique electric field gradients. The incorporation of 111In on substitutional bulk sites of Ni is caused by moving grain boundaries below 1000 K and by volume diffusion above 1000 K. The nanocrystalline NiCu alloys prepared by PED are microscopically inhomogeneous as observed by PAC. In contrast, this inhomogeneity cannot be detected by X-ray diffraction. The influence of the temperature of the electrolyte, the current density during deposition, and the optional addition of saccharin to the electrolyte on the homogeneity of nanocrystalline NiCu alloys was investigated.

  17. On the nature of Ni···Ni interaction in a model dimeric Ni complex.

    PubMed

    Kamiński, Radosław; Herbaczyńska, Beata; Srebro, Monika; Pietrzykowski, Antoni; Michalak, Artur; Jerzykiewicz, Lucjan B; Woźniak, Krzysztof

    2011-06-01

    A new dinuclear complex (NiC(5)H(4)SiMe(2)CHCH(2))(2) (2) was prepared by reacting nickelocene derivative [(C(5)H(4)SiMe(2)CH=CH(2))(2)Ni] (1) with methyllithium (MeLi). Good quality crystals were subjected to a high-resolution X-ray measurement. Subsequent multipole refinement yielded accurate description of electron density distribution. Detailed inspection of experimental electron density in Ni···Ni contact revealed that the nickel atoms are bonded and significant deformation of the metal valence shell is related to different populations of the d-orbitals. The existence of the Ni···Ni bond path explains the lack of unpaired electrons in the complex due to a possible exchange channel. PMID:21505665

  18. Carbon-carbon cross-coupling reactions catalyzed by a two-coordinate nickel(II)-bis(amido) complex via observable Ni(I) , Ni(II) , and Ni(III) intermediates.

    PubMed

    Lipschutz, Michael I; Tilley, T Don

    2014-07-01

    Recently, the development of more sustainable catalytic systems based on abundant first-row metals, especially nickel, for cross-coupling reactions has attracted significant interest. One of the key intermediates invoked in these reactions is a Ni(III) -alkyl species, but no such species that is part of a competent catalytic cycle has yet been isolated. Herein, we report a carbon-carbon cross-coupling system based on a two-coordinate Ni(II) -bis(amido) complex in which a Ni(III) -alkyl species can be isolated and fully characterized. This study details compelling experimental evidence of the role played by this Ni(III) -alkyl species as well as those of other key Ni(I) and Ni(II) intermediates. The catalytic cycle described herein is also one of the first examples of a two-coordinate complex that competently catalyzes an organic transformation, potentially leading to a new class of catalysts based on the unique ability of first-row transition metals to accommodate two-coordinate complexes.

  19. Role of the anode material in the unipolar switching of TiN\\NiO\\Ni cells

    NASA Astrophysics Data System (ADS)

    Goux, L.; Degraeve, R.; Meersschaut, J.; Govoreanu, B.; Wouters, D. J.; Kubicek, S.; Jurczak, M.

    2013-02-01

    In this paper, we investigate the unipolar resistive-switching mechanism in TiNNiONi cells, whereby the NiO layer is deposited by metal-organic chemical vapor deposition. Irrespective of the cell size down to 80 nm, controlled unipolar switching is observed only on condition the Ni electrode is used as anode. Local elemental analyzes revealed enhanced oxygen concentration at the NiONi interface after reset operation. Based on this result as well as on the quantum-mechanical modeling of the conduction for different resistance states, the reset switching is analyzed in terms of electrochemically assisted oxidation process of the conductive filament close to the Ni anode. Electrical switching results on various stack configurations confirm the major impact of the electrode materials on the reset performances, bringing important insights into the mechanisms involved in the unipolar switching of this system. Literature data are discussed on the basis of this learning, suggesting possible extension of these considerations to other oxide-based switching systems.

  20. The impact of Ni on the physiology of a Mediterranean Ni-hyperaccumulating plant.

    PubMed

    Roccotiello, Enrica; Serrano, Helena Cristina; Mariotti, Mauro Giorgio; Branquinho, Cristina

    2016-06-01

    High nickel (Ni) levels exert toxic effects on plant growth and plant water content, thus affecting photosynthesis. In a pot experiment, we investigated the effect of the Ni concentration on the physiological characteristics of the Ni hyperaccumulator Alyssoides utriculata when grown on a vermiculite substrate in the presence of different external Ni concentrations (0-500 mg Ni L(-1)). The results showed that the Ni concentration was higher in leaves than in roots, as evidenced by a translocation factor = 3 and a bioconcentration factor = 10. At the highest concentration tested (500 mg Ni L(-1)), A. utriculata accumulated 1100 mg Ni per kilogram in its leaves, without an effects on its biomass. Plant water content increased significantly with Ni accumulation. Ni treatment did not, or only slightly, affected chlorophyll fluorescence parameters. The photosynthetic efficiency (FV/FM) of A. utriculata was stable between Ni treatments (always ≥ 0.8) and the photosynthetic performance of the plant under Ni stress remained high (performance index = 1.5). These findings support that A. utriculata has several mechanisms to avoid severe damage to its photosynthetic apparatus, confirming the tolerance of this species to Ni under hyperaccumulation. PMID:26983814

  1. Solidification Behavior in Newly Designed Ni-Rich Ni-Ti-Based Alloys

    NASA Astrophysics Data System (ADS)

    Samal, Sumanta; Biswas, Krishanu; Phanikumar, Gandham

    2016-10-01

    The present investigation reports phase and microstructure evolution during solidification of novel Ni-rich Ni-Ti-based alloys, Ni60Ti40, Ni50Cu10Ti40, Ni48Cu10Co2Ti40, and Ni48Cu10Co2Ti38Ta2 during suction casting. The design philosophy of the multicomponent alloys involves judicious selection of alloying elements such as Cu, Co, and Ta in the near Ni60Ti40 eutectic alloy by replacing both Ni and Ti so that phase mixture in the microstructure remains the same from the binary to quinary alloy. The basic objective is to study the effect of addition of Cu, Co, and Ta on the phase evolution and transformation in the Ni-rich Ni-Ti-based alloys. The detailed electron microscopic studies on these suction cast alloys reveal the presence of ultrafine eutectic lamellae between NiTi and Ni3Ti phases along with dendritic NiTi and Ti2Ni phases. It has also been observed that in the binary (Ni60Ti40) alloy, the ordered NiTi (B2) phase transforms to trigonal (R) phase followed by NiTi martensitic phase (M-phase), i.e., B2 → R-phase → M-phase during solid-state cooling. However, the addition of alloying elements such as Cu, Co to the binary (Ni60Ti40) alloy suppresses the martensitic transformation of the ordered NiTi (B2) dendrite. Thus, in the ternary and quaternary alloys, the ordered NiTi (B2) phase is transformed to only trigonal (R) phase, i.e., B2 → R-phase. The secondary precipitate of Ti2Ni has been observed in all of the studied alloys. Interestingly, Ni48Cu10Co2Ti38Ta2 quinary alloy shows the disordered nature of NiTi dendrites. The experimentally observed solidification path is in good agreement with Gulliver-Scheil simulated path for binary alloy, whereas simulated solidification path deviates from the experimental results in case of ternary, quaternary, and quinary alloys.

  2. Effects of interactions between NiM (M = Mn, Fe, Co and Cu) bimetals with MgO (1 0 0) on the adsorption of CO2

    NASA Astrophysics Data System (ADS)

    Wang, Baojun; Yan, Ruixia; Liu, Hongyan

    2012-09-01

    A density-functional theory method has been conducted to investigate the interactions of NiM (M = Mn, Fe, Co and Cu) with MgO (1 0 0) as well as the effects of interactions on the adsorption of CO2. The binding energies of NiM on MgO and the adsorption energies of CO2 on NiM/MgO have been calculated, and the results show that the defective NiM/MgO catalysts exhibit stronger metal-support interaction (MSI) than the perfect NiM/MgO catalysts do, leading to weaker adsorption ability to CO2, except NiMn/MgO system. However, for the catalysts with the same MgO surface and different bimetals, the stronger the MSI is, the stronger adsorption ability of the substrate to CO2 is, except NiCu/MgO system.

  3. A threonine stabilizes the NiC and NiR catalytic intermediates of [NiFe]-hydrogenase.

    PubMed

    Abou-Hamdan, Abbas; Ceccaldi, Pierre; Lebrette, Hugo; Gutiérrez-Sanz, Oscar; Richaud, Pierre; Cournac, Laurent; Guigliarelli, Bruno; De Lacey, Antonio L; Léger, Christophe; Volbeda, Anne; Burlat, Bénédicte; Dementin, Sébastien

    2015-03-27

    The heterodimeric [NiFe] hydrogenase from Desulfovibrio fructosovorans catalyzes the reversible oxidation of H2 into protons and electrons. The catalytic intermediates have been attributed to forms of the active site (NiSI, NiR, and NiC) detected using spectroscopic methods under potentiometric but non-catalytic conditions. Here, we produced variants by replacing the conserved Thr-18 residue in the small subunit with Ser, Val, Gln, Gly, or Asp, and we analyzed the effects of these mutations on the kinetic (H2 oxidation, H2 production, and H/D exchange), spectroscopic (IR, EPR), and structural properties of the enzyme. The mutations disrupt the H-bond network in the crystals and have a strong effect on H2 oxidation and H2 production turnover rates. However, the absence of correlation between activity and rate of H/D exchange in the series of variants suggests that the alcoholic group of Thr-18 is not necessarily a proton relay. Instead, the correlation between H2 oxidation and production activity and the detection of the NiC species in reduced samples confirms that NiC is a catalytic intermediate and suggests that Thr-18 is important to stabilize the local protein structure of the active site ensuring fast NiSI-NiC-NiR interconversions during H2 oxidation/production.

  4. A Threonine Stabilizes the NiC and NiR Catalytic Intermediates of [NiFe]-hydrogenase*

    PubMed Central

    Abou-Hamdan, Abbas; Ceccaldi, Pierre; Lebrette, Hugo; Gutiérrez-Sanz, Oscar; Richaud, Pierre; Cournac, Laurent; Guigliarelli, Bruno; De Lacey, Antonio L.; Léger, Christophe; Volbeda, Anne; Burlat, Bénédicte; Dementin, Sébastien

    2015-01-01

    The heterodimeric [NiFe] hydrogenase from Desulfovibrio fructosovorans catalyzes the reversible oxidation of H2 into protons and electrons. The catalytic intermediates have been attributed to forms of the active site (NiSI, NiR, and NiC) detected using spectroscopic methods under potentiometric but non-catalytic conditions. Here, we produced variants by replacing the conserved Thr-18 residue in the small subunit with Ser, Val, Gln, Gly, or Asp, and we analyzed the effects of these mutations on the kinetic (H2 oxidation, H2 production, and H/D exchange), spectroscopic (IR, EPR), and structural properties of the enzyme. The mutations disrupt the H-bond network in the crystals and have a strong effect on H2 oxidation and H2 production turnover rates. However, the absence of correlation between activity and rate of H/D exchange in the series of variants suggests that the alcoholic group of Thr-18 is not necessarily a proton relay. Instead, the correlation between H2 oxidation and production activity and the detection of the NiC species in reduced samples confirms that NiC is a catalytic intermediate and suggests that Thr-18 is important to stabilize the local protein structure of the active site ensuring fast NiSI-NiC-NiR interconversions during H2 oxidation/production. PMID:25666617

  5. Review of magnetic features observed in (A,A')Ni 2B 2C solid solutions

    NASA Astrophysics Data System (ADS)

    Kuznietz, Moshe; Gonçalves, António P.; Almeida, Manuel

    2002-08-01

    The nickel-borocarbides ANi 2B 2C [A=Y, Ln (lanthanide), An(actinide)], crystallizing in the body-centred tetragonal LuNi 2B 2C-type structure, are classified according to the existence or coexistence of superconducting and antiferromagnetic states (AF). The magnetic features observed in polycrystalline (A,A')Ni 2B 2C solid solutions, adopting the same crystal structure, are reviewed and discussed. Published data on the magnetism in (A,Ln)Ni 2B 2C systems (ANi 2B 2C nonmagnetic, A=Y,La,Lu) indicate a gradual rise in the threshold content, x( m), in (Y 1- xLn x)Ni 2B 2C (Ln=Gd,Tb,Dy,Ho,Er) for the establishment of AF states. (A,A')Ni 2B 2C systems with magnetic end compounds show gradual variation in magnetic features when A and A' are both heavy Ln. The behaviour of (A,A')Ni 2B 2C systems of light A (Pr or U) and heavy A' (Dy or Tm) depends on the magnetic structures of the end compounds. In intermediate compositions, incomplete moment compensation in (Pr,Dy)Ni 2B 2C decreases TN, while different moment directions in the end compounds in (U,Dy)Ni 2B 2C lead to a directional frustration of ordered moments. Such a frustration in (U,Tm)Ni 2B 2C is related to different magnetic structures of the end compounds.

  6. Mo{sub 2}NiB{sub 2}-type (Gd, Tb, Dy){sub 2}Ni{sub 2.35}Si{sub 0.65} and La{sub 2}Ni{sub 3}-type (Dy, Ho){sub 2}Ni{sub 2.5}Si{sub 0.5} compounds: Crystal structure and magnetic properties

    SciTech Connect

    Morozkin, A.V.; Isnard, O.; Nirmala, R.; Malik, S.K.

    2015-05-15

    earth compounds. The variation of alloy’s composition by ~3 at% i.e. from Dy{sub 2}Ni{sub 2.35}Si{sub 0.65} to Dy{sub 2}Ni{sub 2.5}Si{sub 0.5} leads to significant transformation of crystal structure of compound with different variant of distortion of Po-type rare earth sublattice, as in Gd–Co–Ga and Er–Ni–In systems: the Mo{sub 2}NiB{sub 2}-type Gd{sub 2}Co{sub 2}Ga and La{sub 2}Ni{sub 3}-type Gd{sub 2}Co{sub 2.9}Ga{sub 0.1}, and Mo{sub 2}FeB{sub 2}-type Er{sub 2}Ni{sub 1.78}In and Mn{sub 2}AlB{sub 2}-type Er{sub 2}Ni{sub 2}In. Magnetization measurements indicate collinear ferromagnetic ordering of Mo{sub 2}NiB{sub 2}-type Gd{sub 2}Ni{sub 2.35}Si{sub 0.65} and a complex antiferromagnetic ordering with low-temperature metamagnetic nature for Mo{sub 2}NiB{sub 2}-type Tb{sub 2}Ni{sub 2.35}Si{sub 0.65} compounds. However, neutron diffraction study in zero applied field of Tb{sub 2}Ni{sub 2.35}Si{sub 0.65} reveals c-axis pure antiferromagnetic ordering of terbium sublattice with K=[1/2, 0, 1/2] propagation vector. Magnetization measurements indicate ferromagnetic order with coexisting antiferromagnetic interactions and low-temperature metamagnetic state for La{sub 2}Ni{sub 3}-type Dy{sub 2}Ni{sub 2.5}Si{sub 0.5}. We suggest possible polymorphism in other Mo{sub 2}FeB{sub 2}-type, Mo{sub 2}NiB{sub 2}-type, La{sub 2}Ni{sub 3}-type and Mn{sub 2}AlB{sub 2}-type rare earth compounds with corresponding change in their magnetic properties. - Highlights: • (Gd, Tb, Dy){sub 2}Ni{sub 2.35}Si{sub 0.65} compounds crystallize in the Mo{sub 2}NiB{sub 2}-type structure. • (Dy, Ho){sub 2}Ni{sub 2.5}Si{sub 0.5} compounds crystallize in the La{sub 2}Ni{sub 3}-type structure. • Gd{sub 2}Ni{sub 2.35}Si{sub 0.65} shows pure ferromagnetic type ordering. • Tb{sub 2}Ni{sub 2.35}Si{sub 0.65} and Dy{sub 2}Ni{sub 2.5}Si{sub 0.5} show mixed ferro-antiferromagnetic ordering. • Tb{sub 2}Ni{sub 2.35}Si{sub 0.65} and Dy{sub 2}Ni{sub 2.5}Si{sub 0.5} exhibit low-temperature metamagnetic

  7. Atomistic Design of Favored Compositions for Synthesizing the Al-Ni-Y Metallic Glasses

    PubMed Central

    Wang, Q.; Li, J. H.; Liu, J. B.; Liu, B. X.

