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Sample records for dmdf model ni

  1. Numerical prediction with `DMDF` model of pack ice motion in the Okhotsk sea; DMDF model ni yoru Okhotsk kai ryuhyo undo no suchi yosoku

    Energy Technology Data Exchange (ETDEWEB)

    Matsuzawa, T.; Yamaguchi, H.; Suzuki, S.; Kato, H. [The University of Tokyo (Japan); Rheem, C. [The University of Tokyo, Tokyo (Japan). Institute of Industrial Science

    1996-12-31

    A simulation was performed on pack ice motion in the Okhotsk Sea in winter by using the distributed mass/discrete floe (DMDF) method that carries out a dynamic numerical calculation of pack ice motion. Several kinds of cases were compared and calculated. As a result, effectiveness was verified on a DMDF model with boundary conditions which are relatively large in range and complex in nature. At the same time, it was possible to estimate part of the characteristics of pack ice motion in this sea area. The numerical calculation used the floe distribution on February 1, 1994 as the initial condition, and performed calculations on conditions until February 8 giving considerations on meteorological and hydrographic data. As a result, the calculation result showed the same movements as those in the observed ice conditions. If an ocean current is hypothesized steady, the calculation is affected more than necessarily by the ocean current, and it derives a result departed from reality. From these findings, it was elucidated that floe motions are governed mainly by wind; and in making a numerical modeling, a consideration including composition with the ocean current is necessary. Shear stress of wind has its acting direction displaced from the wind direction because of effect of the Corioli`s force. 6 refs., 13 figs., 2 tabs.

  2. Modeling and simulation of NiO dissolution and Ni deposition in molten carbonate fuel cells

    Energy Technology Data Exchange (ETDEWEB)

    Nam, Suk Woo; Choi, Hyung-Joon; Lim, Tae Hoon [Korea Institute of Science & Technology, Seoul (Korea, Republic of)] [and others

    1996-12-31

    Dissolution of NiO cathode into the electrolyte matrix is an important phenomena limiting the lifetime of molten carbonate fuel cell (MCFC). The dissolved nickel diffuses into the matrix and is reduced by dissolved hydrogen leading to the formation of metallic nickel films in the pores of the matrix. The growth of Ni films in the electrolyte matrix during the continuous cell operation results eventually in shorting between cathode and anode. Various mathematical and empirical models have been developed to describe the NiO dissolution and Ni deposition processes, and these models have some success in estimating the lifetime of MCFC by correlating the amount of Ni deposited in the matrix with shorting time. Since the exact mechanism of Ni deposition was not well understood, deposition reaction was assumed to be very fast in most of the models and the Ni deposition region was limited around a point in the matrix. In fact, formation of Ni films takes place in a rather broad region in the matrix, the location and thickness of the film depending on operating conditions as well as matrix properties. In this study, we assumed simple reaction kinetics for Ni deposition and developed a mathematical model to get the distribution of nickel in the matrix.

  3. Energetic Mapping of Ni Catalysts by Detailed Kinetic Modeling

    DEFF Research Database (Denmark)

    Bjørgum, Erlend; Chen, De; Bakken, Mari G.

    2005-01-01

    precursor seems to result in more steplike sites, kinks, and defects for carbon monoxide dissociation. A detailed kinetic modeling of the TPO results based on elementary reaction steps has been conducted to give an energetic map of supported Ni catalysts. Experimental results from the ideal Ni surface fit...

  4. A Simple theoretical model for 63Ni betavoltaic battery

    International Nuclear Information System (INIS)

    ZUO, Guoping; ZHOU, Jianliang; KE, Guotu

    2013-01-01

    A numerical simulation of the energy deposition distribution in semiconductors is performed for 63 Ni beta particles. Results show that the energy deposition distribution exhibits an approximate exponential decay law. A simple theoretical model is developed for 63 Ni betavoltaic battery based on the distribution characteristics. The correctness of the model is validated by two literature experiments. Results show that the theoretical short-circuit current agrees well with the experimental results, and the open-circuit voltage deviates from the experimental results in terms of the influence of the PN junction defects and the simplification of the source. The theoretical model can be applied to 63 Ni and 147 Pm betavoltaic batteries. - Highlights: • The energy deposition distribution is found following an approximate exponential decay law when beta particles emitted from 63 Ni pass through a semiconductor. • A simple theoretical model for 63 Ni betavoltaic battery is constructed based on the exponential decay law. • Theoretical model can be applied to the betavoltaic batteries which radioactive source has a similar energy spectrum with 63 Ni, such as 147 Pm

  5. CLASSICAL AREAS OF PHENOMENOLOGY: First-principles calculations for the elastic properties of Ni-base model superalloys: Ni/Ni3Al multilayers

    Science.gov (United States)

    Wang, Yun-Jiang; Wang, Chong-Yu

    2009-10-01

    A model system consisting of Ni[001](100)/Ni3Al[001](100) multi-layers are studied using the density functional theory in order to explore the elastic properties of single crystal Ni-based superalloys. Simulation results are consistent with the experimental observation that rafted Ni-base superalloys virtually possess a cubic symmetry. The convergence of the elastic properties with respect to the thickness of the multilayers are tested by a series of multilayers from 2γ'+2γ to 10γ'+10γ atomic layers. The elastic properties are found to vary little with the increase of the multilayer's thickness. A Ni/Ni3Al multilayer with 10γ'+10γ atomic layers (3.54 nm) can be used to simulate the mechanical properties of Ni-base model superalloys. Our calculated elastic constants, bulk modulus, orientation-dependent shear modulus and Young's modulus, as well as the Zener anisotropy factor are all compatible with the measured results of Ni-base model superalloys R1 and the advanced commercial superalloys TMS-26, CMSX-4 at a low temperature. The mechanical properties as a function of the γ' phase volume fraction are calculated by varying the proportion of the γ and γ' phase in the multilayers. Besides, the mechanical properties of two-phase Ni/Ni3Al multilayer can be well predicted by the Voigt-Reuss-Hill rule of mixtures.

  6. 3D Computer Models of T- x- y Diagrams, Forming the Fe-Ni-Co-FeS-NiS-CoS Subsystem

    Science.gov (United States)

    Lutsyk, V. I.; Vorob'eva, V. P.

    2017-12-01

    3D computer models of Fe-Ni-Co, Fe-Ni-FeS-NiS, Fe-Co-FeS-CoS, Ni-Co-NiS-CoS T- x- y diagrams have been designed. The geometric structure (35 surfaces, two-phase surface of the reaction type change, 17 phase regions) of the Fe-Ni-FeS-NiS T- x- y diagram is investigated in detail. The liquidus hypersurfaces prediction of the Fe-Ni-Co-FeS-NiS-CoS subsystem is represented.

  7. Defect modelling of martensitic transformations in NiTi

    International Nuclear Information System (INIS)

    Pond, R.C.; Nixon, T.

    2000-01-01

    Recent advances in the theoretical understanding of interfacial defects enable both the deformation and extent of diffusional flux associated with defect motion during phase transformation to be determined quantitatively. In the present paper this appreciation is used to show that transformations which proceed by the generation, motion and interaction of interfacial defects can only be diffusionless when special crystallographic circumstances pertain. The principal steps in modelling such transformations are outlined, and the results for the case of NiTi are presented. (orig.)