    2015-01-01

    For a ternary alloy system promising for obtaining the so-called bulk metallic glasses (BMGs), the first priority issue is to predict the favored compositions, which could then serve as guidance for the appropriate alloy design. Taking the Al-Ni-Y system as an example, here we show an atomistic approach, which is developed based on a recently constructed and proven realistic interatomic potential of the system. Applying the Al-Ni-Y potential, series simulations not only clarify the glass formation mechanism, but also predict in the composition triangle, a hexagonal region, in which a disordered state, i.e., the glassy phase, is favored energetically. The predicted region is defined as glass formation region (GFR) for the ternary alloy system. Moreover, the approach is able to calculate an amorphization driving force (ADF) for each possible glassy alloy located within the GFR. The calculations predict an optimized sub-region nearby a stoichiometry of Al80Ni5Y15, implying that the Al-Ni-Y metallic glasses designed in the sub-region could be the most stable. Interestingly, the atomistic predictions are supported by experimental results observed in the Al-Ni-Y system. In addition, structural origin underlying the stability of the Al-Ni-Y metallic glasses is also discussed in terms of a hybrid packing mode in the medium-range scale. PMID:26592568

  8. Effects of alloying element and temperature on the stacking fault energies of dilute Ni-base superalloys.

    PubMed

    Shang, S L; Zacherl, C L; Fang, H Z; Wang, Y; Du, Y; Liu, Z K

    2012-12-19

    A systematic study of stacking fault energy (γ(SF)) resulting from induced alias shear deformation has been performed by means of first-principles calculations for dilute Ni-base superalloys (Ni(23)X and Ni(71)X) for various alloying elements (X) as a function of temperature. Twenty-six alloying elements are considered, i.e., Al, Co, Cr, Cu, Fe, Hf, Ir, Mn, Mo, Nb, Os, Pd, Pt, Re, Rh, Ru, Sc, Si, Ta, Tc, Ti, V, W, Y, Zn, and Zr. The temperature dependence of γ(SF) is computed using the proposed quasistatic approach based on a predicted γ(SF)-volume-temperature relationship. Besides γ(SF), equilibrium volume and the normalized stacking fault energy (Γ(SF) = γ(SF)/Gb, with G the shear modulus and b the Burgers vector) are also studied as a function of temperature for the 26 alloying elements. The following conclusions are obtained: all alloying elements X studied herein decrease the γ(SF) of fcc Ni, approximately the further the alloying element X is from Ni on the periodic table, the larger the decrease of γ(SF) for the dilute Ni-X alloy, and roughly the γ(SF) of Ni-X decreases with increasing equilibrium volume. In addition, the values of γ(SF) for all Ni-X systems decrease with increasing temperature (except for Ni-Cr at higher Cr content), and the largest decrease is observed for pure Ni. Similar to the case of the shear modulus, the variation of γ(SF) for Ni-X systems due to various alloying elements is traceable from the distribution of (magnetization) charge density: the spherical distribution of charge density around a Ni atom, especially a smaller sphere, results in a lower value of γ(SF) due to the facility of redistribution of charges. Computed stacking fault energies and the related properties are in favorable accord with available experimental and theoretical data.

  9. Effects of alloying element and temperature on the stacking fault energies of dilute Ni-base superalloys

    NASA Astrophysics Data System (ADS)

    Shang, S. L.; Zacherl, C. L.; Fang, H. Z.; Wang, Y.; Du, Y.; Liu, Z. K.

    2012-12-01

    A systematic study of stacking fault energy (γSF) resulting from induced alias shear deformation has been performed by means of first-principles calculations for dilute Ni-base superalloys (Ni23X and Ni71X) for various alloying elements (X) as a function of temperature. Twenty-six alloying elements are considered, i.e., Al, Co, Cr, Cu, Fe, Hf, Ir, Mn, Mo, Nb, Os, Pd, Pt, Re, Rh, Ru, Sc, Si, Ta, Tc, Ti, V, W, Y, Zn, and Zr. The temperature dependence of γSF is computed using the proposed quasistatic approach based on a predicted γSF-volume-temperature relationship. Besides γSF, equilibrium volume and the normalized stacking fault energy (ΓSF = γSF/Gb, with G the shear modulus and b the Burgers vector) are also studied as a function of temperature for the 26 alloying elements. The following conclusions are obtained: all alloying elements X studied herein decrease the γSF of fcc Ni, approximately the further the alloying element X is from Ni on the periodic table, the larger the decrease of γSF for the dilute Ni-X alloy, and roughly the γSF of Ni-X decreases with increasing equilibrium volume. In addition, the values of γSF for all Ni-X systems decrease with increasing temperature (except for Ni-Cr at higher Cr content), and the largest decrease is observed for pure Ni. Similar to the case of the shear modulus, the variation of γSF for Ni-X systems due to various alloying elements is traceable from the distribution of (magnetization) charge density: the spherical distribution of charge density around a Ni atom, especially a smaller sphere, results in a lower value of γSF due to the facility of redistribution of charges. Computed stacking fault energies and the related properties are in favorable accord with available experimental and theoretical data.

  10. Interdiffusion in Ni/CrMo Composition-Modulated Films

    SciTech Connect

    Jankowski, A F; Saw, C K

    2003-02-18

    The measurement of diffusivity at low temperature in the Ni-CrMo alloy system, relative to the melt point, is accomplished through the use of a composition-modulated structure. The composition-modulated structure consists of numerous pairs of alternating Ni and Cr-Mo layers that are each just a few nanometers thick. A direct assessment of alloy stability is made possible through measurement of the atomic diffusion between these layers that occurs during anneal treatments. X ray diffraction under the Bragg condition in the {theta}/2{theta} mode is the method used to quantify the changes that occur in the short-range order, i.e. the artificial composition fluctuation. The relative intensities of satellite reflections about the Bragg peaks are monitored as a function of the time at temperature. The decay rate of the artificial composition fluctuation of Ni with Cr-Mo is analyzed using the microscopic theory of diffusion to quantify a macroscopic diffusion coefficient D as 1.52 x 10{sup -19} cm{sup 2} {center_dot} sec{sup -1} for Ni{sub 2}(Cr,Mo) at 760 K.

  11. Directional solidification studies in Ni-Al alloys

    SciTech Connect

    Lee, Je-hyun

    1993-05-01

    Three solid phases are involved in the phase equilibria of the intermetallic compound Ni{sub 3}Al near its melting point, {beta}, {gamma}{prime}(Ni{sub 3}Al), and {gamma}. The generally-accepted phase diagram involves a eutectic reaction between {beta}{prime} and {gamma}, but some recent studies agree with an older diagram due to Schramm, which has a eutectic reaction between the {beta} and {gamma}{prime} phases. The phase equilibria near Ni{sub 3}Al compositions was evaluated using quenched directional solidification experiments, that preserve the microstructures tonned at the solidification front, and using diffusion couple experiments. These experiments show that eutectic forms between {beta} and {gamma}{prime} phases, as in the Schramm diagram. Growth and phase transformations of these three phases are also studied in the directional solidification experiments. Microstructure analysis shows that etching of Ni{sub 3}Al({gamma}{prime}) is very sensitive to small composition variations and crystallographic orientation changes. The eutectic solidification study confirms that the equilibrium eutectic is {gamma}{prime}+{beta}, and that the metastable {gamma}+{beta} eutectic might be also produced in this system according to the impurities, solidification rates, and composition variations.

  12. Neutron Scattering Studies of the S=1/2 Triangular Lattice Magnets NaNiO2 and LiNiO2

    NASA Astrophysics Data System (ADS)

    Clancy, J. Patrick

    2011-03-01

    NaNi O2 and LiNi O2 are isostructural quantum magnets based on a stacked triangular lattice in which magnetism arises from S=1/2 magnetic moments carried by Ni 3+ ions. Surprisingly, while these compounds are structurally and electronically very similar, the magnetic properties they exhibit are dramatically different. NaNi O2 undergoes a cooperative Jahn-Teller phase transition at 480K and magnetically orders below TN ~ 23 K, adopting a structure which consists of ferromagnetic sheets of S=1/2 moments stacked in an antiferromagnetic fashion. In contrast, LiNi O2 undergoes a spin glass transition at Tg ~ 9 K and remains disordered down to the lowest measured temperatures. Understanding the absence of long-range magnetic order in LiNi O2 is a problem which has attracted considerable interest for more than twenty five years. Among many potential explanations, the answer has most notably been attributed to geometric frustration caused by inherent mixing of the Li and Ni sublattices, or orbital degeneracy resulting from the lack of a coherent Jahn-Teller distortion. In this talk I will describe time-of-flight neutron scattering measurements performed on polycrystalline samples of NaNi O2 and LiNi O2 using the wide Angular-Range Chopper Spectrometer (ARCS) at ORNL and the Disk Chopper Spectrometer (DCS) at NIST. These measurements provide a thorough characterization of the excitation spectra for these two compounds, probing the inelastic scattering over energy scales ranging from ~ 0.1 meV to 1.5 eV. In NaNi O2 , our measurements reveal two sets of well-defined spin excitations, which we associate with ferromagnetic spin waves mediated by in-plane interactions and antiferromagnetic spin waves mediated by out-of-plane interactions. In LiNi O2 , we observe similar, albeit much broader, excitations consistent with short-range two-dimensional magnetic correlations. In the case of NaNi O2 , we have developed a simple linear spin wave theory model to describe these excitations

  13. Composite Ni/NiO-Cr2O3 Catalyst for Alkaline Hydrogen Evolution Reaction

    SciTech Connect

    Bates, MK; Jia, QY; Ramaswamy, N; Allen, RJ; Mukerjee, S

    2015-03-12

    We report a Ni-Cr/C electrocatalyst with unpreeedented massactivity for the hydrogen evolution reaction (HER). in alkaline electrolyte. The HER Oietics of numerous binary and ternary Ni-alloys and composite Ni/metal-euride/C samples were evaluated in aquebus 0.1 M KOH electrolyte. The highest HER mass-activity was observed for Ni-Cr materials which exhibit metallic Ni as well as NiOx and Cr2O3 phases as determined by X-ray diffraction (XRD) and X-ray absorption spectroscopy (XAS) analysis. The onset of the HER is significantly improved compared to munerous binary dor ternary Ni-alloys, inCluding Ni Mg materials. It is likely that at adjacent Ni/NiOx sites, the oxide acts as a sink for OHads, while the metallic Ni acts as a, sink for the H-ads, intermediate of the HER, thus minimizing the high activation energy of hydrogen evolution via water reduction. This is confirmed by in situ XAS studies that show that the synergistic HER enhancement is due to NiO content and that the Cr2O3 appears to stabilize the composite NiO component-under HER conditions (where NiOx would typically be reduced to metallic Ni-0). Furthermore, in contrast to Pt, the Ni(O-x)/Cr2O3 catalyst appears resistant to poisoning by the anion.exchange ionomer (AEI), a serloua consideration when applied to an anionic polymer electrolyte interface. Furthermore, we report a: detailed model of the double layer interface which helps explain the observed ensemble effect in the presence of AEI.

  14. Ni clay neoformation on montmorillonite surface.

    PubMed

    Dähn, R; Scheidegger, A; Manceau, A; Schlegel, M; Baeyens, B; Bradbury, M H

    2001-03-01

    Polarized extended X-ray absorption fine structure spectroscopy (P-EXAFS) was used to study the sorption mechanism of Ni on the aluminous hydrous silicate montmorillonite at high ionic strength (0.3 M NaClO4), pH 8 and a Ni concentration of 0.66 mM. Highly textured self-supporting clay films were obtained by slowly filtrating a clay suspension after a reaction time of 14 days. P-EXAFS results indicate that sorbed Ni has a Ni clay-like structural environment with the same crystallographic orientation as montmorillonite layers.

  15. Cyclic voltammetric study of Co-Ni-Fe alloys electrodeposition in sulfate medium

    SciTech Connect

    Hanafi, I.; Daud, A. R.; Radiman, S.

    2013-11-27

    Electrochemical technique has been used to study the electrodeposition of cobalt, nickel, iron and Co-Ni-Fe alloy on indium tin oxide (ITO) coated glass substrate. To obtain the nucleation mechanism, cyclic voltammetry is used to characterize the Co-Ni-Fe system. The scanning rate effect on the deposition process was investigated. Deposition of single metal occurs at potential values more positive than that estimated stability potential. Based on the cyclic voltammetry results, the electrodeposition of cobalt, nickel, iron and Co-Ni-Fe alloy clearly show that the process of diffusion occurs is controlled by the typical nucleation mechanism.

  16. Isospin diffusion in {sup 58}Ni-induced reactions at intermediate energies. I. Experimental results

    SciTech Connect

    Galichet, E.; Rivet, M. F.; Borderie, B.; Bougault, R.; Durand, D.; Lopez, O.; Manduci, L.; Tamain, B.; Vient, E.; Dayras, R.; Volant, C.; Rosato, E.

    2009-06-15

    Isospin diffusion in semiperipheral collisions is probed as a function of the dissipated energy by studying two systems {sup 58}Ni+{sup 58}Ni and {sup 58}Ni+{sup 197}Au, over the incident energy range 52A-74A MeV. A close examination of the multiplicities of light products in the forward part of the phase space clearly shows an influence of the isospin of the target on the neutron richness of these products. A progressive isospin diffusion is observed when collisions become more central, in connection with the interaction time.

  17. Engineering NiO sensitive materials and its ultra-selective detection of benzaldehyde.

    PubMed

    Yang, Fuchao; Guo, Zhiguang

    2016-04-01

    Ongoing interest in oxide semiconductor as components of gas sensing devices is motivated by environmental monitoring and intelligent control. NiO with different precursor solution were synthesized by aqueous chemical deposition and pyrolysis process. Here the method is quite facile, green and free of surfactant. Their morphology, crystal structure and chemical composition have been systemically characterized by various techniques. Interestingly, the microstructures of NiO can be engineered by different nickel salt (nitrate or chloride). These NiO based gas sensors showed substantially enhanced responses to benzaldehyde target analyte and exhibited fast response-recover feature. The observed gas sensing behavior is explained in terms of oxygen ionosorption mechanism.

  18. Method for measurement of diffusivity: Calorimetric studies of Fe/Ni multilayer thin films

    SciTech Connect

    Liu, JX; Barmak, K

    2015-07-15

    A calorimetric method for the measurement of diffusivity in thin film multilayers is introduced and applied to the Fe Ni system. Using this method, the diffusivity in [Fe (25 nm)/Ni (25 nm)](20) multilayer thin films is measured as 4 x 10(-3)exp(-1.6 +/- 0.1 eV/ k(B)T) cm(2)/s, respectively. The diffusion mechanism in the multilayers and its relevance to laboratory synthesis of L1(0) ordered FeNi are discussed. (C) 2015 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  19. DFT study of the water gas shift reaction on Ni(111), Ni(100) and Ni(110) surfaces

    NASA Astrophysics Data System (ADS)

    Mohsenzadeh, Abas; Richards, Tobias; Bolton, Kim

    2016-02-01

    Density functional theory (DFT) calculations were used to study the water gas shift (WGS) reaction on Ni(111), Ni(100) and Ni(110) surfaces. The adsorption energy for ten species involved in the reaction together with activation barriers and reaction energies for the nine most important elementary steps were determined using the same model and DFT methods. The results reveal that these energies are sensitive to the surface structure. In spite of this, the WGS reaction occurs mainly via the direct (also referred to as redox) pathway with the CO + O → CO2 reaction as the rate determining step on all three surfaces. The activation barrier obtained for this rate limiting step decreases in the order Ni(110) > Ni(111) > Ni(100). Therefore, if O species are present on the surfaces then the WGS reaction is fastest on the Ni(100) surface. However, the barrier for desorption of H2O (which is the source of the O species) is lower than its dissociation reaction on the Ni(111) and Ni(100) surfaces, but not on the Ni(110) surface. Hence, at low H2O(g) pressures, the direct pathway on the Ni(110) surface will dominate and will be the rate limiting step. The calculations also show that the reason that the WGS reaction does not primarily occur via the formate pathway is that this species is a stable intermediate on all surfaces. The reactions studied here support the Brønsted-Evans-Polanyi (BEP) principles with an R2 value of 0.99.

  20. First principles exploration of NiO and its ions NiO+ and NiO-

    NASA Astrophysics Data System (ADS)

    Sakellaris, Constantine N.; Mavridis, Aristides

    2013-02-01

    We present a high level ab initio study of NiO and its ions, NiO+ and NiO-. Employing variational multireference configuration interaction (MRCI) and single reference coupled-cluster methods combined with basis sets of quintuple quality, 54, 20, and 10 bound states of NiO, NiO+, and NiO- have been studied. For all these states, complete potential energy curves have been constructed at the MRCI level of theory; in addition, for the ground states of the three species core subvalence (3s23p6/Ni) and scalar relativistic effects have been taken into account. We report energetics, spectroscopic parameters, dipole moments, and spin-orbit coupling constants. The agreement with experiment is in the case of NiO good, but certain discrepancies that need further investigation have arisen in the case of the anion whose ground state remains computationally a tantalizing matter. The cation is experimentally almost entirely unexplored, therefore, the study of many states shall prove valuable to further investigators. The ground state symmetry, bond distances, and binding energies of NiO and NiO+ are (existing experimental values in parenthesis), X3Σ-(X3Σ-), re = 1.606 (1.62712) Å, D0 = 88.5 (89.2 ± 0.7) kcal/mol, and X4Σ-(?), re = 1.60(?) Å, D0 = 55 (62.4 ± 2.4) kcal/mol, respectively. The ground state of NiO- is 4Σ- (but 2Π experimentally) with D0 = 85-87 (89.2 ± 0.7) kcal/mol.

  1. Investigation on the structural and electrical properties of NdSrNi{sub 1-x}Cr{sub x}O{sub 4+{delta}} (0.1<=x<=0.9) system

    SciTech Connect

    Jammali, Manel; Chaker, H.; Cherif, K.; Ben Hassen, R.

    2010-05-15

    The phases NdSrNi{sub 1-x}Cr{sub x}O{sub 4+{delta}} (0.1<=x<=0.9) have been synthesized by modified sol-gel method and subsequent annealing at 1250 deg. C in 1 atm of flowing argon. X-ray diffraction (XRD) analysis and electrical resistivity have been measured at room temperature. Rietveld refinement shows that all compositions with x>0.1 were found to crystallize in the tetragonal K{sub 2}NiF{sub 4} type structure in the space group I4/mmm, while for x=0.1, a mixture of two phases with the tetragonal space group I4/mmm and the orthorhombic space group Fmmm. Variations of a and c parameters show a complex behavior with increasing chromium content. It was established that compounds with chromium content less then x<=0.5 are oxygen-deficient, while for x>0.5 the sample are oxygen-overstoichiometric. The NdSrNi{sub 0.5}Cr{sub 0.5}O{sub 4+{delta}} compound exhibits semiconductive behavior and the electrical transport mechanism agrees with the non-adiabatic small polaron hopping model in the temperature ranges 298-493, 493-573 and 573-703 K separately. - Graphical abstract: The X-ray pattern of the x=0.1 sample showed a shift of some Bragg reflections that was indicative of a unit cell of lower symmetry. Two distortions of the I4/mmm K{sub 2}NiF{sub 4} aristotype cell to orthorhombic symmetry are known, Fmmm and I mmm, depending on which of the <1 0 0> and <1 1 0> sets of mirror planes and twofold axes are lost together with the fourfold axis when the symmetry is lowered

  2. Effect of air annealing on structural and magnetic properties of Ni/NiO nanoparticles

    NASA Astrophysics Data System (ADS)

    Nadeem, K.; Ullah, Asmat; Mushtaq, M.; Kamran, M.; Hussain, S. S.; Mumtaz, M.

    2016-11-01

    We reported systematic study on structural and magnetic properties of nickel/nickel oxide (Ni/NiO) nanoparticles annealed under air atmosphere at different temperatures in the range 400-800 °C. The XRD spectra revealed two phases such as Ni and NiO. The average crystallite size increases with increasing annealing temperature. A phase diagram was developed between two phases versus annealing temperature using XRD analysis. At lower annealing temperatures, Ni phase is dominant which does not easily undergo oxidation to form NiO. The NiO phase increases with increasing annealing temperature. FTIR spectroscopy revealed an increase in the NiO phase content at higher annealing temperature, which is in agreement with the XRD analysis. SEM images showed that nanoparticles are well separated at lower annealing temperatures but get agglomerated at higher annealing temperatures. The ferromagnetic (FM) Ni phase content and saturation magnetization (Ms) showed nearly the same trend with increasing annealing temperature. The nanoparticles annealed at 500 °C and 800 °C revealed highest and lowest Ms values, respectively, which is in accordance with the XRD phase diagram. Coercivity showed an overall decreasing trend with increasing annealing temperature due to decreased concentration of FM Ni phase and increasing average crystallite size. All these measurements indicate that the structural and magnetic properties of Ni/NiO nanoparticles are strongly influenced by the annealing temperature.

  3. Porous NiTi shape memory alloys produced by SHS: microstructure and biocompatibility in comparison with Ti2Ni and TiNi3.

    PubMed

    Bassani, Paola; Panseri, Silvia; Ruffini, Andrea; Montesi, Monica; Ghetti, Martina; Zanotti, Claudio; Tampieri, Anna; Tuissi, Ausonio

    2014-10-01

    Shape memory alloys based on NiTi have found their main applications in manufacturing of new biomedical devices mainly in surgery tools, stents and orthopedics. Porous NiTi can exhibit an engineering elastic modulus comparable to that of cortical bone (12-17 GPa). This condition, combined with proper pore size, allows good osteointegration. Open cells porous NiTi was produced by self propagating high temperature synthesis (SHS), starting from Ni and Ti mixed powders. The main NiTi phase is formed during SHS together with other Ni-Ti compounds. The biocompatibility of such material was investigated by single culture experiment and ionic release on small specimen. In particular, NiTi and porous NiTi were evaluated together with elemental Ti and Ni reference metals and the two intermetallic TiNi3, Ti2Ni phases. This approach permitted to clearly identify the influence of secondary phases in porous NiTi materials and relation with Ni-ion release. The results indicated, apart the well-known high toxicity of Ni, also toxicity of TiNi3, whilst phases with higher Ti content showed high biocompatibility. A slightly reduced biocompatibility of porous NiTi was ascribed to combined effect of TiNi3 presence and topography that requires higher effort for the cells to adapt to the surface.

  4. Porous NiTi shape memory alloys produced by SHS: microstructure and biocompatibility in comparison with Ti2Ni and TiNi3.

    PubMed

    Bassani, Paola; Panseri, Silvia; Ruffini, Andrea; Montesi, Monica; Ghetti, Martina; Zanotti, Claudio; Tampieri, Anna; Tuissi, Ausonio

    2014-10-01

    Shape memory alloys based on NiTi have found their main applications in manufacturing of new biomedical devices mainly in surgery tools, stents and orthopedics. Porous NiTi can exhibit an engineering elastic modulus comparable to that of cortical bone (12-17 GPa). This condition, combined with proper pore size, allows good osteointegration. Open cells porous NiTi was produced by self propagating high temperature synthesis (SHS), starting from Ni and Ti mixed powders. The main NiTi phase is formed during SHS together with other Ni-Ti compounds. The biocompatibility of such material was investigated by single culture experiment and ionic release on small specimen. In particular, NiTi and porous NiTi were evaluated together with elemental Ti and Ni reference metals and the two intermetallic TiNi3, Ti2Ni phases. This approach permitted to clearly identify the influence of secondary phases in porous NiTi materials and relation with Ni-ion release. The results indicated, apart the well-known high toxicity of Ni, also toxicity of TiNi3, whilst phases with higher Ti content showed high biocompatibility. A slightly reduced biocompatibility of porous NiTi was ascribed to combined effect of TiNi3 presence and topography that requires higher effort for the cells to adapt to the surface. PMID:24928669

  5. Characterization of Electrodeposited Nanoporous Ni and NiCu Films

    NASA Astrophysics Data System (ADS)

    Koboski, Kyla; Hampton, Jennifer

    2013-03-01

    Nanoporous thin films are interesting candidates to catalyze certain reactions because of their large surface areas. This project focuses on the deposition of Ni and NiCu thin films on a Au substrate and further explores the catalysis of the hydrogen evolution reaction (HER). Depositions are created using controlled potential electrolysis. Samples are then dealloyed using linear sweep voltammetry. Before and after the dealloying, all the samples are characterized using multiple techniques. Electrochemical capacitance measurements allow comparisons of sample roughness. HER measurements characterize the reactivity of the sample with respect to the specific catalytic reaction. The Tafel equation is fit to the data to obtain information about the kinetics of the HER of the samples. Other methods for characterizing the samples include scanning electron microscopy (SEM) and energy dispersive spectroscopy (EDS). The use of SEM allows images to be taken of the deposition to determine the change in the structure pre- and post- dealloy of the sample. EDS allows the elemental composition of the deposition to be determined before and after the dealloy stage. This material is based upon work supported by the National Science Foundation under RUI Grant DMR-1104725, MRI Grant CHE-1126462, MRI Grant CHE-0959282, and ARI grant PHY-0963317.

  6. Free energies of (Co, Fe, Ni, Zn)Fe₂O₄ spinels and oxides in water at high temperatures and pressure from density functional theory: results for stoichiometric NiO and NiFe₂O₄ surfaces.

    PubMed

    O'Brien, C J; Rák, Z; Brenner, D W

    2013-11-01

    A set of effective chemical potentials (ECPs) are derived that connect energies of (Co, Fe, Ni, Zn)Fe2O4 spinels and oxides calculated at 0 K from density functional theory (DFT) to free energies in high temperature and pressure water. The ECPs are derived and validated by solving a system of linear equations that combine DFT and experimental free energies for NiO, ZnO, Fe2O3, Fe3O4, FeO(OH), CoFe2O4, ZnFe2O4, NiFe2O4 and H2O. To connect to solution phase chemistry, a set of ECPs are also derived for solvated Ni(2+), Zn(2+), Fe(2+) and Fe(3+) ions using an analogous set of linear equations and the solid ECPs. The ECPs are used to calculate free energies of low index stoichiometric surfaces of nickel oxide (NiO) and nickel ferrite (NiFe2O4) in water as a function of temperature from 300 to 600 K at a pressure of 155 bar. Surface denuding at high temperatures is predicted, the implications of which for the formation of oxide corrosion products on heat transfer surfaces in light-water nuclear reactors are discussed.

  7. Free energies of (Co, Fe, Ni, Zn)Fe₂O₄ spinels and oxides in water at high temperatures and pressure from density functional theory: results for stoichiometric NiO and NiFe₂O₄ surfaces.

    PubMed

    O'Brien, C J; Rák, Z; Brenner, D W

    2013-11-01

    A set of effective chemical potentials (ECPs) are derived that connect energies of (Co, Fe, Ni, Zn)Fe2O4 spinels and oxides calculated at 0 K from density functional theory (DFT) to free energies in high temperature and pressure water. The ECPs are derived and validated by solving a system of linear equations that combine DFT and experimental free energies for NiO, ZnO, Fe2O3, Fe3O4, FeO(OH), CoFe2O4, ZnFe2O4, NiFe2O4 and H2O. To connect to solution phase chemistry, a set of ECPs are also derived for solvated Ni(2+), Zn(2+), Fe(2+) and Fe(3+) ions using an analogous set of linear equations and the solid ECPs. The ECPs are used to calculate free energies of low index stoichiometric surfaces of nickel oxide (NiO) and nickel ferrite (NiFe2O4) in water as a function of temperature from 300 to 600 K at a pressure of 155 bar. Surface denuding at high temperatures is predicted, the implications of which for the formation of oxide corrosion products on heat transfer surfaces in light-water nuclear reactors are discussed. PMID:24100344

  8. Free energies of (Co, Fe, Ni, Zn)Fe2O4 spinels and oxides in water at high temperatures and pressure from density functional theory: results for stoichiometric NiO and NiFe2O4 surfaces

    NASA Astrophysics Data System (ADS)

    O'Brien, C. J.; Rák, Z.; Brenner, D. W.

    2013-11-01

    A set of effective chemical potentials (ECPs) are derived that connect energies of (Co, Fe, Ni, Zn)Fe2O4 spinels and oxides calculated at 0 K from density functional theory (DFT) to free energies in high temperature and pressure water. The ECPs are derived and validated by solving a system of linear equations that combine DFT and experimental free energies for NiO, ZnO, Fe2O3, Fe3O4, FeO(OH), CoFe2O4, ZnFe2O4, NiFe2O4 and H2O. To connect to solution phase chemistry, a set of ECPs are also derived for solvated Ni2+, Zn2+, Fe2+ and Fe3+ ions using an analogous set of linear equations and the solid ECPs. The ECPs are used to calculate free energies of low index stoichiometric surfaces of nickel oxide (NiO) and nickel ferrite (NiFe2O4) in water as a function of temperature from 300 to 600 K at a pressure of 155 bar. Surface denuding at high temperatures is predicted, the implications of which for the formation of oxide corrosion products on heat transfer surfaces in light-water nuclear reactors are discussed.

  9. Evaluation of damage induced by high irradiation levels on α-Ni-Ni3Si eutectic structure

    NASA Astrophysics Data System (ADS)

    Camacho Olguin, Carlos Alberto; Garcia-Borquez, Arturo; González-Rodríguez, Carlos Alberto; Loran-Juanico, Jose Antonio; Cruz-Mejía, Hector

    2015-06-01

    Diluted alloys of the binary system Ni-Si have been used as target of beam of ions, electrons, neutrons and so on because in this kind of alloy occurs transformations order-disorder, when the temperature is raised. This fact has permitted to evaluate the phenomena associated with the damage induced by irradiation (DII). The results of these works have been employed to understand the behavior under irradiation of complex alloys and to evaluate the reliability of the results of mathematical simulation of the evolution of the DII. The interest in the alloy system Ni-Si has been reborn due to the necessity of developing materials, which have better resistance against the corrosion on more aggressive environments such as those generated on the nuclear power plants or those that exist out of the Earth's atmosphere. Now, a growing interest to use concentrated alloys of this binary system on diverse fields of the materials science has been taking place because up to determined concentration of silicon, a regular eutectic is formed, and this fact opens the possibility to develop lamellar composite material by directional solidification. However, nowadays, there is a lack of fundamental knowledge about the behavior of this type of lamellar structure under aggressive environments, like those mentioned before. Hence, the task of this work is to evaluate the effect that has the irradiation over the microstructure of the concentrated alloy Ni22at%Si. The dendritic region of the hypereutectic alloy consists of an intermetallic phase Ni3Si, whereas the interdendritic region is formed by the alternation of lamellas of solid solution α-Ni and intermetallic phase Ni3Si. Such kind of microstructure has the advantage to get information of the DII over different phases individually, and at the same time, about of the microstructure influence over the global damage in the alloy. The hypereutectic Ni22at%Si alloy was irradiated perpendicularly to its surface, with 3.66 MeV - Ni ions up

  10. NiO(111) nanosheets as efficient and recyclable adsorbents for dye pollutant removal from wastewater

    NASA Astrophysics Data System (ADS)

    Song, Zhi; Chen, Lifang; Hu, Juncheng; Richards, Ryan

    2009-07-01

    Semiconductor single-crystalline polar NiO(111) nanosheets with well-defined hexagonal holes have been investigated for application in dye adsorption and combustion processes. With regard to adsorption technologies, high surface area metal oxides have an advantage over activated carbon in that the adsorbed species can be combusted and the adsorbent reused in the case of metal oxides while regeneration of activated carbon remains challenging and thus the adsorbent/adsorbate system must be disposed of. Here, three typical textile dyes, reactive brilliant red X-3B, congo red and fuchsin red, were studied for removal from wastewater with two NiO systems and activated carbon. These studies revealed that the NiO(111) nanosheets exhibited much more favorable adsorptive properties than conventionally prepared nickel oxide powder (CP-NiO) obtained from thermal decomposition of nickel nitrate. The maximum adsorption capabilities of the three dyes on NiO(111) nanosheets reached 30.4 mg g-1, 35.15 mg g-1 and 22 mg g-1 for reactive brilliant red X-3B, congo red and fuchsin acid, respectively, while the maximum adsorption capabilities of the three dyes on CP-NiO were only 8.4, 13.2 and 12 mg g-1 for reactive brilliant red X-3B, congo red and fuchsin acid. To simulate the adsorption isotherm, two commonly employed models, the Langmuir and the Freundlich isotherms, were selected to explicate the interaction of the dye and NiO(111). The isotherm evaluations revealed that the Langmuir model demonstrated better fit to experimental equilibrium data than the Freundlich model. The maximum predicted adsorption capacity was 36.1 mg g-1. In addition, adsorption kinetic data of NiO(111) followed a pseudo-second-order rate for congo red. These studies infer that NiO(111) nanosheets possess desirable properties for application in adsorption and combustion applications.