  8. Thermodynamic reassessment of Nb-Ni-Ti system with order–disorder model

    Energy Technology Data Exchange (ETDEWEB)

    Santhy, K.; Hari Kumar, K.C.

    2015-01-15

    Highlights: • Thermodynamic re-assessment of Ni-Ti and Nb-Ni-Ti systems using CALPHAD with DFT. • Incorporation of order-disorder model in ternary and binaries. • Ternary solubility in the binary phases Ni{sub 3}Ti, NiTi, and NbNi{sub 3} are obtained by DFT. • Solubility of Ni{sub 3}Ti, NiTi, and NbNi{sub 3} in ternary are incorporated in modelling. • The calculated ternary Nb-Ni-Ti system compared with experimental data. - Abstract: A thermodynamic description of the Nb-Ni-Ti system is refined by combining results of first-principle total energy calculations with the CALPHAD approach. The lower order binary system Ni-Ti is reassessed with all available thermochemical and phase diagram data. Single Gibbs energy description is used for ordered and disordered bcc phase in this system. To make consistent extrapolation to ternary system, metastable B2 phase is introduced in both Nb-Ni and Nb-Ti systems. The enthalpy of formation of binary intermediate phases are calculated by first-principle method, which are compared with the experimental data. The energy of formation of hypothetical end-members in Ni-Ti binary system and the ternary solubility in the binary phases Ni{sub 3}Ti, NiTi, and NbNi{sub 3} are also calculated by first-principle method and incorporated in the modelling of those phases. Calculated phase diagram and thermochemical properties of Ni-Ti system is show good agreement with experimental data. The calculated ternary Nb-Ni-Ti system is summarily presented in the form of isothermal and isopleth sections, liquids projection and reaction scheme, with appropriate comparisons with available experimental data.

  9. Atomic scale modelling of nanosize Ni sub 3 Al cluster beam deposition on Al, Ni and Ni sub 3 Al (1 1 1) surfaces

    CERN Document Server

    Kharlamov, V S; Hou, M

    2002-01-01

    The slowing down of Ni sub 3 Al clusters on a Al, Ni and Ni sub 3 Al (1 1 1) surfaces is studied by atomic scale modelling. The semi-grand canonical metropolis Monte Carlo is used for the preparation of isolated clusters at thermodynamic equilibrium. The cluster deposition on the surface is studied in detail by classical Molecular Dynamics simulations that include a model to account for electron-phonon coupling. Long- and short-range orders in the cluster are evaluated as functions of temperature in an impact energy range between 0 and 1.5 eV/atom. The interaction between the Ni sub 3 Al cluster and an Al surface is characterised low short range (chemical) disorder. No sizeable epitaxy is found, subsequent to the impact. In contrast, in the case of Ni and Ni sub 3 Al substrates, which are harder materials than aluminium, the chemical disorder is higher and epitaxial accommodation is possible. With these substrates, chemical disorder in the cluster is an increasing function of the impact energy, as well as of ...

  10. Model of Cu-Al-Fe-Ni Bronze Crystallization

    Directory of Open Access Journals (Sweden)

    Pisarek B. P.

    2013-09-01

    Full Text Available According to the analysis of the current state of the knowledge shows that there is little information on the process of phase transformations that occur during the cooling Cu-Al-Fe-Ni hypo-eutectoid bronzes with additions of Cr, Mo and/or W, made additions individually or together, for the determination of: the type of crystallizing phases, crystallizing phases, order and place of their nucleation. On the basis of recorded using thermal and derivative analysis of thermal effects phases crystallization or their systems, analysis of the microstructure formed during crystallization - observed on the metallographic specimen casting ATD10-PŁ probe, analysis of the existing phase equilibrium diagrams forming elements tested Cu-Al-Fe-Ni bronze, with additions of Cr, Mo, W and/or Si developed an original model of crystallization and phase transformation in the solid state, the casting of high quality Cu-Al-Fe-Ni bronze comprising: crystallizing type phase, crystallizing phase sequence, place of nucleation.

  11. Model of Ni-63 battery with realistic PIN structure

    Science.gov (United States)

    Munson, Charles E.; Arif, Muhammad; Streque, Jeremy; Belahsene, Sofiane; Martinez, Anthony; Ramdane, Abderrahim; El Gmili, Youssef; Salvestrini, Jean-Paul; Voss, Paul L.; Ougazzaden, Abdallah

    2015-09-01

    GaN, with its wide bandgap of 3.4 eV, has emerged as an efficient material for designing high-efficiency betavoltaic batteries. An important part of designing efficient betavoltaic batteries involves a good understanding of the full process, from the behavior of the nuclear material and the creation of electron-hole pairs all the way through the collection of photo-generated carriers. This paper presents a detailed model based on Monte Carlo and Silvaco for a GaN-based betavoltaic battery device, modeled after Ni-63 as an energy source. The accuracy of the model is verified by comparing it with experimental values obtained for a GaN-based p-i-n structure under scanning electron microscope illumination.

  12. Model of Ni-63 battery with realistic PIN structure

    Energy Technology Data Exchange (ETDEWEB)

    Munson, Charles E.; Voss, Paul L.; Ougazzaden, Abdallah, E-mail: aougazza@georgiatech-metz.fr [Georgia Tech Lorraine, Georgia Tech-C.N.R.S., UMI2958, 2-3 rue Marconi, 57070 Metz (France); School of Electrical and Computer Engineering, Georgia Institute of Technology, 777 Atlantic Drive NW, 30332-0250 Atlanta (United States); Arif, Muhammad; Salvestrini, Jean-Paul [Georgia Tech Lorraine, Georgia Tech-C.N.R.S., UMI2958, 2-3 rue Marconi, 57070 Metz (France); Université de Lorraine, CentraleSupélec, LMOPS, EA 4423, 2 rue E. Belin, 57070 Metz (France); Streque, Jeremy; El Gmili, Youssef [Georgia Tech Lorraine, Georgia Tech-C.N.R.S., UMI2958, 2-3 rue Marconi, 57070 Metz (France); Belahsene, Sofiane; Martinez, Anthony; Ramdane, Abderrahim [Laboratory for Photonics and Nanostructures, CNRS, Route de Nozay, 91460 Marcoussis (France)

    2015-09-14

    GaN, with its wide bandgap of 3.4 eV, has emerged as an efficient material for designing high-efficiency betavoltaic batteries. An important part of designing efficient betavoltaic batteries involves a good understanding of the full process, from the behavior of the nuclear material and the creation of electron-hole pairs all the way through the collection of photo-generated carriers. This paper presents a detailed model based on Monte Carlo and Silvaco for a GaN-based betavoltaic battery device, modeled after Ni-63 as an energy source. The accuracy of the model is verified by comparing it with experimental values obtained for a GaN-based p-i-n structure under scanning electron microscope illumination.

  13. Model of Ni-63 battery with realistic PIN structure

    International Nuclear Information System (INIS)

    Munson, Charles E.; Voss, Paul L.; Ougazzaden, Abdallah; Arif, Muhammad; Salvestrini, Jean-Paul; Streque, Jeremy; El Gmili, Youssef; Belahsene, Sofiane; Martinez, Anthony; Ramdane, Abderrahim

    2015-01-01

    GaN, with its wide bandgap of 3.4 eV, has emerged as an efficient material for designing high-efficiency betavoltaic batteries. An important part of designing efficient betavoltaic batteries involves a good understanding of the full process, from the behavior of the nuclear material and the creation of electron-hole pairs all the way through the collection of photo-generated carriers. This paper presents a detailed model based on Monte Carlo and Silvaco for a GaN-based betavoltaic battery device, modeled after Ni-63 as an energy source. The accuracy of the model is verified by comparing it with experimental values obtained for a GaN-based p-i-n structure under scanning electron microscope illumination

  14. RF magnetron sputtering deposition of NiO/Ni bilayer and approach of the Magnetic behavior using the Preisach model

    Energy Technology Data Exchange (ETDEWEB)

    Bendjerad, A., E-mail: bendjerad@gmail.com [L.E.B. Research Laboratory, Electrical Engineering Department, University of Batna 2, Batna (Algeria); Head of Clean Room, L.E.A Laboratory, University of Batna 2, Batna (Algeria); Boukhtache, S. [L.E.B. Research Laboratory, Electrical Engineering Department, University of Batna 2, Batna (Algeria); Benhaya, A. [Head of Clean Room, L.E.A Laboratory, University of Batna 2, Batna (Algeria); Lahmar, A. [Laboratoire de Physiques de la Matière Condensée (LPMC), University of Picardie Jules Vernes, Amiens (France); Zergoug, M. [C.S.C Centre de soudage et de contrôle, Dely Ibrahim, BP 64 Chéraga, Alger (Algeria); Luneau, D. [Université Claude Bernard Lyon 1 Laboratoire des Multimatériaux, (UMR 5615) 69622 cedex (France)

    2017-04-15

    Bilayer of nickel and nickel oxide were deposited on glass substrates using RF magnetron sputtering technique. The magnetic properties of the prepared thin films were carried out at room temperature in both parallel and perpendicular magnetic field to the sample. The Preisach model was applied to provide a mathematical model of the magnetic hysteresis loop in the case of parallel geometry, along the easy axis of the bi-layer NiO / Ni. Good agreement was obtained between the theoretical and experimental results.

  15. Long range ordering in model Ni-Cr-X alloys

    International Nuclear Information System (INIS)

    Young, G.A.; Eno, D.R.

    2015-01-01

    Nickel-chromium alloys are used throughout commercial nuclear power systems due to their desirable combination of corrosion resistance and mechanical properties. However, some Ni-Cr alloys can undergo long range ordering (LRO), forming the Ni 2 Cr phase when exposed to temperatures < 590 C. degrees. LRO results in lattice contraction, hardening, and a change in slip mode, which, in turn, can cause dimensional changes, internal stress, and appreciable embrittlement. Despite the technological importance of this alloy system, the variables that influence LRO are not well understood and the time-temperature-transformation kinetics poorly defined. In order to assess the risk of LRO in nuclear power systems, the present research uses model Ni-Cr alloys and ageing times up to 10000 hours to define the kinetics of LRO and to assess the effects of cold work, quench rate, and alloying additions. Results show that the hardening caused by ordering is well described by the Kolmogorov-Johnson-Mehl-Avrami (KJMA) equation with an Avrami exponent, n near 0.65 and an apparent activation energy that depends on the starting condition of the alloy. Furnace cooled samples displayed a Q ∼ 244 kJ/mol, which suggests bulk diffusional growth of the ordered phase, while water quenched samples exhibited a Q ∼ 147 kJ/mol, indicating that excess vacancies accelerate ordering. Cold work (10% or 20%) acts to disrupt any ordering that forms on furnace cooling but has no apparent effect on the apparent activation energy or Avrami exponent. Iron additions decrease the temperature below which the ordered phase is stable but do not appear to affect the rate of ordering. Investigation of other alloying suggest that molybdenum (∼ 2.47 wt.%) may accelerate ordering but other alloying elements studied (Si up to 0.28 wt.%, Mn up to 0.19 wt.%, and Nb up to 2.38 wt.%) have little influence. These findings, combined with a review of LRO in commercial alloys indicate that LRO can develop over a wide

  16. Calculation of Gibbs energy of Zr-Al-Ni, Zr-Al-Cu, Al-Ni-Cu and Zr-Al-Ni-Cu liquid alloys based on quasiregular solution model

    International Nuclear Information System (INIS)

    Li, H.Q.; Yang, Y.S.; Tong, W.H.; Wang, Z.Y.

    2007-01-01

    With the effects of electronic structure and atomic size being introduced, the mixing enthalpy as well as the Gibbs energy of the ternary Zr-Al-Cu, Ni-Al-Cu, Zr-Ni-Al and quaternary Zr-Al-Ni-Cu systems are calculated based on quasiregular solution model. The computed results agree well with the experimental data. The sequence of Gibbs energies of different systems is: G Zr-Al-Ni-Cu Zr-Al-Ni Zr-Al-Cu Cu-Al-Ni . To Zr-Al-Cu, Ni-Al-Cu and Zr-Ni-Al, the lowest Gibbs energy locates in the composition range of X Zr 0.39-0.61, X Al = 0.38-0.61; X Ni = 0.39-0.61, X Al = 0.38-0.60 and X Zr = 0.32-0.67, X Al = 0.32-0.66, respectively. And to the Zr-Ni-Al-Cu system with 66.67% Zr, the lowest Gibbs energy is obtained in the region of X Al = 0.63-0.80, X Ni = 0.14-0.24

  17. Ni adsorption and Ni-Al LDH precipitation in a sandy aquifer: An experimental and mechanistic modeling study

    NARCIS (Netherlands)

    Regelink, I.C.; Temminghoff, E.J.M.

    2011-01-01

    Mining activities and industries have created nickel (Ni) contaminations in many parts of the world. The objective of this study is to increase our understanding of Ni adsorption and Nickel-Aluminium Layered Double Hydroxide (Ni-Al LDH) precipitation to reduce Ni mobility in a sandy soil aquifer. At

  18. Predictability of 2-year La Niña events in a coupled general circulation model

    Science.gov (United States)

    DiNezio, Pedro N.; Deser, Clara; Okumura, Yuko; Karspeck, Alicia

    2017-12-01

    The predictability of the duration of La Niña is assessed using the Community Earth System Model Version 1 (CESM1), a coupled climate model capable of simulating key features of the El Niño/Southern Oscillation (ENSO) phenomenon, including the multi-year duration of La Niña. Statistical analysis of a 1800 year long control simulation indicates that a strong thermocline discharge or a strong El Niño can lead to La Niña conditions that last 2 years (henceforth termed 2-year LN). This relationship suggest that 2-year LN maybe predictable 18 to 24 months in advance. Perfect model forecasts performed with CESM1 are used to further explore the link between 2-year LN and the "Discharge" and "Peak El Niño" predictors. Ensemble forecasts are initialized on January and July coinciding with ocean states characterized by peak El Niño amplitudes and peak thermocline discharge respectively. Three cases with different magnitudes of these predictors are considered resulting in a total of six ensembles. Each "Peak El Niño" and "Discharge" ensemble forecast consists of 30 or 20 members respectively, generated by adding a infinitesimally small perturbation to the atmospheric initial conditions unique to each member. The forecasts show that the predictability of 2-year LN, measured by the potential prediction utility (PPU) of the Niño-3.4 SST index during the second year, is related to the magnitude of the initial conditions. Forecasts initialized with strong thermocline discharge or strong peak El Niño amplitude show higher PPU than those with initial conditions of weaker magnitude. Forecasts initialized from states characterized by weaker predictors are less predictable, mainly because the ensemble-mean signal is smaller, and therefore PPU is reduced due to the influence of forecast spread. The error growth of the forecasts, measured by the spread of the Niño-3.4 SST index, is independent of the initial conditions and appears to be driven by wind variability over the