  11. Thermodynamic Effect of Platinum Addition to beta-NiAl: An Initial Investigation

    NASA Technical Reports Server (NTRS)

    2005-01-01

    An initial investigation was conducted to determine the effect of platinum addition on the activities of aluminum and nickel in beta-NiAl(Pt) over the temperature range 1354 to 1692 K. These measurements were made with a multiple effusion-cell configured mass spectrometer (multi-cell KEMS). The results of this study show that Pt additions act to decreased alpha(Al) and increased the alpha(Ni) in beta-NiAl(Pt) for constant X(sub Ni)/X(sub Al) approx. = 1.13, while at constant X(sub Al) the affect of Pt on Al is greatly reduced. The measured partial enthalpies of mixing indicate Al-atoms have a strong self interaction while Ni- and Pt-atoms in have similar interactions with Al-atoms. Conversely the binding of Ni-atoms in beta-NiAl decreases with Pt addition independent of Al concentration. These initial results prove the technique can be applied to the Ni-Al-Pt system but more activity measurements are required to fully understand the thermodynamics of this system and how Pt additions improved the scaling behavior of nickel-based superalloys. In addition, with the choice of a suitable oxide material for the effusion-cell, the "closed" isothermal nature of the effusion-cell allows the direct investigation of an alloy-oxide equilibrium which resembles the "local-equilibrium" description of the metal-scale interface observed during high temperature oxidation. It is proposed that with an Al(l) + Al2O3(s) experimental reference state together with the route measurement of the relative partial-pressures of Al(g) and Al2O(g) allows the activities of O and Al2O3 to be determined along with the activities of Ni and Al. These measurements provide a direct method of investigating the thermodynamics of the metal-scale interface of a TGO-scale.

  12. Specific heat and magnetic susceptibility of CeNiSn doped with Rh.

    PubMed

    Slebarski, A; Maple, M B; Fijałkowski, M; Goraus, J

    2010-04-28

    CeNiSn is known as a semimetallic system with a small pseudogap at the Fermi energy. We investigate the effect of Rh doping on the Kondo insulator CeNiSn by means of measurements of ac magnetic susceptibility and specific heat. We show that the formation of the Kondo insulator narrow gap in CeNi(1 - x)Rh(x)Sn is associated with disorder-induced f-electron localization. For doped CeNiSn with x ≤ 0.06, the electrical resistivity data follow an activation and variable range hopping behaviour at low T, consistent with weak disorder and localization, while C/T is large, which is not a common feature of Kondo insulators. For x > 0.06, the system is metallic and exhibits non-Fermi liquid behaviour with magnetic susceptibility χ ∼ T( - n) with n ∼ 0.4 and electrical resistivity ρ ∼ T.

  13. Specific heat and magnetic susceptibility of CeNiSn doped with Rh.

    PubMed

    Slebarski, A; Maple, M B; Fijałkowski, M; Goraus, J

    2010-04-28

    CeNiSn is known as a semimetallic system with a small pseudogap at the Fermi energy. We investigate the effect of Rh doping on the Kondo insulator CeNiSn by means of measurements of ac magnetic susceptibility and specific heat. We show that the formation of the Kondo insulator narrow gap in CeNi(1 - x)Rh(x)Sn is associated with disorder-induced f-electron localization. For doped CeNiSn with x ≤ 0.06, the electrical resistivity data follow an activation and variable range hopping behaviour at low T, consistent with weak disorder and localization, while C/T is large, which is not a common feature of Kondo insulators. For x > 0.06, the system is metallic and exhibits non-Fermi liquid behaviour with magnetic susceptibility χ ∼ T( - n) with n ∼ 0.4 and electrical resistivity ρ ∼ T. PMID:21386423

  14. Modeling and Characterization of the Magnetocaloric Effect in Ni2MnGa Materials

    SciTech Connect

    Nicholson, Don M; Odbadrakh, Khorgolkhuu; Rios, Orlando; Hodges, Jason P; Ludtka, Gerard Michael; Porter, Wallace D; Sefat, A. S.; Rusanu, Aurelian; Evans III, Boyd Mccutchen

    2012-01-01

    Magnetic shape memory alloys have great promise as magneto-caloric effect refrigerant materials due to their combined magnetic and structural transitions. Computational and experimental research is reported on the Ni2MnGa material system. The magnetic states of this system have been explored using the Wang-Landau statistical approach in conjunction with the Locally Self-consistent Multiple-Scattering (LSMS) method to explore the magnetic states responsible for the magnet-caloric effect in this material. The effects of alloying agents on the transition temperatures of the Ni2MnGa alloy were investigated using differential scanning calorimetry (DSC) and superconducting quantum interference device (SQUID). Neutron scattering experiments were performed to observe the structural and magnetic phase transformations at the Spallation Neutron Source (SNS) at Oak Ridge National Laboratory (ORNL) on alloys of Ni-Mn-Ga and Ni-Mn-Ga-Cu-Fe. Data from the observations are discussed in comparison with the computational studies.

  15. CVD Fiber Coatings for Al2O3/NiAl Composites

    NASA Technical Reports Server (NTRS)

    Boss, Daniel E.

    1995-01-01

    While sapphire-fiber-reinforced nickel aluminide (Al2O3/NiAl) composites are an attractive candidate for high-temperature structures, the significant difference in the coefficient of thermal expansion between the NiAl matrix and the sapphire fiber creates substantial residual stresses in the composite. This study seeks to produce two fiber-coating systems with the potential to reduce the residual stresses in the sapphire/NiAl composite system. Chemical vapor deposition (CVD) was used to produce both the compensating and compliant-fiber coatings for use in sapphire/NiAl composites. A special reactor was designed and built to produce the FGM and to handle the toxic nickel precursors. This process was successfully used to produce 500-foot lengths of fiber with coating thicknesses of approximately 3 microns, 5 microns, and 10 microns.

  16. Microstructural evaluation of NiTi-based films deposited by magnetron sputtering

    SciTech Connect

    Crăciunescu, Corneliu M. Mitelea, Ion Budău, Victor; Ercuţa, Aurel

    2014-11-24

    Shape memory alloy films belonging to the NiTi-based systems were deposited on heated and unheated substrates, by magnetron sputtering in a custom made system, and their structure and composition was analyzed using electron microscopy. Several substrates were used for the depositions: glass, Cu-Zn-Al, Cu-Al-Ni and Ti-NiCu shape memory alloy ribbons and kapton. The composition of the Ti-Ni-Cu films showed limited differences, compared to the one of the target and the microstructure for the DC magnetron sputtering revealed crystallized structure with features determined on peel off samples from a Si wafer. Both inter and transcrystalline fractures were observed and related to the interfacial stress developed on cooling from deposition temperature.

  17. Microstructural evaluation of NiTi-based films deposited by magnetron sputtering

    NASA Astrophysics Data System (ADS)

    Crǎciunescu, Corneliu M.; Mitelea, Ion; Budǎu, Victor; ErcuÅ£a, Aurel

    2014-11-01

    Shape memory alloy films belonging to the NiTi-based systems were deposited on heated and unheated substrates, by magnetron sputtering in a custom made system, and their structure and composition was analyzed using electron microscopy. Several substrates were used for the depositions: glass, Cu-Zn-Al, Cu-Al-Ni and Ti-NiCu shape memory alloy ribbons and kapton. The composition of the Ti-Ni-Cu films showed limited differences, compared to the one of the target and the microstructure for the DC magnetron sputtering revealed crystallized structure with features determined on peel off samples from a Si wafer. Both inter and transcrystalline fractures were observed and related to the interfacial stress developed on cooling from deposition temperature.

  18. Boron induced structure modifications in Pd-Cu-B system: new Ti2Ni-type derivative borides Pd3Cu3B and Pd5Cu5B2.

    PubMed

    Sologub, Oksana; Salamakha, Leonid P; Eguchi, Gaku; Stöger, Berthold; Rogl, Peter F; Bauer, Ernst

    2016-03-21

    The formation of two distinct derivative structures of Ti2Ni-type, interstitial Pd3Cu3B and substitutive Pd5Cu5B2, has been elucidated in Pd-Cu-B alloys from analysis of X-ray single crystal and powder diffraction data and supported by SEM. The metal atom arrangement in the new boride Pd3Cu3B (space group Fd3m, W3Fe3C-type structure, a = 1.1136(3) nm) follows the pattern of atom distribution in the CdNi-type structure. Pd5Cu5B2 (space group F(4)3m, a = 1.05273(5) nm) exhibits a non-centrosymmetric substitutive derivative of the Ti2Ni-type structure. The reduction of symmetry on passing from Ti2Ni-type structure to Pd5Cu5B2 corresponds to the loss of an inversion centre delivered by an ordered occupation of the Ni position (32e) by dissimilar atoms, Cu and B. In both structures, the boron atom centers Pd forming [BPd6] octahedra in Pd3Cu3B and [BPd6] trigonal prisms in Pd5Cu5B2. Neither a perceptible homogeneity range nor mutual solid solubility was observed for two compounds at 600 °C, while in as cast conditions Pd5Cu5B2 exhibits an extended homogeneity range formed by a partial substitution of Cu atoms (in 24f) by Pd (Pd5+xCu5-xB2, 0 ≤x≤ 1). Electrical resistivity measurements performed on Pd3Cu3B as well as on Pd-poor and Pd-rich termini of Pd5+xCu5-xB2 annealed at 600 °C and in as cast conditions respectively demonstrated the absence of any phase transitions for this compounds in the temperature region from 0.3 K to 300 K. PMID:26875687

  19. Models of the Ni-L and Ni-SIa States of the [NiFe]-Hydrogenase Active Site.

    PubMed

    Chambers, Geoffrey M; Huynh, Mioy T; Li, Yulong; Hammes-Schiffer, Sharon; Rauchfuss, Thomas B; Reijerse, Edward; Lubitz, Wolfgang

    2016-01-19

    A new class of synthetic models for the active site of [NiFe]-hydrogenases are described. The Ni(I/II)(SCys)2 and Fe(II)(CN)2CO sites are represented with (RC5H4)Ni(I/II) and Fe(II)(diphos)(CO) modules, where diphos = 1,2-C2H4(PPh2)2(dppe) or cis-1,2-C2H2(PPh2)2(dppv). The two bridging thiolate ligands are represented by CH2(CH2S)2(2-) (pdt(2-)), Me2C(CH2S)2(2-) (Me2pdt(2-)), and (C6H5S)2(2-). The reaction of Fe(pdt)(CO)2(dppe) and [(C5H5)3Ni2]BF4 affords [(C5H5)Ni(pdt)Fe(dppe)(CO)]BF4 ([1a]BF4). Monocarbonyl [1a]BF4 features an S = 0 Ni(II)Fe(II) center with five-coordinated iron, as proposed for the Ni-SIa state of the enzyme. One-electron reduction of [1a](+) affords the S = 1/2 derivative [1a](0), which, according to density functional theory (DFT) calculations and electron paramagnetic resonance and Mössbauer spectroscopies, is best described as a Ni(I)Fe(II) compound. The Ni(I)Fe(II) assignment matches that for the Ni-L state in [NiFe]-hydrogenase, unlike recently reported Ni(II)Fe(I)-based models. Compound [1a](0) reacts with strong acids to liberate 0.5 equiv of H2 and regenerate [1a](+), indicating that H2 evolution is catalyzed by [1a](0). DFT calculations were used to investigate the pathway for H2 evolution and revealed that the mechanism can proceed through two isomers of [1a](0) that differ in the stereochemistry of the Fe(dppe)CO center. Calculations suggest that protonation of [1a](0) (both isomers) affords Ni(III)-H-Fe(II) intermediates, which represent mimics of the Ni-C state of the enzyme.

  20. Cyclic and isothermal oxidation behavior at 1100 and 1200 C of Ni-20Cr, Ni-20Cr-3Mn, Ni-20Cr-3Si, and Ni-40Cr alloys

    NASA Technical Reports Server (NTRS)

    Lowell, C. E.

    1973-01-01

    Alloys of Ni-20Cr, Ni-20Cr-3Mn, Ni-20Cr-3Si, and Ni-40Cr were cyclically oxidized at 1100 and 1200 C for up to 100 hours. Oxidation behavior was judged by sample thickness and weight change, metallography, diffraction, and microprobe analysis. The least attacked were Ni-40Cr and Ni-20Cr-3Si. The alloy Ni-20Cr-3Mn was much less attacked than Ni-20Cr, but more than the other alloys. The formation of Cr2O3 accounted for the increased resistance of Ni-Cr and Ni-20Cr-3Si, and the formation of MnCr2O4 accounts for the improvement in Ni-20Cr-3mn over Ni-20Cr.

  1. Formation of Mg{sub 2}Ni with enhanced kinetics: Using MgH{sub 2} instead of Mg as a starting material

    SciTech Connect

    Zhao Bin; Fang Fang; Sun Dalin; Zhang Qingan; Wei Shiqiang; Cao Fenglei; Sun Huai; Ouyang Liuzhang; Zhu Min

    2012-08-15

    At a temperature over the decomposition point (375 Degree-Sign C) of MgH{sub 2}, the formation of Mg{sub 2}Ni is greatly enhanced from the 2MgH{sub 2}+Ni system, as compared to the 2Mg+Ni system. In support of this finding, in-situ observation of X-ray absorption fine structure of the two systems indicates that Mg---Ni bonds form faster in the 2MgH{sub 2}+Ni system than in the 2Mg+Ni system. Furthermore, theoretical modeling also shows that Mg atoms are readily released from MgH{sub 2} using much less energy and thus are more available to react with Ni once the dehydrogenation of MgH{sub 2} occurs, as compared to normal Mg. - Graphical Abstract: The formation of Mg{sub 2}Ni is greatly enhanced by using MgH{sub 2} instead of Mg at a temperature higher than the MgH{sub 2} decomposition point. Highlights: Black-Right-Pointing-Pointer A new and efficient synthesis of Mg-based compounds at a reduced temperature. Black-Right-Pointing-Pointer Mg{sub 2}Ni formation is enhanced by using MgH{sub 2} instead of Mg as a starting material. Black-Right-Pointing-Pointer XAFS results show that Mg---Ni bonds are formed faster in 4MgH{sub 2}+Ni than in 4Mg+Ni. Black-Right-Pointing-Pointer DFT calculations show that Mg atoms are released from MgH{sub 2} more readily than from Mg. Black-Right-Pointing-Pointer Mg formed by MgH{sub 2} dehydrogenation is more available to react with Ni than normal Mg.

  2. The effect of gravity on the combustion synthesis of Ni-Al and Ni3Al-TiB2 composites from elements

    NASA Technical Reports Server (NTRS)

    Varma, Arvind; Yi, Hu Chun; Mcginn, Paul J.

    1995-01-01

    Previous studies on the combustion synthesis of advanced materials indicate that combustion and structure formation mechanisms involve several stages including melting of reactants and products, spreading of the melt, droplet coalescence, diffusion and convection, buoyancy of solid particles, and densification of the liquid product. Most of these processes are affected by gravity. Conducting the combustion synthesis under microgravity conditions is expected to help elucidate the reaction mechanisms. Two systems were examined. The first involves Ni/AI cladded particles, which is an ideal system to examine the individual particle and liquid flow before combustion occurs. For comparison, elemental Ni and Al powders with the same stoichiometry as that of the cladded particles were also used in some experiments. The second system was the Ni3AITiB2 composite in which the Ni3AI (-delta H(sub f) = 153.1 kJ/mol) phase melts during reaction enabling us to examine settling of the liquid phase. The amount of liquid phase was controlled by varying the TiB2 (-delta H(sub f) = 323.8 kJ/mol) content which generates the additional heat. The overall reactions for the two systems can be expressed as follows. System 1: 4Ni + 2AI yields Ni3AI + NiA and System 2: 3Ni + Al + x (Ti + 2B) yields Ni3Al + x(TiB2). For the first system, pellets were pressed directly from the cladded particles, at green densities about 77 +/- 3% of theoretical value. For the second, the pellets were prepared by mixing the elemental reactant powders in the required stoichiometry by ball-milling and then pressing uniaxially at green densities about 70 +/- 3 percent of theoretical. The pellets were cylindrical in shape, 10 mm in diameter and length typically 20-30 mm. The pellet samples were reacted in UHP Argon (1 atm) using the experimental setup and procedure described previously. After reaction, the samples were sectioned axially in order to conduct the microstructural analysis in the longitudinal direction

  3. Mode Coupling Theory and the Glass Transition in Molecular Dynamics Simulated NiZr

    NASA Astrophysics Data System (ADS)

    Teichler, H.

    1996-01-01

    Molecular dynamics (MD) simulations for a NiZr model adapted to Hausleitner-Hafner interatomic potentials are analyzed within the mode coupling theory (MCT). Fitting numerical solutions of the (modified) schematic MCT equation with the self-intermediate scattering function of the MD system demonstrates unambiguously the transition scenario from liquidlike to nearly arrested behavior predicted by the MCT as precursor of the glass transition (around 1120 K for the present NiZr model).

  4. Imaging the Fine Structure of a Magnetic Domain Wall in a Ni Nanocylinder

    PubMed Central

    2013-01-01

    We present the first experimental imaging of the internal DW structure in 55 and 85 nm diameter Ni nanocylinders, using electron holography combined with micromagnetic calculations. We demonstrate the magnetic transition from a hybrid magnetic state with both vortex and transverse DW in 85 nm diameter Ni nanocylinders to a pure transverse wall in thinner nanowires. This is particularly important as DWs in nanocylinders are model systems to go beyond the classical Walker limit. PMID:23586647

  5. Hexagonal NiS nanobelts as advanced cathode materials for rechargeable Al-ion batteries.

    PubMed

    Yu, Zhijing; Kang, Zepeng; Hu, Zongqian; Lu, Jianhong; Zhou, Zhigang; Jiao, Shuqiang

    2016-08-16

    Hexagonal NiS nanobelts served as novel cathode materials for rechargeable Al-ion batteries based on an AlCl3/[EMIm]Cl ionic liquid electrolyte system. The nano-banded structure of the materials can facilitate the electrolyte immersion and enhance Al(3+) diffusion. The hexagonal NiS nanobelt based cathodes exhibit high storage capacity, good cyclability and low overpotential. PMID:27487940

  6. (001) Oriented piezoelectric films prepared by chemical solution deposition on Ni foils

    SciTech Connect

    Yeo, Hong Goo Trolier-McKinstry, Susan

    2014-07-07

    Flexible metal foil substrates are useful in some microelectromechanical systems applications including wearable piezoelectric sensors or energy harvesters based on Pb(Zr,Ti)O₃ (PZT) thin films. Full utilization of the potential of piezoelectrics on metal foils requires control of the film crystallographic texture. In this study, (001) oriented PZT thin films were grown by chemical solution deposition (CSD) on Ni foil and Si substrates. Ni foils were passivated using HfO₂ grown by atomic layer deposition in order to suppress substrate oxidation during subsequent thermal treatment. To obtain the desired orientation of PZT film, strongly (100) oriented LaNiO₃ films were integrated by CSD on the HfO₂ coated substrates. A high level of (001) LaNiO₃ and PZT film orientation were confirmed by X-ray diffraction patterns. Before poling, the low field dielectric permittivity and loss tangents of (001) oriented PZT films on Ni are near 780 and 0.04 at 1 kHz; the permittivity drops significantly on poling due to in-plane to out-of-plane domain switching. (001) oriented PZT film on Ni displayed a well-saturated hysteresis loop with a large remanent polarization ~36 μC/cm², while (100) oriented PZT on Si showed slanted P-E hysteresis loops with much lower remanent polarizations. The |e{sub 31,f}| piezoelectric coefficient was around 10.6 C/m² for hot-poled (001) oriented PZT film on Ni.

  7. Response of the tropical Pacific Ocean to El Niño versus global warming

    NASA Astrophysics Data System (ADS)

    Liu, Fukai; Luo, Yiyong; Lu, Jian; Wan, Xiuquan

    2016-04-01

    Climate models project an El Niño-like SST response in the tropical Pacific Ocean to global warming (GW). By employing the Community Earth System Model and applying an overriding technique to its ocean component, Parallel Ocean Program version 2, this study investigates the similarity and difference of formation mechanism for the changes in the tropical Pacific Ocean under El Niño and GW. Results show that, despite sharing some similarities between the two scenarios, there are many significant distinctions between GW and El Niño: (1) the phase locking of the seasonal cycle reduction is more notable under GW compared with El Niño, implying more extreme El Niño events in the future; (2) in contrast to the penetration of the equatorial subsurface temperature anomaly that appears to propagate in the form of an oceanic equatorial upwelling Kelvin wave during El Niño, the GW-induced subsurface temperature anomaly manifest in the form of off-equatorial upwelling Rossby waves; (3) while significant across-equator northward heat transport (NHT) is induced by the wind stress anomalies associated with El Niño, little NHT is found at the equator due to a symmetric change in the shallow meridional overturning circulation that appears to be weakened in both North and South Pacific under GW; and (4) heat budget analysis shows that the maintaining mechanisms for the eastern equatorial Pacific warming are also substantially different.

  8. Biosorption of Ni(II) from aqueous solutions by Litchi chinensis seeds.

    PubMed

    Flores-Garnica, Jonathan Gonzalo; Morales-Barrera, Liliana; Pineda-Camacho, Gabriela; Cristiani-Urbina, Eliseo

    2013-05-01

    The potential of Litchi chinensis seeds (LCS) for biosorption of Ni(II) ions from aqueous solutions was investigated in batch systems in terms of kinetics, equilibrium and thermodynamics. Experimental data showed that the biosorption capacity of LCS was dependent on operating variables such as solution pH, initial Ni(II) concentration, contact time, and temperature. The optimum pH value for Ni(II) biosorption was 7.5. Significant enhancement of Ni(II) biosorption was observed by increasing initial metal concentration and temperature. Modeling of sorption kinetics showed good agreement of experimental data with the pseudo-second-order kinetic model. Langmuir model exhibited the best fit to experimental data. According to this isotherm model, the maximum Ni(II) biosorption capacity of LCS is 66.62 mg g(-1). The calculated thermodynamic parameters showed that the biosorption of Ni(II) ions is an endothermic and non-spontaneous process. Results indicate that LCS can be used as an effective and environmentally friendly biosorbent to detoxify Ni(II)-polluted wastewaters.

  9. Electronic and magnetic properties of X-doped (X=Ni, Pd, Pt) WS2 monolayer

    NASA Astrophysics Data System (ADS)

    Zhao, Xu; Xia, Congxin; Dai, Xianqi; Wang, Tianxing; Chen, Peng; Tian, Liang

    2016-09-01

    We investigate the electronic and magnetic properties of X-doped (X=Ni, Pd, Pt) WS2 monolayer using the first-principles methods based on density functional theory. The results show that WS2 monolayer doped by Ni, Pd and Pt is ferromagnetic. The impurity states near the Fermi level depend highly on the atomic size and electronegativity. For different X-doped WS2, the formation energy is lower under S-rich conditions, which indicates that it is energy favorable and relatively easier to incorporate X atom into WS2 under S-rich experimental conditions. Moreover, Ni-doped system owns the lowest formation energy compared with other atoms under S-rich experimental condition. Our studies predict X-doped (X=Ni, Pd, Pt) WS2 monolayers to be candidates for thin dilute magnetic semiconductors. Ni-doped WS2 has relatively wide half-metallic gap. So Ni-doped WS2 is the most ideal for spin injection among Ni, Pd, and Pt, which is important for application in semiconductor spintronics.

  10. Antiferromagnetic Spin Reorientation Transition induced by the coupling at NiO/CoO interface

    NASA Astrophysics Data System (ADS)

    Zhu, Jie; Li, Qian; Li, Junxue; Ding, Zhao; Liang, Jianhui; Xiao, Xia; Wu, Yizheng; Hua, C. Y.; Huang, M. J.; Lin, H.-J.; Department of Physics, Fudan University Collaboration; National Synchrotron Radiation Research Center Collaboration

    2014-03-01

    Manipulating the antiferromagnetic (AFM) spin orientation is important for spitronic researches. But AFM spin-reorientation transition (SRT) can be realized only through limited mechanisms. In this contribution, we realized an in-plane to out-of-plane AFM SRT in NiO/CoO/MgO(001) system through a new mechanism, i.e., the exchange coupling between AFM spins. NiO and CoO spin orientations were determined by X-ray magnetic linear dichroism (XMLD) measurements. The CoO spin was fixed in-plane below Néel temperature (TN) , while the NiO spin undergoes an in-plane to out-of-plane SRT above a critical NiO thickness. The SRT is attributed to the competition between NiO out-of-plane anisotropy from expansive strain and in-plane anisotropy from interfacial coupling with CoO spin. The SRT was influenced by CoO AFM ordering modulated by temperature, CoO thickness and interfacial coupling strength tuned by the thickness of MgO layer inserted between NiO and CoO. Besides, temperature-dependent XMLD measurement indicated a rise of CoO TN by 80K with the proximity effect from NiO. Our experimental results can be further understood by Monte Carlo simulations.

  11. New NiCd Battery Standard and Guide

    NASA Technical Reports Server (NTRS)

    Milden, M. J.

    1982-01-01

    The preparation and contents guides designed to provide specifications and standards for NiCd batteries for space missions are discussed. Requirements were established to assure proper in orbit performance and compliance with handling procedures to minimize degradation. The guides were designed to benefit both industries and the military. The surveys include: reasons given for and against the use of flight batteries in systems tests; use of rechargeable batteries during space vehicle testing; and military standards and specifications.

  12. 3D-nanoarchitectured Pd/Ni catalysts prepared by atomic layer deposition for the electrooxidation of formic acid.

    PubMed

    Assaud, Loïc; Monyoncho, Evans; Pitzschel, Kristina; Allagui, Anis; Petit, Matthieu; Hanbücken, Margrit; Baranova, Elena A; Santinacci, Lionel

    2014-01-01

    Three-dimensionally (3D) nanoarchitectured palladium/nickel (Pd/Ni) catalysts, which were prepared by atomic layer deposition (ALD) on high-aspect-ratio nanoporous alumina templates are investigated with regard to the electrooxidation of formic acid in an acidic medium (0.5 M H2SO4). Both deposition processes, Ni and Pd, with various mass content ratios have been continuously monitored by using a quartz crystal microbalance. The morphology of the Pd/Ni systems has been studied by electron microscopy and shows a homogeneous deposition of granularly structured Pd onto the Ni substrate. X-ray diffraction analysis performed on Ni and NiO substrates revealed an amorphous structure, while the Pd coating crystallized into a fcc lattice with a preferential orientation along the [220]-direction. Surface chemistry analysis by X-ray photoelectron spectroscopy showed both metallic and oxide contributions for the Ni and Pd deposits. Cyclic voltammetry of the Pd/Ni nanocatalysts revealed that the electrooxidation of HCOOH proceeds through the direct dehydrogenation mechanism with the formation of active intermediates. High catalytic activities are measured for low masses of Pd coatings that were generated by a low number of ALD cycles, probably because of the cluster size effect, electronic interactions between Pd and Ni, or diffusion effects.

  13. 3D-nanoarchitectured Pd/Ni catalysts prepared by atomic layer deposition for the electrooxidation of formic acid

    PubMed Central

    Assaud, Loïc; Monyoncho, Evans; Pitzschel, Kristina; Allagui, Anis; Petit, Matthieu; Hanbücken, Margrit

    2014-01-01

    Summary Three-dimensionally (3D) nanoarchitectured palladium/nickel (Pd/Ni) catalysts, which were prepared by atomic layer deposition (ALD) on high-aspect-ratio nanoporous alumina templates are investigated with regard to the electrooxidation of formic acid in an acidic medium (0.5 M H2SO4). Both deposition processes, Ni and Pd, with various mass content ratios have been continuously monitored by using a quartz crystal microbalance. The morphology of the Pd/Ni systems has been studied by electron microscopy and shows a homogeneous deposition of granularly structured Pd onto the Ni substrate. X-ray diffraction analysis performed on Ni and NiO substrates revealed an amorphous structure, while the Pd coating crystallized into a fcc lattice with a preferential orientation along the [220]-direction. Surface chemistry analysis by X-ray photoelectron spectroscopy showed both metallic and oxide contributions for the Ni and Pd deposits. Cyclic voltammetry of the Pd/Ni nanocatalysts revealed that the electrooxidation of HCOOH proceeds through the direct dehydrogenation mechanism with the formation of active intermediates. High catalytic activities are measured for low masses of Pd coatings that were generated by a low number of ALD cycles, probably because of the cluster size effect, electronic interactions between Pd and Ni, or diffusion effects. PMID:24605281

  14. 3D-nanoarchitectured Pd/Ni catalysts prepared by atomic layer deposition for the electrooxidation of formic acid.

    PubMed

    Assaud, Loïc; Monyoncho, Evans; Pitzschel, Kristina; Allagui, Anis; Petit, Matthieu; Hanbücken, Margrit; Baranova, Elena A; Santinacci, Lionel

    2014-01-01

    Three-dimensionally (3D) nanoarchitectured palladium/nickel (Pd/Ni) catalysts, which were prepared by atomic layer deposition (ALD) on high-aspect-ratio nanoporous alumina templates are investigated with regard to the electrooxidation of formic acid in an acidic medium (0.5 M H2SO4). Both deposition processes, Ni and Pd, with various mass content ratios have been continuously monitored by using a quartz crystal microbalance. The morphology of the Pd/Ni systems has been studied by electron microscopy and shows a homogeneous deposition of granularly structured Pd onto the Ni substrate. X-ray diffraction analysis performed on Ni and NiO substrates revealed an amorphous structure, while the Pd coating crystallized into a fcc lattice with a preferential orientation along the [220]-direction. Surface chemistry analysis by X-ray photoelectron spectroscopy showed both metallic and oxide contributions for the Ni and Pd deposits. Cyclic voltammetry of the Pd/Ni nanocatalysts revealed that the electrooxidation of HCOOH proceeds through the direct dehydrogenation mechanism with the formation of active intermediates. High catalytic activities are measured for low masses of Pd coatings that were generated by a low number of ALD cycles, probably because of the cluster size effect, electronic interactions between Pd and Ni, or diffusion effects. PMID:24605281

  15. Quasirelativistic calculation of the vibronic spectra of NiH and NiD

    NASA Astrophysics Data System (ADS)

    Marian, C. M.

    1990-07-01

    Large ab initio calculations on the low-lying 2Δ, 2Π, and 2Σ+ electronic states of NiH have been performed employing a relativistically corrected Hamiltonian. The relative ordering of the unperturbed electronic states is found to be 2Δ<2Σ+<2Π. Diagonal and off-diagonal spin-orbit matrix elements have been evaluated within the Breit-Pauli approximation and were used to couple the individual vibronic functions. With the exception of <2Σ+1/2‖HSO‖2Π1/2>, the spin-orbit matrix elements are found to be nearly independent of the internuclear distance. Their magnitude is determined by coupling matrix elements of the components of a pure atomic d9 configuration. The deflection of the <2Σ+1/2‖HSO‖2Π1/2> matrix element from the d9 limit at shorter bond distances can be attributed to increased admixture of d10 character in the 2Σ+ wave function. For NiH the v=0, J=2.5 level of the 2Δ3/2 state is calculated at 1014 cm-1, in excellent agreement with experiments (1012 cm-1). The lower of the heavily mixed 2Σ+1/2 and 2Π1/2 combinations with total angular momentum J=2.5 is located at 2279 cm-1, approximately 150 cm-1 above the corresponding experimental value. Shifting the 2Σ+ potential curve by -250 cm-1 brings the calculated levels of the Ω=1/2 system into almost perfect agreement with observed levels averaged over e and f components. The upper, experimentally not yet determined component is predicted at approximately 3655 cm-1, close to the v=2 level of the 2Δ5/2 state. The 2Π3/2 v=0, J=2.5 and the 2Δ3/2 v=1, J=2.5 levels, located at 2631 and 3091 cm-1, are considerably mixed. Excitation energies to several higher-lying vibronic states of NiH and a corresponding analysis of the vibronic spectrum of the NiD isotope are also reported.