  19. Thermodynamic Modeling of Ag-Ni System Combining Experiments and Molecular Dynamic Simulation

    Science.gov (United States)

    Rajkumar, V. B.; Chen, Sinn-wen

    2017-04-01

    Ag-Ni is a simple and important system with immiscible liquids and (Ag,Ni) phases. Previously, this system has been thermodynamically modeled utilizing certain thermochemical and phase equilibria information based on conjecture. An attempt is made in this study to determine the missing information which are difficult to measure experimentally. The boundaries of the liquid miscibility gap at high temperatures are determined using a pyrometer. The temperature of the liquid ⇌ (Ag) + (Ni) eutectic reaction is measured using differential thermal analysis. Tie-lines of the Ag-Ni system at 1023 K and 1473 K are measured using a conventional metallurgical method. The enthalpy of mixing of the liquid at 1773 K and the (Ag,Ni) at 973 K is calculated by molecular dynamics simulation using a large-scale atomic/molecular massively parallel simulator. These results along with literature information are used to model the Gibbs energy of the liquid and (Ag,Ni) by a calculation of phase diagrams approach, and the Ag-Ni phase diagram is then calculated.

  20. Improved simulation of two types of El Niño in CMIP5 models

    International Nuclear Information System (INIS)

    Kug, Jong-Seong; Ham, Yoo-Geun; Lee, June-Yi; Jin, Fei-Fei

    2012-01-01

    Using the coupled general circulation models (CGCMs) participating in phases 3 and 5 of the Coupled Model Intercomparison Project (CMIP3 and CMIP5), simulations of the two types of El Niño event are evaluated. Previous studies using CMIP3 models pointed out that most of the models tend to simulate a single type of El Niño, and have serious problems in simulating the two types of El Niño independently. On the average, the CGCMs in CMIP5 have slightly better performance in simulating the two types of El Niño event independently with more distinct spatial patterns, compared to those in CMIP3. It is demonstrated that the precipitation response to Cold Tongue El Niño is one of the important factors in simulating the two types of El Niño independently in coupled models, and this precipitation response is closely related to the dry bias over the equatorial eastern Pacific. (letter)

  1. Modeling of Ni Diffusion Induced Austenite Formation in Ferritic Stainless Steel Interconnects

    DEFF Research Database (Denmark)

    Chen, Ming; Molin, Sebastian; Zhang, L.

    2015-01-01

    Ferritic stainless steel interconnect plates are widely used in planar solid oxide fuel cell (SOFC) or electrolysis cell (SOEC) stacks. During stack production and operation, nickel from the Ni/YSZ fuel electrode or from the Ni contact component diffuses into the IC plate, causing transformation...... of the ferritic phase into an austenitic phase in the interface region. This is accompanied with changes in volume and in mechanical and corrosion properties of the IC plates. In this work, kinetic modeling of the inter-diffusion between Ni and FeCr based ferritic stainless steel was conducted, using the CALPHAD...

  2. Modeling of Ni Diffusion Induced Austenite Formation in Ferritic Stainless Steel Interconnects

    DEFF Research Database (Denmark)

    Chen, Ming; Alimadadi, Hossein; Molin, Sebastian

    2017-01-01

    Ferritic stainless steel interconnect plates are widely used in planar solid oxide fuel cell and electrolysis cell stacks. During stack production and operation, nickel from the Ni/yttria stabilized zirconia fuel electrode or from the Ni contact component layer diffuses into the interconnect plate......, causing transformation of the ferritic phase into an austenitic phase in the interface region. This is accompanied with changes in volume, and in mechanical and corrosion properties of the interconnect plates. In this work, kinetic modeling of the inter-diffusion between Ni and FeCr based ferritic...

  3. Intermediate Co/Ni-base model superalloys — Thermophysical properties, creep and oxidation

    International Nuclear Information System (INIS)

    Zenk, Christopher H.; Neumeier, Steffen; Engl, Nicole M.; Fries, Suzana G.; Dolotko, Oleksandr; Weiser, Martin; Virtanen, Sannakaisa; Göken, Mathias

    2016-01-01

    The mechanical properties of γ′-strengthened Co–Ni–Al–W–Cr model superalloys extending from pure Ni-base to pure Co-base superalloys have been assessed. Differential scanning calorimetry measurements and thermodynamic calculations match well and show that the γ′ solvus temperature decreases with increasing Co-content. The γ/γ′ lattice misfit is negative on the Ni- and positive on the Co-rich side. High Ni-contents decelerate the oxidation kinetics up to a factor of 15. The creep strength of the Ni-base alloy increases by an order of magnitude with additions of Co before it deteriorates strongly upon higher additions despite an increasing γ′ volume fraction.

  4. Modelling and experimental investigation of geometrically graded NiTi shape memory alloys

    International Nuclear Information System (INIS)

    Shariat, Bashir S; Liu, Yinong; Rio, Gerard

    2013-01-01

    To improve actuation controllability of a NiTi shape memory alloy component in applications, it is desirable to create a wide stress window for the stress-induced martensitic transformation in the alloy. One approach is to create functionally graded NiTi with a geometric gradient in the actuation direction. This geometric gradient leads to transformation load and displacement gradients in the structure. This paper reports a study of the pseudoelastic behaviour of geometrically graded NiTi by means of mechanical model analysis and experimentation using three types of sample geometry. Closed-form solutions are obtained for nominal stress–strain variation of such components under cyclic tensile loading and the predictions are validated with experimental data. The geometrically graded NiTi samples exhibit a distinctive positive stress gradient for the stress-induced martensitic transformation and the slope of the stress gradient can be adjusted by sample geometry design. (paper)

  5. Ab initio defect properties for modeling radiation-induced segregation in Fe-Ni-Cr alloys

    International Nuclear Information System (INIS)

    Tucker, J.D.; Allen, T.R.; Morgan, D.; Najafabadi, R.

    2007-01-01

    Radiation-induced segregation (RIS) has been studied with experimental and theoretical methods for over 30 years and many models have been built in an attempt to understand the mechanisms involved. Input parameters for these models are often not available experimentally, limiting the model's predictive capabilities. In an effort to obtain more accurate input parameters we have calculated formation and migration energies for both vacancies and interstitials using ab initio methods in face-centered cubic (fcc) Fe-Ni-Cr alloys, with an emphasis on Ni-based alloys with dilute concentrations of Cr and Fe. The data gives new insight into a number of properties including species dependence of migration barriers and binding energies for both vacancies and interstitials. We predict species dependent vacancy migration barriers for Cr (0.82 eV), Fe (0.95 eV), and Ni (1.08 eV) and interstitial migration barriers for Cr (0.08 eV), Fe (0.11 eV), and Ni (0.14 eV) in a Ni matrix. Significant binding between Cr and the interstitial dumbbell was also observed. Further work will build on this data to create a rate theory models for RIS. (author)

  6. Stratospheric Pathway of El Niño-Southern Oscillation in CMIP5 Models

    Science.gov (United States)

    Iza, Maddalen; Calvo, Natalia; Hurwitz, Margaret; Cagnazzo, Chiara; Peña-Ortiz, Cristina; Butler, Amy; Ineson, Sarah; Manzini, Elisa; Garfinkel, Chaim

    2014-05-01

    Recent studies have shown the role of the stratosphere as an intermediary between the ENSO signal in the tropical troposphere and some tropospheric teleconnections in the Northern Hemisphere (NH) winter. An additional type of ENSO, distinct from the traditional Canonical ENSO has also been identified in the last years. It is characterized by sea surface temperature anomalies in the central Pacific and referred as Central Pacific El Niño (CP-ENSO), whereas the Canonical ENSO is referred as the eastern Pacific El Niño (EP-ENSO). While it has been shown that exclusively CP-ENSO has an effect on the SH polar lower stratosphere, it remains unclear whether the effects of CP- and EP-ENSO differ in the NH polar stratosphere. Up to now, the role of the stratosphere on the ENSO signal has been investigated in atmospheric general circulation models where the sea-surface temperatures were prescribed following observations. We investigate here the NH stratospheric signal of the two distinct types of El Niño events (EP and CP) in a group of atmosphere-ocean coupled models, as those provided by CMIP5. The role of the stratosphere in NH winter tropospheric teleconnections is also explored. Two sets of CMIP5 simulations are considered (preindustrial control and historical experiments) and compared to reanalysis data. Results show that the comparison of the stratospheric El Niño signal between high-top and low-top models is difficult to assess, as the early winter tropospheric teleconnections are already different in both sets of models. The results obtained for EP in the high-top model ensemble-mean show a robust signal in the NH polar stratosphere with a significant warming about 4 K, which propagates downwards throughout the winter season towards the troposphere, in agreement with observations. During CP events, the anomalous warming is limited to the NH upper polar stratosphere and does not propagate downwards. Thus, CMIP5 high-top models reveal significant differences in

  7. Thermodynamic Modelling of Fe-Cr-Ni-Spinel Formation at the Light-Water Reactor Conditions

    International Nuclear Information System (INIS)

    Kurepin, V. A.; Kulik, D. A.; Hitpold, A.; Nicolet, M.

    2002-03-01

    In the light water reactors (LWR), the neutron activation and transport of corrosion products is of concern in the context of minimizing the radiation doses received by the personnel during maintenance works. A practically useful model for transport and deposition of the stainless steel corrosion products in LWR can only be based on an improved understanding of chemical processes, in particular, on the attainment of equilibrium in this hydrothermal system, which can be described by means of a thermodynamic solid-solution -aqueous-solution (SSAS) model. In this contribution, a new thermodynamic model for a Fe-Cr-Ni multi-component spinel solid solutions was developed that considers thermodynamic consequences of cation interactions in both spinel sub-Iattices. The obtained standard thermodynamic properties of two ferrite and two chromite end-members and their mixing parameters at 90 bar pressure and 290 *c temperature predict a large miscibility gap between (Fe,Ni) chromite and (Fe,Ni) ferrite phases. Together with the SUPCRT92-98 thermo- dynamic database for aqueous species, the 'spinel' thermodynamic dataset was applied to modeling oxidation of austenitic stainless steel in hydrothermal water at 290*C and 90 bar using the Gibbs energy minimization (GEM) algorithm, implemented in the GEMS-PSI code. Firstly, the equilibrium compositions of steel oxidation products were modelIed as function of oxygen fugacity .fO 2 by incremental additions of O 2 in H 2 O-free system Cr-Fe- Ni-O. Secondly, oxidation of corrosion products in the Fe-Cr-Ni-O-H aquatic system was modelIed at different initial solid/water ratios. It is demonstrated that in the transition region from hydrogen regime to oxygen regime, the most significant changes in composition of two spinel-oxide phases (chromite and ferrite) and hematite must take place. Under more reduced conditions, the Fe-rich ferrite (magnetite) and Ni-poor chromite phases co-exist at equilibrium with a metal Ni phase, maintaining

  8. Simulation of Ni-MH Batteries via an Equivalent Circuit Model for Energy Storage Applications

    Directory of Open Access Journals (Sweden)

    Ying Zhu

    2016-01-01

    Full Text Available Impedance measurement was conducted at the entire cell level for studying of the Ni-MH rechargeable batteries. An improved equivalent circuit model considering diffusion process is proposed for simulation of battery impedance data at different charge input levels. The cell capacity decay was diagnosed by analyzing the ohmic resistance, activation resistance, and mass transfer resistance of the Ni-MH cells with degraded capacity. The capacity deterioration of this type, Ni-MH cell, is considered in relation to the change of activation resistance of the nickel positive electrodes. Based on the report and surface analysis obtained from the energy dispersive X-ray spectroscopy, the composition formula of metal-hydride electrodes can be closely documented as the AB5 type alloy and the “A” elements are recognized as lanthanum (La and cerium (Ce. The capacity decay of the Ni-MH cell is potentially initiated due to starved electrolyte for the electrochemical reaction of active materials inside the Ni-MH battery, and the discharge product of Ni(OH2 at low state-of-charge level is anticipated to have more impeding effects on electrode kinetic process for higher power output and efficient energy delivery.

  9. A coupled model between hydrogen diffusion and mechanical behavior of superelastic NiTi alloys

    Science.gov (United States)

    Elkhal Letaief, W.; Hassine, T.; Gamaoun, F.

    2017-07-01

    The undesirable effects of hydrogen show significant alterations to the thermomechanical behavior of superelastic NiTi shape memory alloys. Through experimental results, the presence of hydrogen induces a delay of forward transformation. Added to that, hydrogen-induced expansion is clearly noticed. We also remark a loss of superelasticity. These effects occur according to the hydrogen absorption by the NiTi alloy. The aim of this paper is to develop a coupled diffusion-mechanical model of shape memory alloys, which regards the aforesaid effects of hydrogen on the thermomechanical behavior and the transformation mechanism of NiTi alloys. The model is derived from the relationship between the chemical potential of hydrogen and the thermodynamics laws. Furthermore, we introduce a special transformation hardening function that predicts stress-strain behavior well during the transformation plateau. The model is implemented in ABAQUS finite element analysis software through the UMAT and UMATHT subroutines. The simulation results present good concordance with the experiments.

  10. Seasonal Synchronization of a Simple Stochastic Dynamical Model Capturing El Niño Diversity

    Science.gov (United States)

    Thual, S.; Majda, A.; Chen, N.