  16. Who is El Niño?

    NASA Astrophysics Data System (ADS)

    Philander, S. George

    It is a curious story, about a phenomenon we first welcomed as a blessing but now view with dismay, if not horror [Philander, 1998]. We named it El Niño for the child Jesus, provided it with relatives—La Niña and ENSO—and are devoting innumerable studies to the description and idealization of this family. These scriptures provide such a broad spectrum of historical, cultural, and scientific perspectives that there is now confusion about the identity of El Niño. Trenberth [1997] summarizes the situation as follows.The atmospheric component tied to El Niño is termed the “Southern Oscillation.” Scientists often call the phenomenon where the atmosphere and ocean collaborate ENSO, short for El Niño-Southern Oscillation. El Niño then corresponds to the warm phase of ENSO. The opposite “La Niña” (“the girl” in Spanish) phase consists of a basinwide cooling of the tropical Pacific and thus the cold phase of ENSO. However, for the public, the term for the whole phenomenon is “El Niño.”

  17. Ion scattering experiment on Ni(110) surface

    SciTech Connect

    Nicholas, B.; Rambabu, B.; Collins, W.E.

    1986-01-01

    Light emission from excited neutral scattered Ne and sputtered Ni were investigated using the LEIS method. A 5-keV Ne/sup +/ beam was used to bombard a Ni(110) surface. Results of the light emission data is presented and compared with neutral production of Ne. 4 refs., 3 figs.

  18. Water dissociation on Ni(100) and Ni(111): Effect of surface temperature on reactivity

    SciTech Connect

    Seenivasan, H.; Tiwari, Ashwani K.

    2013-11-07

    Water adsorption and dissociation on Ni(100) and Ni(111) surfaces are studied using density functional theory calculations. Water adsorbs on top site on both the surfaces, while H and OH adsorb on four fold hollow and three fold hollow (fcc) sites on Ni(100) and Ni(111), respectively. Transition states (TS) on both surfaces are identified using climbing image-nudged elastic band method. It is found that the barrier to dissociation on Ni(100) surface is slightly lower than that on Ni(111) surface. Dissociation on both the surfaces is exothermic, while the exothermicity on Ni(100) is large. To study the effect of lattice motion on the energy barrier, TS calculations are performed for various values of Q (lattice atom coordinate along the surface normal) and the change in the barrier height and position is determined. Calculations show that the energy barrier to reaction decreases with increasing Q and increases with decreasing Q on both the surfaces. Dissociation probability values at different surface temperatures are computed using semi-classical approximation. Results show that the influence of surface temperature on dissociation probability on the Ni(100) is significantly larger compared to that of Ni(111). Moreover, on Ni(100), a dramatic shift in energy barrier to lower incident energy values is observed with increasing surface temperature, while the shift is smaller in the case of Ni(111)

  19. Preparation and characterization of Ni-P/Ni3.1B composite alloy coatings

    NASA Astrophysics Data System (ADS)

    Wang, Yurong; He, Jiawei; Wang, Wenchang; Shi, Jianhua; Mitsuzaki, Naotoshi; Chen, Zhidong

    2014-02-01

    The preparation of Ni-P/Ni3.1B composite alloy coating on the surface of copper was achieved by co-deposition of Ni3.1B nanoparticles with Ni-P coating during electroless plating. Ni-P-B alloy coating was obtained by heat-treating the as-plated Ni-P/Ni3.1B composite coating. The effect of the concentration of sodium alginate, borax, thiourea, Ni3.1B, temperature, and pH value on the deposition rate and B content were investigated and determined to be: 30 g L-1, 10 g L-1, 2 mg L-1, 20 mg L-1, 70 °C and 9.0 , respectively. Sodium alginate and thiourea were played as surfactant for coating Ni3.1B nanoparticles and stabilizer for the plating bath, respectively. Ni-P/Ni3.1B composite coating had good performance such as corrosion resistance and solderability.

  20. Plasma-Sprayed High Entropy Alloys: Microstructure and Properties of AlCoCrFeNi and MnCoCrFeNi

    NASA Astrophysics Data System (ADS)

    Ang, Andrew Siao Ming; Berndt, Christopher C.; Sesso, Mitchell L.; Anupam, Ameey; S, Praveen; Kottada, Ravi Sankar; Murty, B. S.

    2015-02-01

    High entropy alloys (HEAs) represent a new class of materials that present novel phase structures and properties. Apart from bulk material consolidation methods such as casting and sintering, HEAs can also be deposited as a surface coating. In this work, thermal sprayed HEA coatings are investigated that may be used as an alternative bond coat material for a thermal barrier coating system. Nanostructured HEAs that were based on AlCoCrFeNi and MnCoCrFeNi were prepared by ball milling and then plasma sprayed. Splat studies were assessed to optimise the appropriate thermal spray parameters and spray deposits were prepared. After mechanical alloying, aluminum-based and manganese-based HEA powders revealed contrary prominences of BCC and FCC phases in their X-ray diffraction patterns. However, FCC phase was observed as the major phase present in both of the plasma-sprayed AlCoCrFeNi and MnCoCrFeNi coatings. There were also minor oxide peaks detected, which can be attributed to the high temperature processing. The measured porosity levels for AlCoCrFeNi and MnCoCrFeNi coatings were 9.5 ± 2.3 and 7.4 ± 1.3 pct, respectively. Three distinct phase contrasts, dark gray, light gray and white, were observed in the SEM images, with the white regions corresponding to retained multicomponent HEAs. The Vickers hardness (HV0.3kgf) was 4.13 ± 0.43 and 4.42 ± 0.60 GPa for AlCoCrFeNi and MnCoCrFeNi, respectively. Both type of HEAs coatings exhibited anisotropic mechanical behavior due to their lamellar, composite-type microstructure.

  1. Removal of Ni(II) and Cu(II) ions using native and acid treated Ni-hyperaccumulator plant Alyssum discolor from Turkish serpentine soil.

    PubMed

    Bayramoglu, Gulay; Arica, M Yakup; Adiguzel, Nezaket

    2012-09-01

    Alyssum discolor biomass was collected from serpentine soil and was used for removal of metal ions. The plant species grown on serpentine soils are known to be rich with metals ions and thus have more capability for accumulating heavy metals. Native and acid-treated biomass of A. discolor (A. discolor) were utilized for the removal of Ni(II) and Cu(II) ions from aqueous solutions. The effects of contact time, initial concentration, and pH on the biosorption of Ni(II) and Cu(II) ions were investigated. Biosorption equilibrium was established in about 60 min. The surface properties of the biomass preparations were varied with pH, and the maximum amounts of Ni(II) and Cu(II) ions on both A. discolor biomass preparations were adsorbed at pH 5.0. The maximum biosorption capacities of the native, and acid-treated biomass preparations for Ni(II) were 13.1 and 34.7 mgg(-1) and for Cu(II) 6.15 and 17.8 mgg(-1) dry biomass, respectively. The biosorption of Ni(II) and Cu(II) ions from single and binary component systems can be successfully described by Langmuir and Freundlich isotherms. When the heavy metal ions were in competition, the amounts of biosorbed metal ions on the acid treated plant biomass were found to be 0.542 mmolg(-1) for Ni(II) and 0.162 mmolg(-1) for Cu(II), the A. discolor biomass was significantly selective for Ni(II) ions. The information gained from these studies was expected to indicate whether the native, and acid-treated forms can have the potential to be used for the removal and recovery of Ni(II) ions from wastewaters. PMID:22608134

  2. Skeletal Ni Catalysts Prepared from Amorphous Ni-Zr Alloys: Enhanced Catalytic Performance for Hydrogen Generation from Ammonia Borane.

    PubMed

    Nozaki, Ai; Tanihara, Yasutomo; Kuwahara, Yasutaka; Ohmichi, Tetsutaro; Mori, Kohsuke; Nagase, Takeshi; Yasuda, Hiroyuki Y; Yamashita, Hiromi

    2016-02-01

    Skeletal Ni catalysts were prepared from Ni-Zr alloys, which possess different chemical composition and atomic arrangements, by a combination of thermal treatment and treatment with aqueous HF. Hydrogen generation from ammonia borane over the skeletal Ni catalysts proceeded efficiently, whereas the amorphous Ni-Zr alloy was inactive. Skeletal Ni prepared from amorphous Ni30 Zr70 alloy had a higher catalytic activity than that prepared from amorphous Ni40 Zr60 and Ni50 Zr50 alloys. The atomic arrangement of the Ni-Zr alloy also strongly affected the surface structure and catalytic activities. Thermal treatment of the amorphous Ni-Zr alloys at a temperature slightly lower than the crystallization temperature led to an increase of the number of surface-exposed Ni atoms and an enhancement of the catalytic activities for hydrogen generation from ammonia borane. The skeletal Ni catalysts also showed excellent durability and recyclability.

  3. Synthesis and characterization of Lithium-ion cathode materials in the system (1-x-y) LiNi0.8Co0.15Al0.05O 2.xLi2MnO3.yLiCoO2

    NASA Astrophysics Data System (ADS)

    Yerramilli, Anish

    Energy storage technology has been dominated by lithium ion batteries, which are considered the most promising with higher energy density compared to any other battery technologies. The market for lithium ion batteries has increased rapidly from 2007. Goals set by the U.S Department of Energy for hybrid electric vehicles have not been met by any of the existing cathode materials. The objective of this thesis was to find a material composition that has better cyclability and lower cost than the standard battery materials. A ternary composition with low cost materials like Al, Mn and Ni were used instead of high amounts of Co to reduce the cost of the battery. It was hypothesized that there are cathode compositions in the system (1-x-y) LiNi0.8Co0.15Al0.05O2.xLi2MnO3.yLiCoO2 that when tested for discharge capacities and cyclability will show better properties than the current generation lithium ion cathode materials. The system (1-x-y) LiNi0.8Co0.15Al0.05O2.xLi2MnO3.yLiCoO2 is synthesized using a simple sol-gel synthesis. The materials LiNi0.8Co0.15Al0.05O2, Li2MnO3 and LiCoO2 were used as end points in a ternary composition diagram. Twenty eight cathode compositions spanning the entire ternary composition diagram were synthesized under the same conditions and characterized using X-ray diffraction (XRD) and an Arbin BT2000 battery testing system. XRD results showed α-NaFeO2 structure with a space group of R3m. The results from electrochemical testing revealed a wide range of electrochemical capacities and cyclabilities. The regions close to Li2MnO3 showed high capacities and cyclability. The material with composition Li1.5 Ni0.133Co0.358Al0.008Mn0.5 had an initial discharge capacity of 216.3 mAh/g and retained this capacity even after multiple cycles in the voltage range of 4.6-2 V at a rate of C/15. Statistical analysis was done using SAS/STAT 9.2 with the ADX procedure to fit a general linear model with three linear terms and three two way interactions to map

  4. A ternary Ni-Al-W EAM potential for Ni-based single crystal superalloys

    NASA Astrophysics Data System (ADS)

    Fan, Qin-Na; Wang, Chong-Yu; Yu, Tao; Du, Jun-Ping

    2015-01-01

    Based on experiments and first-principles calculations, a ternary Ni-Al-W embedded-atom-method (EAM) potential is constructed for the Ni-based single crystal superalloys. The potential predicts that W atoms do not tend to form clusters in γ(Ni), which is consistent with experiments. The impurity diffusion of W in γ(Ni) is investigated using the five-frequency model. The diffusion coefficients and the diffusion activation energy of W are in reasonable agreement with the data in literatures. By W doping, the lattice misfit between the two phases decreases and the elastic constants of γ‧(Ni3Al) increase. As for alloyed elements Co, Re and W, the pinning effect of solute atom on the γ(Ni)/γ‧(Ni3Al) misfit dislocation increases with the increasing of the atomic radius.

  5. Direct observation of infinite NiO2 planes in LaNiO2 films

    NASA Astrophysics Data System (ADS)

    Ikeda, Ai; Krockenberger, Yoshiharu; Irie, Hiroshi; Naito, Michio; Yamamoto, Hideki

    2016-06-01

    Epitaxial thin films of LaNiO2, which is an oxygen-deficient perovskite with “infinite layers” of Ni1+O2, were prepared by a low-temperature reduction of LaNiO3 single-crystal films on NdGaO3 substrates. We report the high-angle annular dark-field and bright-field scanning transmission electron microscopy observations of infinite NiO2 planes of c-axis-oriented LaNiO2 epitaxial thin films with a layer stacking sequence of NiO2/La/NiO2. Resistivity measurements on the films show T 2 dependence between 400 and 150 K and a negative Hall coefficient.

  6. Nanoscale structural heterogeneity in Ni-rich half-Heusler TiNiSn

    SciTech Connect

    Douglas, Jason E. Pollock, Tresa M.; Chater, Philip A.; Brown, Craig M.; Seshadri, Ram

    2014-10-28

    The structural implications of excess Ni in the TiNiSn half-Heusler compound are examined through a combination of synchrotron x-ray and neutron scattering studies, in conjunction with first principles density functional theory calculations on supercells. Despite the phase diagram suggesting that TiNiSn is a line compound with no solid solution, for small x in TiNi{sub 1+x}Sn there is indeed an appearance—from careful analysis of the scattering—of some solubility, with the excess Ni occupying the interstitial tetrahedral site in the half-Heusler structure. The analysis performed here would point to the excess Ni not being statistically distributed, but rather occurring as coherent nanoclusters. First principles calculations of energetics, carried out using supercells, support a scenario of Ni interstitials clustering, rather than a statistical distribution.

  7. Origin of spontaneous exchange bias in Co/NiMn bilayer structure

    NASA Astrophysics Data System (ADS)

    Akbulut, A.; Akbulut, S.; Yildiz, F.

    2016-11-01

    Spontaneous exchange bias (EB) is reported for as deposited Si/Pt(tPt)/Ni45Mn55(tAFM/Co(tFM)/Pt(30 Å) thin film system without requiring any post annealing, deposition with field or field cooling procedures. Magnetic properties of this system were investigated with respect to thicknesses of buffer Pt layer (tPt), antiferromagnetic NiMn layer (tAFM) and ferromagnetic Co layer (tFM). Exchange coupling between NiMn and Co layers enhanced considerably by increasing tPt. In order to observe a spontaneous EB in the system, Pt buffer layer must be thicker than a certain thickness, and NiMn layer must be grown directly on the buffer layer. On the other hand, significant increments in the coercive fields (HC) were reported for thinner Pt buffer layers. The thickness ranges for Co and NiMn layers were also determined to obtain spontaneous EB. This spontaneous EB is discussed to be a result of NiMn (111) texture which is induced by Pt buffer layer. Greater EB fields (HEB) are measured for the samples in the negative field direction by the effect of annealing and field cooling (from 400 K to 300 K at 2 kOe).

  8. Oscillatory surface relaxations in Ni, Al, and their ordered alloys

    SciTech Connect

    Chen, S.P.; Voter, A.F.; Srolovitz, D.J.

    1986-09-15

    Results from simulations of Ni, Al, Ni/sub 3/Al, and NiAl show long-range, oscillatory surface relaxations that decay exponentially into the bulk. Pure fcc Ni and Al have oscillation periods that are close to the nearest-neighbor distance, independent of crystal face. This is shown to be due to surface smoothing and steric effects. In Ni/sub 3/Al and NiAl, the surface planes are rippled, with the Ni-Ni and Al-Al interlayer spacings oscillating 180/sup 0/ out of phase. Very good agreement between our results and experimentally measured atomic relaxations is obtained.