    2017-12-01

    The El Niño-Southern Oscillation (ENSO) has significant impact on global climate and seasonal prediction. Recently, a simple ENSO model was developed that automatically captures the ENSO diversity and intermittency in nature, where state-dependent stochastic wind bursts and nonlinear advection of sea surface temperature (SST) are coupled to simple ocean-atmosphere processes that are otherwise deterministic, linear and stable. In the present article, it is further shown that the model can reproduce qualitatively the ENSO synchronization (or phase-locking) to the seasonal cycle in nature. This goal is achieved by incorporating a cloud radiative feedback that is derived naturally from the model's atmosphere dynamics with no ad-hoc assumptions and accounts in simple fashion for the marked seasonal variations of convective activity and cloud cover in the eastern Pacific. In particular, the weak convective response to SSTs in boreal fall favors the eastern Pacific warming that triggers El Niño events while the increased convective activity and cloud cover during the following spring contributes to the shutdown of those events by blocking incoming shortwave solar radiations. In addition to simulating the ENSO diversity with realistic non-Gaussian statistics in different Niño regions, both the eastern Pacific moderate and super El Niño, the central Pacific El Niño as well as La Niña show a realistic chronology with a tendency to peak in boreal winter as well as decreased predictability in spring consistent with the persistence barrier in nature. The incorporation of other possible seasonal feedbacks in the model is also documented for completeness.

  11. 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

    Science.gov (United States)

    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

  12. 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.

    Directory of Open Access Journals (Sweden)

    Ning Zhang

    Full Text Available 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.

  13. Steam reforming of biomass gasification tar using benzene as a model compound over various Ni supported metal oxide catalysts.

    Science.gov (United States)

    Park, Hyun Ju; Park, Sung Hoon; Sohn, Jung Min; Park, Junhong; Jeon, Jong-Ki; Kim, Seung-Soo; Park, Young-Kwon

    2010-01-01

    The steam reforming of benzene as a model compound of biomass gasification tar was carried out over various Ni/metal oxide catalysts. The effects of the support, temperature, Ni-precursor, Ni loading and reaction time were examined, and their catalytic performance was compared with that of a commercial Ni catalyst. Among the Ni/metal oxide catalysts used, 15 wt% Ni/CeO(2)(75%)-ZrO(2)(25%) showed the highest catalytic performance owing to its greater redox characteristics and increased surface area, irrespective of the reaction temperature. The catalytic activity of 15 wt% Ni/CeO(2)(75%)-ZrO(2)(25%) was higher than that of the commercial Ni catalyst. Moreover, the catalyst activity was retained due to its excellent resistance to coke deposition even after 5h. The Ni-precursor played a critical role in the catalytic activity. With the exception of nickel nitrate, all the Ni-precursors (chloride and sulfate) caused deactivation of the catalyst.

  14. Mathematical Modeling of Ni/H2 and Li-Ion Batteries

    Science.gov (United States)

    Weidner, John W.; White, Ralph E.; Dougal, Roger A.

    2001-01-01

    The modelling effort outlined in this viewgraph presentation encompasses the following topics: 1) Electrochemical Deposition of Nickel Hydroxide; 2) Deposition rates of thin films; 3) Impregnation of porous electrodes; 4) Experimental Characterization of Nickel Hydroxide; 5) Diffusion coefficients of protons; 6) Self-discharge rates (i.e., oxygen-evolution kinetics); 7) Hysteresis between charge and discharge; 8) Capacity loss on cycling; 9) Experimental Verification of the Ni/H2 Battery Model; 10) Mathematical Modeling Li-Ion Batteries; 11) Experimental Verification of the Li-Ion Battery Model; 11) Integrated Power System Models for Satellites; and 12) Experimental Verification of Integrated-Systems Model.

  15. Asymptotic solution for the El Niño time delay sea—air oscillator model

    International Nuclear Information System (INIS)

    Mo Jia-Qi; Lin Wan-Tao; Lin Yi-Hua

    2011-01-01

    A sea—air oscillator model is studied using the time delay theory. The aim is to find an asymptotic solving method for the El Niño-southern oscillation (ENSO) model. Employing the perturbed method, an asymptotic solution of the corresponding problem is obtained. Thus we can obtain the prognoses of the sea surface temperature (SST) anomaly and the related physical quantities. (general)

  16. Fatigue Modeling for Superelastic NiTi Considering Cyclic Deformation and Load Ratio Effects

    Science.gov (United States)

    Mahtabi, Mohammad J.; Shamsaei, Nima

    2017-09-01

    A cumulative energy-based damage model, called total fatigue toughness, is proposed for fatigue life prediction of superelastic NiTi alloys with various deformation responses (i.e., transformation stresses), which also accounts for the effects of mean strain and stress. Mechanical response of superelastic NiTi is highly sensitive to chemical composition, material processing, as well as operating temperature; therefore, significantly different deformation responses may be obtained for seemingly identical NiTi specimens. In this paper, a fatigue damage parameter is proposed that can be used for fatigue life prediction of superelastic NiTi alloys with different mechanical properties such as loading and unloading transformation stresses, modulus of elasticity, and austenite-to-martensite start and finish strains. Moreover, the model is capable of capturing the effects of tensile mean strain and stress on the fatigue behavior. Fatigue life predictions using the proposed damage parameter for specimens with different cyclic stress responses, tested at various strain ratios ( R ɛ = ɛ min /ɛ max) are shown to be in very good agreement with the experimentally observed fatigue lives.

  17. Atomistic modeling of ternary additions to NiTi and quaternary additions to Ni-Ti-Pd, Ni-Ti-Pt and Ni-Ti-Hf shape memory alloys

    Energy Technology Data Exchange (ETDEWEB)

    Mosca, H.O., E-mail: hmosca@cnea.gov.ar [Gcia. Investigacion y Aplicaciones, CNEA, Av. Gral Paz 1499, B1650KNA San Martin (Argentina); GCMM, UTN, FRG Pacheco, Av. H. Yrigoyen 288, Gral. Pacheco (Argentina); Bozzolo, G. [Loyola University Maryland, 4501 N. Charles St., Baltimore, MD 21210 (United States); Grosso, M.F. del [Gcia. Investigacion y Aplicaciones, CNEA, Av. Gral Paz 1499, B1650KNA San Martin (Argentina); GCMM, UTN, FRG Pacheco, Av. H. Yrigoyen 288, Gral. Pacheco (Argentina); Consejo Nacional de Investigaciones Cientificas y Tecnicas, CONICET (Argentina)

    2012-08-15

    The behavior of ternary and quaternary additions to NiTi shape memory alloys is investigated using a quantum approximate method for the energetics. Ternary additions X to NiTi and quaternary additions to Ni-Ti-Pd, Ni-Ti-Pt, and Ni-Ti-Hf alloys, for X=Au, Pt, Ir, Os, Re, W, Ta,Ag, Pd, Rh, Ru, Tc, Mo, Nb, Zr, Zn, Cu, Co, Fe, Mn, V, Sc, Si, Al and Mg are considered. Bulk properties such as lattice parameter, energy of formation, and bulk modulus of the B2 alloys are studied for variations due to the presence of one or two simultaneous additives.