  9. XAFS study of Ni (II) aminovinylketone complexes

    NASA Astrophysics Data System (ADS)

    Yalovega, Galina E.; Vlasenko, Valerii G.; Uraev, Ali I.; Garnovskii, Alexander D.; Soldatov, Alexander V.

    2006-11-01

    The functional properties of the active sites in a metalloproteins depend on coordination geometry of metal, the number and the nature of coordination ligands. The Ni K-edge XAFS spectra of novel nickel complexes as models for the MeN 2O 2(S 2) active site in metalloproteins were measured and analyzed. Theoretical analysis of the Ni K-edge XANES was performed using FDMNES code based on the finite difference method (FDM) to solve the Schrödinger equation beyond muffin-tin approximations and self-consistent full multiple-scattering approach (code FEFF8.2). It was found that the spectrum is almost totally formed by the octahedron of the nearest neighbor atoms around Ni ion in the II (Ni) complex. The III (Ni) complex active center exists in square-planar configuration with shorter distances.

  10. Tensile deformation of NiTi wires.

    PubMed

    Gall, Ken; Tyber, Jeff; Brice, Valerie; Frick, Carl P; Maier, Hans J; Morgan, Neil

    2005-12-15

    We examine the structure and properties of cold drawn Ti-50.1 at % Ni and Ti-50.9 at % Ni shape memory alloy wires. Wires with both compositions possess a strong <111> fiber texture in the wire drawing direction, a grain size on the order of micrometers, and a high dislocation density. The more Ni rich wires contain fine second phase precipitates, while the wires with lower Ni content are relatively free of precipitates. The wire stress-strain response depends strongly on composition through operant deformation mechanisms, and cannot be explained based solely on measured differences in the transformation temperatures. We provide fundamental connections between the material structure, deformation mechanisms, and resulting stress-strain responses. The results help clarify some inconsistencies and common misconceptions in the literature. Ramifications on materials selection and design for emerging biomedical applications of NiTi shape memory alloys are discussed.

  11. Charge ordering in Ni1 +/Ni2 + nickelates: La4Ni3O8 and La3Ni2O6

    NASA Astrophysics Data System (ADS)

    Botana, Antia S.; Pardo, Victor; Pickett, Warren E.; Norman, Michael R.

    2016-08-01

    Ab initio calculations allow us to establish a close connection between the Ruddlesden-Popper layered nickelates and cuprates not only in terms of filling of d levels (close to d9) but also because they show Ni1 +(S =1 /2 ) /Ni2 +(S =0 ) stripe ordering. The insulating charge-ordered ground state is obtained from a combination of structural distortions and magnetic order. The Ni2 + ions are in a low-spin configuration (S =0 ) yielding an antiferromagnetic arrangement of Ni1 + S =1 /2 ions like the long-sought spin-1/2 antiferromagnetic insulator analog of the cuprate parent materials. The analogy extends further with the main contribution to the bands near the Fermi energy coming from hybridized Ni dx2-y2 and O p states.

  12. NiAl alloys for structural uses

    NASA Technical Reports Server (NTRS)

    Koss, D. A.

    1991-01-01

    Alloys based on the intermetallic compound NiAl are of technological interest as high temperature structural alloys. These alloys possess a relatively low density, high melting temperature, good thermal conductivity, and (usually) good oxidation resistance. However, NiAl and NiAl-base alloys suffer from poor fracture resistance at low temperatures as well as inadequate creep strength at elevated temperatures. This research program explored macroalloying additions to NiAl-base alloys in order to identify possible alloying and processing routes which promote both low temperature fracture toughness and high temperature strength. Initial results from the study examined the additions of Fe, Co, and Hf on the microstructure, deformation, and fracture resistance of NiAl-based alloys. Of significance were the observations that the presence of the gamma-prime phase, based on Ni3Al, could enhance the fracture resistance if the gamma-prime were present as a continuous grain boundary film or 'necklace'; and the Ni-35Al-20Fe alloy was ductile in ribbon form despite a microstructure consisting solely of the B2 beta phase based on NiAl. The ductility inherent in the Ni-35Al-20Fe alloy was explored further in subsequent studies. Those results confirm the presence of ductility in the Ni-35Al-20Fe alloy after rapid cooling from 750 - 1000 C. However exposure at 550 C caused embrittlement; this was associated with an age-hardening reaction caused by the formation of Fe-rich precipitates. In contrast, to the Ni-35Al-20Fe alloy, exploratory research indicated that compositions in the range of Ni-35Al-12Fe retain the ordered B2 structure of NiAl, are ductile, and do not age-harden or embrittle after thermal exposure. Thus, our recent efforts have focused on the behavior of the Ni-35Al-12Fe alloy. A second parallel effort initiated in this program was to use an alternate processing technique, mechanical alloying, to improve the properties of NiAl-alloys. Mechanical alloying in the

  13. Simple dynamical models capturing the key features of the Central Pacific El Niño

    PubMed Central

    Chen, Nan; Majda, Andrew J.

    2016-01-01

    The Central Pacific El Niño (CP El Niño) has been frequently observed in recent decades. The phenomenon is characterized by an anomalous warm sea surface temperature (SST) confined to the central Pacific and has different teleconnections from the traditional El Niño. Here, simple models are developed and shown to capture the key mechanisms of the CP El Niño. The starting model involves coupled atmosphere–ocean processes that are deterministic, linear, and stable. Then, systematic strategies are developed for incorporating several major mechanisms of the CP El Niño into the coupled system. First, simple nonlinear zonal advection with no ad hoc parameterization of the background SST gradient is introduced that creates coupled nonlinear advective modes of the SST. Secondly, due to the recent multidecadal strengthening of the easterly trade wind, a stochastic parameterization of the wind bursts including a mean easterly trade wind anomaly is coupled to the simple atmosphere–ocean processes. Effective stochastic noise in the wind burst model facilitates the intermittent occurrence of the CP El Niño with realistic amplitude and duration. In addition to the anomalous warm SST in the central Pacific, other major features of the CP El Niño such as the rising branch of the anomalous Walker circulation being shifted to the central Pacific and the eastern Pacific cooling with a shallow thermocline are all captured by this simple coupled model. Importantly, the coupled model succeeds in simulating a series of CP El Niño that lasts for 5 y, which resembles the two CP El Niño episodes during 1990–1995 and 2002–2006. PMID:27698122

  14. Solid speciation and availability of nickel and chromium in Ni mining spoils

    NASA Astrophysics Data System (ADS)

    Raous, Sophie; Garnier, Jérémie; Sterckeman, Thibaul; Echevarria, Guillaume; Becquer, Thierry; Thomas, Fabien

    2010-05-01

    Nickel mining of ultramafic laterites generates different types of wastes, topsoils and ores that are too poor in Ni to be currently processed. These are mixed and stored on heaps which could be a potential source of Ni and Cr pollution. Chemical reactivity of the main metal bearing phases present in the mining spoils of Goiás (Brasil) was investigated. Principally a silicated 'saprolite' material and a Fe-oxide rich limonitic material were isolated from the wastes. Their total Ni and Cr content are high, respectively for Ni and Cr : 7,170 and 54,970 mg kg-1 in limonite and 12,200 and 12,650 mg kg-1 in saprolite. The main metal-bearing minerals, identified and localized using XRD, TEM-EDX, Raman spectroscopy and Mossbaüer spectrometry are well-crystallized minerals: goethite (75%), hematite (13%) and chromite in limonite and ferruginous smectite, talc and chromite in saprolite. Single and sequential extractions showed that the amounts of 1M KCl exchangeable Ni and Cr reached respectively 7.1% and 0.03% of total contents in saprolite. Moreover, Cr(VI) extraction by KH2PO4 showed that more than 2% (980 mg kg-1) of total Cr was under this labile toxic form in limonite. This study allowed us to determine the main reactions controlling the Ni and Cr mobility in the spoils i.e. Ni2+ cationic exchange in saprolitic spoil and CrO32- surface complexation in limonitic spoil. This study allowed us to demonstrate the need of chemical rehabilitation of mining wastes in order to avoid the dispersion of the high contents of Ni and Cr available. It constitutes the system definition needed to predict the Cr and Ni mobility in ultramafic mining spoils.

  15. The Chandler wobble as a trigger of the El Niño excitation

    NASA Astrophysics Data System (ADS)

    Serykh, Ilya; Sonechkin, Dmitry

    2014-05-01

    Using data of the Met Office Hadley Centre, time series of the near surface temperature and sea-surface pressure for the period 1875-2012 are processed to compute the Oceanic Niño Index (ONI) and the Equatorial Southern Oscillation Index (ESOI). Detailed spectra of the ONI and ESOI show peaks that exist throughout the year, but the most powerful in the boreal winter months. Peak periods are consist of 29, 43 and 58 months, which is roughly equivalent to 2, 3 and 4 periods of the well-known 14-month Chandler wobble of the Earth's pole motion. A plausible physical mechanism of the Chandler wobble influence on the El Niño excitation is presented. A computation of the global fields of the spectral energy at each of the periods afore-indicated admits to identify some distinctive features of the spatial structure of the most powerful disturbances during El Niño. Detailed spectra of the El Niño Modoki Index (EMI) computed for each month separately show differences between main oscillations of El Niño Modoki and classic El Niño. Besides, computations are made of cross-correlations and lead/lag interrelations between El Niño and some other processes in the global climate system for all afore-indicated periods. Some regions are identified for which the cross-correlations are essential, but the processes being considered either lead or lag El Niño. This finding admits to suppose that there exists an external force common for both, El Niño and other macroscale climatic processes.

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

    SciTech Connect

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

    2013-11-15

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

  17. Preparation and characterization of Ni-based perovskite catalyst for steam CO2 reforming of methane.

    PubMed

    Yang, Eun-Hyeok; Kim, Sang Woo; Ahn, Byong Song; Moon, Dong Ju

    2013-06-01

    Steam CO2 reforming of methane was investigated over Ni-based perovskite catalyst to produce desired H2/CO ratio by adjusting the feed ratio of CH4, CO2 and H2O for floating GTL process application. La modified perovskites were prepared by the Pechini method and calcined in air and the Ni-based catalysts were prepared by dispersing Ni on the La modified perovskite by an incipient wetness impregnation. The catalysts before and after the reaction were characterized by N2 physisoprtion, CO chemisoprtion, XRD, TPR and SEM techniques. To control desired H2/CO ratio, simulation for SCR was carried out by Aspen plus, and product distribution for SCR was investigated in a fixed bed reactor system using feed ratio estimated by simulation. The Ni-based perovskite catalysts were found to give CH4 and CO2 conversions of up to 82% and 60% respectively to yield a H2/CO product ratio close to 2.

  18. Binary rare earth element-Ni/Co metallic glasses with distinct β-relaxation behaviors

    SciTech Connect

    Zhu, Z. G.; Wang, Z.; Wang, W. H.

    2015-10-21

    We report the formation of a series of rare earth element (RE)-Ni/Co binary metallic glasses (MGs) with unusual distinct β-relaxation peak compared with that of most of the reported MGs which usually exhibit as an excess wing or a shoulder. The β-relaxation behavior of RE-Ni/Co MGs is sensitive to the composition and the atomic radii of the RE and can be tuned through changing the fraction of RE-Ni (or Co) atomic pairs. The novel RE-Ni/Co MGs with distinct β-relaxation can serve as model system to investigate the nature of the β-relaxation as well as its relations with other physical and mechanical properties of MGs.

  19. Structure and magnetism of Fe-rich nanostructured Fe Ni metastable solid solutions

    NASA Astrophysics Data System (ADS)

    Gorria, P.; Martínez-Blanco, D.; Pérez, M. J.; Blanco, J. A.; Smith, R. I.

    2005-07-01

    New futures on the physical properties of ferromagnetic FeNi alloys have been found combining in situ neutron diffraction experiments and magnetic measurements in mechanical milled Fe-rich Fe-Ni metastable solid solutions. Apart from the well-known Invar effect, on heating these materials are characterised by the existence of a first-order martensite-austenite transformation that takes place at some system-dependent temperature. On cooling, the transformation occurs at a lower temperature than on heating; for Fe 80Ni 20 the size of the effect being larger than 100 °C, much more than the values found in conventional FeNi alloys. These results are discussed considering intrinsic features as magnetovolume effects and/or extrinsic effects such as small grain size and the existence of defects.

  20. Characterization and anticorrosion properties of carbon nanotubes directly synthesized on Ni foil using ethanol

    NASA Astrophysics Data System (ADS)

    Jeong, Namjo; Jwa, Eunjin; Kim, Chansoo; Hwang, Kyo Sik; Park, Soon-cheol; Jang, Moon Suk

    2016-07-01

    In this work, we describe the direct growth of carbon nanofilaments by the catalytic decomposition of ethanol on untreated polycrystalline Ni foil. Our work focuses on the effects of synthesis conditions on the growth of the carbon nanofilaments and their growth mechanism. Direct growth of carbon nanotubes (CNTs) is more favorable on lower-purity Ni foil. The highest yield was obtained at approximately 750 °C. The average diameter of the CNTs was approximately 20-30 nm. Raman spectra revealed that the increase of H2 concentration in the carrier gas and synthesis temperature induced the growth of better-graphitized CNTs. Additionally, we investigated the anticorrosion properties of as-prepared products under simulated seawater conditions. The corrosion rate of the CNT/Ni foil system was maximally 50-60 times slower than that of the as-received Ni foil, indicating that the CNT coating may be a good candidate for corrosion inhibition.

  1. Growth of ultra-uniform graphene using a Ni/W bilayer metal catalyst

    SciTech Connect

    Yang, Jae Hoon; Hwang, Jae Seok; Yang, Hyoung Woo; Kang, Dae Joon; Jang, A-Rang; Shin, Hyeon Suk; Jang, Jae-Eun

    2015-01-26

    We investigated a bilayer catalyst system consisting of polycrystalline Ni and W films for growing mono-layer graphene over large areas. Highly uniform graphene was grown on Ni/W bilayer film with 100% coverage. The graphene grown on Ni/W bilayer film and transferred onto an insulating substrate exhibited average hole and electron mobilities of 727 and 340 cm{sup 2}V{sup −1}s{sup −1}, respectively. A probable growth mechanism is proposed based on X-ray diffractometry and transmission electron microscopy, which suggests that the reaction between diffused carbon and tungsten atoms results in formation of tungsten carbides. This reaction allows the control of carbon precipitation and prevents the growth of non-uniform multilayer graphene on the Ni surface; this has not been straightforwardly achieved before. These results could be of importance in better understanding mono-layer graphene growth, and suggest a facile fabrication route for electronic applications.

  2. LABORATORY MEASUREMENTS OF NiH BY FOURIER TRANSFORM DISPERSED FLUORESCENCE

    SciTech Connect

    Vallon, Raphael; Richard, Cyril; Crozet, Patrick; Wannous, Ghassan; Ross, Amanda

    2009-05-01

    Red and orange bands of laser-induced fluorescence in NiH have been recorded on a Fourier transform interferometer at Doppler resolution. The spectra show strong transitions to low-lying vibronic states which are not thermally populated in a laboratory source, and therefore do not appear in laser excitation spectra, but which would be expected to contribute significantly to any stellar spectrum. The strongest bands belong to the G[{omega}' 5/2]-X {sub 2} {sup 2}{delta}{sub 3/2}, I[{omega}' 3/2]-X {sub 2}, and {sup 2}{delta}{sub 3/2} I[{omega}' 3/2]-W {sub 1} {sup 2}{pi}{sub 3/2} systems. Measurements are reported for {sup 58}NiH, {sup 60}NiH, and {sup 62}NiH.

  3. Beta decay of nuclides 56Fe, 62Ni, 64Ni and 68Ni in the crust of magnetars

    NASA Astrophysics Data System (ADS)

    Liu, Jing-Jing; Kang, Xiao-Ping; Hao, Liang-Huan; Feng, Hao; Liu, Dong-Mei; Li, Chang-Wei; Zeng, Xiang-Ming

    2016-11-01

    By introducing the Dirac δ-function and Pauli exclusion principle in the presence of superstrong magnetic fields (SMFs), we investigate the influence of SMFs on beta decay and the change rates of electron fraction (CREF) of nuclides 56Fe, 62Ni, 64Ni and 68Ni in magnetars, which are powered by magnetic field energy. We find that the magnetic fields have a great influence on the beta decay rates, and the beta decay rates can decrease by more than six orders of magnitude in the presence of SMFs. The CREF also decreases by more than seven orders of magnitude in the presence of SMFs.

  4. Microstructure of Ni-Al powder and Ni-Al composite coatings prepared by twin-wire arc spraying

    NASA Astrophysics Data System (ADS)

    Wang, Ji-xiao; Wang, Gui-xian; Liu, Jing-shun; Zhang, Lun-yong; Wang, Wei; Li, Ze; Wang, Qi-xiang; Sun, Jian-fei

    2016-07-01

    Ni-Al powder and Ni-Al composite coatings were fabricated by twin-wire arc spraying (TWAS). The microstructures of Ni-5wt%Al powder and Ni-20wt%Al powder were characterized by scanning electronic microscopy (SEM) and energy dispersive spectroscopy (EDS). The results showed that the obtained particle size ranged from 5 to 50 μm. The morphology of the Ni-Al powder showed that molten particles were composed of Ni solid solution, NiAl, Ni3Al, Al2O3, and NiO. The Ni-Al phase and a small amount of Al2O3 particles changed the composition of the coating. The microstructures of the twin-wire-arc-sprayed Ni-Al composite coatings were characterized by SEM, EDS, X-ray diffraction (XRD), and transmission electron microscopy (TEM). The results showed that the main phase of the Ni-5wt%Al coating consisted of Ni solid solution and NiAl in addition to a small amount of Al2O3. The main phase of the Ni-20wt%Al coating mainly consisted of Ni solid solution, NiAl, and Ni3Al in addition to a small amount of Al and Al2O3, and NiAl and Ni3Al intermetallic compounds effectively further improved the final wear property of the coatings. TEM analysis indicated that fine spherical NiAl3 precipitates and a Ni-Al-O amorphous phase formed in the matrix of the Ni solid solution in the original state.

  5. p-Type NiO Hybrid Visible Photodetector.

    PubMed

    Mallows, John; Planells, Miquel; Thakare, Vishal; Bhosale, Reshma; Ogale, Satishchandra; Robertson, Neil

    2015-12-23

    A novel hybrid visible-light photodetector was created using a planar p-type inorganic NiO layer in a junction with an organic electron acceptor layer. The effect of different oxygen pressures on formation of the NiO layer by pulsed laser deposition shows that higher pressure increases the charge carrier density of the film and lowers the dark current in the device. The addition of a monolayer of small molecules containing conjugated π systems and carboxyl groups at the device interface was also investigated and with correct alignment of the energy levels improves the device performance with respect to the quantum efficiency, responsivity, and photogeneration. The thickness of the organic layer was also optimized for the device, giving a responsivity of 1.54 × 10(-2) A W(-1) in 460 nm light. PMID:26654105

  6. p-Type NiO Hybrid Visible Photodetector.

    PubMed

    Mallows, John; Planells, Miquel; Thakare, Vishal; Bhosale, Reshma; Ogale, Satishchandra; Robertson, Neil

    2015-12-23

    A novel hybrid visible-light photodetector was created using a planar p-type inorganic NiO layer in a junction with an organic electron acceptor layer. The effect of different oxygen pressures on formation of the NiO layer by pulsed laser deposition shows that higher pressure increases the charge carrier density of the film and lowers the dark current in the device. The addition of a monolayer of small molecules containing conjugated π systems and carboxyl groups at the device interface was also investigated and with correct alignment of the energy levels improves the device performance with respect to the quantum efficiency, responsivity, and photogeneration. The thickness of the organic layer was also optimized for the device, giving a responsivity of 1.54 × 10(-2) A W(-1) in 460 nm light.

  7. First-principles Study of Methane Dehydrogenation on a Bimetallic Cu/Ni(111) Surface

    SciTech Connect

    An, Wei; Zeng, Xiao Cheng; Turner, C. H.

    2009-11-02

    We present density-functional theory calculations of the dehydrogenation of methane and CHx (x =1–3) on a Cu/Ni(111) surface, where Cu atoms are substituted on the Ni surface at a coverage of 1/4 monolayer. As compared to the results on other metal surfaces, including Ni(111), a similar activation mechanism with different energetics is found for the successive dehydrogenation of CH4 on the Cu/Ni(111) surface. In particular, the activation energy barrier (Eact) for CH→C+H is found to be 1.8 times larger than that on Ni(111), while Eact for CH4→CH3+H is 1.3 times larger. Considering the proven beneficial effect of Cu observed in the experimental systems, our findings reveal that the relative Eact in the successive dehydrogenation of CH4 plays a key role in impeding carbon formation during the industrial steam reforming of methane. Our calculations also indicate that previous scaling relationships of the adsorption energy (Eads) for CHx (x=1–3) and carbon on pure metals also hold for several Ni(111)-based alloy systems.

  8. First-principles study of methane dehydrogenation on a bimetallic Cu/Ni(111) surface

    NASA Astrophysics Data System (ADS)

    An, Wei; Zeng, X. C.; Turner, C. Heath

    2009-11-01

    We present density-functional theory calculations of the dehydrogenation of methane and CHx (x=1-3) on a Cu/Ni(111) surface, where Cu atoms are substituted on the Ni surface at a coverage of 1/4 monolayer. As compared to the results on other metal surfaces, including Ni(111), a similar activation mechanism with different energetics is found for the successive dehydrogenation of CH4 on the Cu/Ni(111) surface. In particular, the activation energy barrier (Eact) for CH→C+H is found to be 1.8 times larger than that on Ni(111), while Eact for CH4→CH3+H is 1.3 times larger. Considering the proven beneficial effect of Cu observed in the experimental systems, our findings reveal that the relative Eact in the successive dehydrogenation of CH4 plays a key role in impeding carbon formation during the industrial steam reforming of methane. Our calculations also indicate that previous scaling relationships of the adsorption energy (Eads) for CHx (x=1-3) and carbon on pure metals also hold for several Ni(111)-based alloy systems.

  9. Endophytic bacteria improve phytoremediation of Ni and TCE co-contamination

    SciTech Connect

    Weyens, N.; van der Lelie, D.; Croes, S.; Dupae, J.; Newman, L.; Carleer, R.; Vangronsveld, J.

    2010-07-01

    The aim of this work was to investigate if engineered endophytes can improve phytoremediation of co-contaminations by organic pollutants and toxic metals. As a model system, yellow lupine was inoculated with the endophyte Burkholderia cepacia VM1468 possessing (a) the pTOM-Bu61 plasmid, coding for constitutive trichloroethylene (TCE) degradation, and (b) the ncc-nre Ni resistance/sequestration system. Plants were exposed to Ni and TCE and (a) Ni and TCE phytotoxicity, (b) TCE degradation and evapotranspiration, and (c) Ni concentrations in the roots and shoots were determined. Inoculation with B. cepacia VM1468 resulted in decreased Ni and TCE phytotoxicity, as measured by 30% increased root biomass and up to 50% decreased activities of enzymes involved in anti-oxidative defence in the roots. In addition, TCE evapotranspiration showed a decreasing trend and a 5 times higher Ni uptake was observed after inoculation. Engineered endophytes can improve phytoremediation of mixed contaminations via enhanced degradation of organic contaminants and improved metal uptake and translocation.

  10. Composite Ni/NiO-Cr2O3 Catalyst for Alkaline Hydrogen Evolution Reaction

    PubMed Central

    Bates, Michael K.; Jia, Qingying; Ramaswamy, Nagappan; Allen, Robert J.; Mukerjee, Sanjeev

    2015-01-01

    We report a Ni–Cr/C electrocatalyst with unprecedented mass-activity for the hydrogen evolution reaction (HER) in alkaline electrolyte. The HER kinetics of numerous binary and ternary Ni-alloys and composite Ni/metal-oxide/C samples were evaluated in aqueous 0.1 M KOH electrolyte. The highest HER mass-activity was observed for Ni–Cr materials which exhibit metallic Ni as well as NiOx and Cr2O3 phases as determined by X-ray diffraction (XRD) and X-ray absorption spectroscopy (XAS) analysis. The onset of the HER is significantly improved compared to numerous binary and ternary Ni-alloys, including Ni–Mo materials. It is likely that at adjacent Ni/NiOx sites, the oxide acts as a sink for OHads, while the metallic Ni acts as a sink for the Hads intermediate of the HER, thus minimizing the high activation energy of hydrogen evolution via water reduction. This is confirmed by in situ XAS studies that show that the synergistic HER enhancement is due to NiOx content and that the Cr2O3 appears to stabilize the composite NiOx component under HER conditions (where NiOx would typically be reduced to metallic Ni0). Furthermore, in contrast to Pt, the Ni(Ox)/Cr2O3 catalyst appears resistant to poisoning by the anion exchange ionomer (AEI), a serious consideration when applied to an anionic polymer electrolyte interface. Furthermore, we report a detailed model of the double layer interface which helps explain the observed ensemble effect in the presence of AEI. PMID:26191118

  11. Ni 3+ adsorbate dynamics on a NiO(0 0 1) surface

    NASA Astrophysics Data System (ADS)

    Karakasidis, Theodoros E.; Vamvakopoulos, E.

    2006-05-01

    We present results concerning the dynamical behavior of a Ni 3+ adsorbate on a NiO(0 0 1) surface obtained by molecular dynamics simulations. In a first place, we examined at low temperature the position of the Ni 3+ ion as an adatom on the surface and the corresponding modification of its local environment as reflected on the pair-wise radial distribution function. The calculation of the vibrational properties of the adatom by means of the phonon local density of states (LDOS) shows that there is an anisotropic behavior both in the two principal in-plane directions as well as in the direction normal to the surface in accordance with the structural results. We compare the phonon LDOS of the Ni 3+ adatom with the corresponding results for the Ni 2+ adatom and the Ni 2+ surface cations. Static energetic calculations are indicative that the exchange of the Ni 3+ ion with a surface Ni 2+ ion could be favorable. Such a behavior is confirmed by results observed at temperatures higher than 700 K where the Ni 3+ adsorbate is located on a substitutional position on the surface and not on adatom position. The exchange takes place through simple or double exchange mechanisms. The structural and dynamical behavior of the Ni 3+ ion at the substitution position was investigated in the temperature range 700-2000 K through the calculation of the pair distribution function, the relaxed interlayer relative position (RIRP), mean-square displacements (MSDs) and phonon LDOS. Results show that in comparison with the Ni 2+ surface ions the Ni 3+ ion at substitution position is more tightly bound especially in the direction normal to the surface as is indicated by the local structure and the contraction it presents as well as its phonon LDOS. As temperature increases the binding of the Ni 3+ ion becomes less important as reflected on the physical properties mentioned above.

  12. Exploring the mechanism of water-splitting reaction in NiOx/β-Ga₂O₃ photocatalysts by first-principles calculations.

    PubMed

    Zhou, Xin; Dong, Hao; Ren, Ai-Min

    2016-04-28

    Experiments found that loading suitable cocatalysts, usually in the form of metal and metal oxide nanoparticles, on the semiconductor surface can remarkably increase the photocatalytic activity of water-splitting reaction. To get insight into the mechanism of experimental observations, we took a NiOx/β-Ga2O3 photocatalytic system as a model and performed detailed density functional theory calculations. Electrochemical computational methods are used to investigate the hydrogen evolution reaction (HER) and oxygen evolution reaction (OER). Our results show that in the Ni4O2/β-Ga2O3 system, the reaction sites of HER are on cluster oxygen atoms and Ni atoms in the Ni2 cluster. Loading the Ni4O2 cluster on the β-Ga2O3 surface importantly reduces the reaction free energy of HER. On the clean β-Ga2O3 surface, water dissociation is energetically unfavorable. After attaching the Ni4O2 cluster to the surface, water decomposition becomes thermodynamically favorable. The favorable reaction sites of OER focus on the Ni4O2 cluster. The rate-determining step of OER can be changed by adsorbing the Ni4O2 cluster. Notable reduction of overpotential (0.87 V) for OER on Ni4O2/Ga2O3 is found compared with that on the clean Ga2O3 surface, which reasonably explains the experimental observation on significant enhancement of activity for generating oxygen after loading NiOx cocatalysts.

  13. Exploring the mechanism of water-splitting reaction in NiOx/β-Ga₂O₃ photocatalysts by first-principles calculations.

    PubMed

    Zhou, Xin; Dong, Hao; Ren, Ai-Min

    2016-04-28

    Experiments found that loading suitable cocatalysts, usually in the form of metal and metal oxide nanoparticles, on the semiconductor surface can remarkably increase the photocatalytic activity of water-splitting reaction. To get insight into the mechanism of experimental observations, we took a NiOx/β-Ga2O3 photocatalytic system as a model and performed detailed density functional theory calculations. Electrochemical computational methods are used to investigate the hydrogen evolution reaction (HER) and oxygen evolution reaction (OER). Our results show that in the Ni4O2/β-Ga2O3 system, the reaction sites of HER are on cluster oxygen atoms and Ni atoms in the Ni2 cluster. Loading the Ni4O2 cluster on the β-Ga2O3 surface importantly reduces the reaction free energy of HER. On the clean β-Ga2O3 surface, water dissociation is energetically unfavorable. After attaching the Ni4O2 cluster to the surface, water decomposition becomes thermodynamically favorable. The favorable reaction sites of OER focus on the Ni4O2 cluster. The rate-determining step of OER can be changed by adsorbing the Ni4O2 cluster. Notable reduction of overpotential (0.87 V) for OER on Ni4O2/Ga2O3 is found compared with that on the clean Ga2O3 surface, which reasonably explains the experimental observation on significant enhancement of activity for generating oxygen after loading NiOx cocatalysts. PMID:27051886

  14. High Temperature Life Testing of 80Ni-20Cr Wire in a Simulated Mars Atmosphere for the Sample Analysis at Mars (SAM) Instrument Suite Gas Processing System (GPS) Carbon Dioxide Scrubber

    NASA Technical Reports Server (NTRS)

    Hoffman, Christopher; Munoz, Bruno; Gundersen, Cynthia; Thomas, Walter, III; Stephenson, Timothy

    2008-01-01

    In support of the GPS for the SAM instrument suite built by NASA/GSFC, a life test facility was developed to test the suitability of 80Ni-20Cr alloy wire, 0.0142 cm diameter, for use as a heater element for the carbon dioxide scrubber. The element would be required to operate at 1000 C in order to attain the 800 C required for regeneration of the getter. The element also would need to operate in the Mars atmosphere, which consists mostly of CO2 at pressures between 4 and 12 torr. Data on the high temperature degradation mechanism of 80Ni- 20Cr in low pressure CO2, coupled with the effects of thermal cycling, were unknown. In addition, the influence of work hardening of the wire during assembly and the potential for catastrophic grain growth also were unknown. Verification of the element reliability as defined by the mission goals required the construction of a test facility that would accurately simulate the duty cycles in a simulated Mars atmosphere. The experimental set-up, along with the test protocol and results will be described.

  15. High Temperature Life Testing of 80Ni-20Cr Wire in a Simulated Mars Atmosphere for the Sample Analysis at Mars (SAM) Instrument Suit Gas Processing System (GPS) Carbon Dioxide Scrubber

    NASA Technical Reports Server (NTRS)

    Gundersen, Cynthia; Hoffman, Christopher; Munoz, Bruno; Steohenson, Timothy; Thomas, Walter

    2008-01-01

    In support of the GPS for the SAM instrument suite built by GSFC, a life test facility was developed to test the suitability of 80Ni-20Cr wire, 0.0056 inches in diameter, for use as a heater element for the carbon dioxide scrubber. The wire would be required to operate at 1000 C in order to attain the 800 C required for regeneration of the getter. The wire also would need to operate in the Mars atmosphere, which consists mostly of CO2 at pressures between 4 and 12 torr. Data on the high temperature degradation mechanism of 80Ni-20Cr in low pressure CO2, together with the effects of thermal cycling, were unknown. In addition, the influence of work hardening of the wire during assembly and the potential for catastrophic grain growth also were unknown. Verification of the wire reliability as defined by the mission goals required the construction of a test facility that would accurately simulate the duty cycles in a simulated Mars atmosphere. The experimental set-up, along with the test protocol and results will be described.

  16. Shape coexistence in and near 68