  18. Thermal effects in a mechanical model for pseudoelastic behavior of NiTi wires

    Directory of Open Access Journals (Sweden)

    Hugo Soul

    2007-12-01

    Full Text Available A mechanical model for pseudoelastic behavior of NiTi wires is proposed with the aim to predict the behavior of Shape Memory Alloys(SMA damping wire elements in model structures. We have considered at first a simple linearwise stress-strain relationship to describe the basic isothermal behavior of the SMA members. Then, this basic model is modified in order to include the effect of the strain rate. The model is based on detailed experimental characterization performed on a Ni rich NiTi superelastic wire which included the study of the localized character of the deformation and the local heat generation associated with the stress induced martensitic transformation occurring in these alloys. Heat conduction along the wire and heat interaction with the surroundings was also considered. In that way, the resulting local temperature field around the transformation front is assessed and its effect on the progression of the transformation is evaluated. It is shown how the simple mechanical model reproduces the global mechanical behavior, including the existence of a maximum in the damping capacity with the transformation rate.

  19. Thermodynamic Modelling of Fe-Cr-Ni-Spinel Formation at the Light-Water Reactor Conditions

    Energy Technology Data Exchange (ETDEWEB)

    Kurepin, V.A.; Kulik, D.A.; Hitpold, A.; Nicolet, M

    2002-03-01

    In the light water reactors (LWR), the neutron activation and transport of corrosion products is of concern in the context of minimizing the radiation doses received by the personnel during maintenance works. A practically useful model for transport and deposition of the stainless steel corrosion products in LWR can only be based on an improved understanding of chemical processes, in particular, on the attainment of equilibrium in this hydrothermal system, which can be described by means of a thermodynamic solid-solution -aqueous-solution (SSAS) model. In this contribution, a new thermodynamic model for a Fe-Cr-Ni multi-component spinel solid solutions was developed that considers thermodynamic consequences of cation interactions in both spinel sub-Iattices. The obtained standard thermodynamic properties of two ferrite and two chromite end-members and their mixing parameters at 90 bar pressure and 290 *c temperature predict a large miscibility gap between (Fe,Ni) chromite and (Fe,Ni) ferrite phases. Together with the SUPCRT92-98 thermo- dynamic database for aqueous species, the 'spinel' thermodynamic dataset was applied to modeling oxidation of austenitic stainless steel in hydrothermal water at 290*C and 90 bar using the Gibbs energy minimization (GEM) algorithm, implemented in the GEMS-PSI code. Firstly, the equilibrium compositions of steel oxidation products were modelIed as function of oxygen fugacity .fO{sub 2} by incremental additions of O{sub 2} in H{sub 2}O-free system Cr-Fe- Ni-O. Secondly, oxidation of corrosion products in the Fe-Cr-Ni-O-H aquatic system was modelIed at different initial solid/water ratios. It is demonstrated that in the transition region from hydrogen regime to oxygen regime, the most significant changes in composition of two spinel-oxide phases (chromite and ferrite) and hematite must take place. Under more reduced conditions, the Fe-rich ferrite (magnetite) and Ni-poor chromite phases co-exist at equilibrium with a metal Ni

  20. Characterization of the hierarchical microstructure of a Ni-Al-Ti model alloy; Charakterisierung der hierarchischen Mikrostruktur einer Ni-Al-Ti Modell-Legierung

    Energy Technology Data Exchange (ETDEWEB)

    Vogel, Florian

    2014-02-28

    Phase separation of γ{sup '} precipitates determines the microstructure and mechanical properties of nickel-based superalloys. Upon ageing, γ spheres form inside ordered (L1{sub 2}) γ{sup '} precipitates, undergo a morphological change to plates and finally split the γ{sup '} precipitates. To clarify the identity of the insufficiently characterized γ particles and to elucidate their influence on the evolution of the microstructure and the mechanical properties, differently heat treated samples of a Ni-Al-Ti modell alloy were investigated from the micrometer to the atomic scale. The single crystalline cast material was broadly characterized by means of light and scanning electron microscopy, the laue method (back-reflection), differential scanning calorimetry as well as electron probe microanalysis. Dendritic segregations were found, whereas the dendrite cores show an enrichment in nickel and aluminum and in turn the interdendritic regions show an enrichment in titanium. An adequate combination of temperature and time was determined on the basis of quantitative analyses after different homogenization treatments. The evolution of the hierarchical microstructure was investigated on the nanometer scale by means of transmission electron microscopy and on the atomic scale with atom probe tomography. The combined analyses reveal that Ni-rich clusters form within the γ{sup '} precipitates during the early stages of phase separation. These Ni-rich clusters coalesce and thereby form γ spheres which undergo a morphological change to plates accompanied by a chemical evolution. In the beginning the γ spheres are located well within the metastable γ + γ{sup '} two-phase region and later, after the morphological change, achieve the equilibrium composition of the γ phase. Furthermore the involved energies were considered in order to elucidate the driving forces for the phase separation of γ{sup '} precipitates. A correlation between the

  1. Reactive transport model and apparent Kd of Ni in the near field of a HLW repository in granite

    Science.gov (United States)

    Lu, Chuanhe; Samper, Javier; Luis Cormenzana, José; Ma, Hongyun; Montenegro, Luis; Ángel Cuñado, Miguel

    2012-12-01

    Current performance assessment models for radionuclide migration through the near field of high-level radioactive waste repositories often rely on the assumption of a constant Kd for sorption. The validity of such assumption is evaluated here with a reactive transport model for Ni2+ in the near field of a repository in granite. Model results show that Ni2+ sorbs mainly by surface complexation on weak sorption sites. The apparent Kd of Ni2+, Kda, depends on the concentration of dissolved Ni and pH and is constant only when the concentration of dissolved Ni is smaller than 10-6 mol/L. The results of the sensitivity runs show that Kda is sensitive to the water flux at the bentonite-granite interface, the effective diffusion of the bentonite and the concentration of weak sorption sites of the bentonite. The competition of other nuclides such as Cs+ on Ni2+ sorption is not important. Corrosion products, however, affect significantly the sorption of Ni2+ on the bentonite. The model with a constant Kd does not reproduce the release rates of Ni2+ from the bentonite into the granite. A model with a variable Kd which depends on the concentration of dissolved Ni2+ and pH may provide an acceptable surrogate of the multicomponent reactive transport model for the conditions of the repository considered in our model. Simulations using the Kd-approach were performed with GoldSim based on the interpolation in the pH and concentration table, while the reactive transport model simulations were performed with CORE2D which incorporates multisite surface complexation.

  2. Topological model of austenite-martensite interfaces in Cu-Al-Ni alloy

    Czech Academy of Sciences Publication Activity Database

    Ostapovets, Andriy; Zárubová, Niva; Paidar, Václav

    2012-01-01

    Roč. 122, č. 3 (2012), s. 493-496 ISSN 0587-4246. [International Symposium on Physics of Materials, ISPMA /12./. Praha, 04.09.2011-08.09.2011] R&D Projects: GA AV ČR IAA100100920 Institutional research plan: CEZ:AV0Z10100520 Keywords : CuAlNi * alloy * experimental data * in-situ * topological models * transmission electron microscopy Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 0.531, year: 2012

  3. Thermomechanical model for NiTi shape memory wires

    Czech Academy of Sciences Publication Activity Database

    Frost, Miroslav; Sedlák, Petr; Sippola, M.; Šittner, Petr

    2010-01-01

    Roč. 19, č. 9 (2010), s. 1-10 ISSN 0964-1726 R&D Projects: GA MŠk(CZ) 1M06031; GA ČR(CZ) GA106/09/1573; GA ČR(CZ) GP106/09/P302; GA ČR GAP108/10/1296 Institutional research plan: CEZ:AV0Z20760514; CEZ:AV0Z10100520 Keywords : shape memory alloys * modeling * proportional loading Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.094, year: 2010 http://apps.isiknowledge.com/full_record.do?product=WOS&search_mode=GeneralSearch&qid=3&SID=U2fe5mHN9p3gHClCdF1&page=1&doc=1

  4. Computational Modeling to Predict Fatigue Behavior of NiTi Stents: What Do We Need?

    Science.gov (United States)

    Dordoni, Elena; Petrini, Lorenza; Wu, Wei; Migliavacca, Francesco; Dubini, Gabriele; Pennati, Giancarlo

    2015-01-01

    NiTi (nickel-titanium) stents are nowadays commonly used for the percutaneous treatment of peripheral arterial disease. However, their effectiveness is still debated in the clinical field. In fact a peculiar cyclic biomechanical environment is created before and after stent implantation, with the risk of device fatigue failure. An accurate study of the device fatigue behavior is of primary importance to ensure a successful stenting procedure. Regulatory authorities recognize the possibility of performing computational analyses instead of experimental tests for the assessment of medical devices. However, confidence in numerical methods is only possible after verification and validation of the models used. For the case of NiTi stents, mechanical properties are strongly dependent on the device dimensions and the whole treatments undergone during manufacturing process. Hence, special attention should be paid to the accuracy of the description of the device geometry and the material properties implementation into the numerical code, as well as to the definition of the fatigue limit. In this paper, a path for setting up an effective numerical model for NiTi stent fatigue assessment is proposed and the results of its application in a specific case study are illustrated. PMID:26011245

  5. Cu-Containing Fe-Ni Corrosion-Resistant Alloys Designed by a Cluster-Based Stable Solid Solution Model

    Science.gov (United States)

    Li, Baozeng; Wang, Qing; Wang, Yingmin; Li, Chunyan; Qiang, Jianbing; Ji, Chunjun; Dong, Chuang

    2012-02-01

    Copper is a good corrosion resisting element, but due to its immiscibility with Fe, it is only used as a minor-alloying element in stainless steels. In this work, we introduced a double-cluster structure model [CuNi12][NiFe12] m for stable solid solutions in Cu-containing Fe-Ni corrosion-resistant invar alloys. Our model takes into account all of the enthalpies between the element pairs by assuming Fe-Ni and Ni-Cu nearest neighbors and by avoiding Fe-Cu ones, so that the ideally stabilized structures are described by mixing two cuboctahedral clusters in the fcc lattice, NiFe12 and CuNi12. Two alloy series were designed by varying the relative proportions of the two clusters and the Cu contents. It was proved that the alloys with Cu contents below those prescribed by this model could easily be solutionized and water-quenched to a monolithic fcc solid solution, and resultant alloys possessed good corrosion-resisting properties in 3.5 wt pct NaCl solution.

  6. Reactive transport model of the formation of oxide-type Ni-laterite profiles (Punta Gorda, Moa Bay, Cuba)

    Science.gov (United States)

    Domènech, Cristina; Galí, Salvador; Villanova-de-Benavent, Cristina; Soler, Josep M.; Proenza, Joaquín A.

    2017-10-01

    Oxide-type Ni-laterite deposits are characterized by a dominant limonite zone with goethite as the economically most important Ni ore mineral and a thin zone of hydrous Mg silicate-rich saprolite beneath the magnesium discontinuity. Fe, less soluble, is mainly retained forming goethite, while Ni is redeposited at greater depth in a Fe(III) and Ni-rich serpentine (serpentine II) or in goethite, where it adsorbs or substitutes for Fe in the mineral structure. Here, a 1D reactive transport model, using CrunchFlow, of Punta Gorda oxide-type Ni-laterite deposit (Moa Bay, Cuba) formation is presented. The model reproduces the formation of the different laterite horizons in the profile from an initial, partially serpentinized peridotite, in 106 years, validating the conceptual model of the formation of this kind of deposits in which a narrow saprolite horizon rich in Ni-bearing serpentine is formed above peridotite parent rock and a thick limonite horizon is formed over saprolite. Results also confirm that sorption of Ni onto goethite can explain the weight percent of Ni found in the Moa goethite. Sensitivity analyses accounting for the effect of key parameters (composition, dissolution rate, carbonate concentration, quartz precipitation) on the model results are also presented. It is found that aqueous carbonate concentration and quartz precipitation significantly affects the laterization process rate, while the effect of the composition of secondary serpentine or of mineral dissolution rates is minor. The results of this reactive transport modeling have proven useful to validate the conceptual models derived from field observations.

  7. Structural Time Series Model for El Niño Prediction

    Science.gov (United States)

    Petrova, Desislava; Koopman, Siem Jan; Ballester, Joan; Rodo, Xavier

    2015-04-01

    ENSO is a dominant feature of climate variability on inter-annual time scales destabilizing weather patterns throughout the globe, and having far-reaching socio-economic consequences. It does not only lead to extensive rainfall and flooding in some regions of the world, and anomalous droughts in others, thus ruining local agriculture, but also substantially affects the marine ecosystems and the sustained exploitation of marine resources in particular coastal zones, especially the Pacific South American coast. As a result, forecasting of ENSO and especially of the warm phase of the oscillation (El Niño/EN) has long been a subject of intense research and improvement. Thus, the present study explores a novel method for the prediction of the Niño 3.4 index. In the state-of-the-art the advantageous statistical modeling approach of Structural Time Series Analysis has not been applied. Therefore, we have developed such a model using a State Space approach for the unobserved components of the time series. Its distinguishing feature is that observations consist of various components - level, seasonality, cycle, disturbance, and regression variables incorporated as explanatory covariates. These components are aimed at capturing the various modes of variability of the N3.4 time series. They are modeled separately, then combined in a single model for analysis and forecasting. Customary statistical ENSO prediction models essentially use SST, SLP and wind stress in the equatorial Pacific. We introduce new regression variables - subsurface ocean temperature in the western equatorial Pacific, motivated by recent (Ramesh and Murtugudde, 2012) and classical research (Jin, 1997), (Wyrtki, 1985), showing that subsurface processes and heat accumulation there are fundamental for initiation of an El Niño event; and a southern Pacific temperature-difference tracer, the Rossbell dipole, leading EN by about nine months (Ballester, 2011).

  8. Development of mechanistic sorption model and treatment of uncertainties for Ni sorption on montmorillonite/bentonite

    International Nuclear Information System (INIS)

    Ochs, Michael; Ganter, Charlotte; Tachi, Yukio; Suyama, Tadahiro; Yui, Mikazu

    2011-02-01

    Sorption and diffusion of radionuclides in buffer materials (bentonite) are the key processes in the safe geological disposal of radioactive waste, because migration of radionuclides in this barrier is expected to be diffusion-controlled and retarded by sorption processes. It is therefore necessary to understand the detailed/coupled processes of sorption and diffusion in compacted bentonite and develop mechanistic /predictive models, so that reliable parameters can be set under a variety of geochemical conditions relevant to performance assessment (PA). For this purpose, JAEA has developed the integrated sorption and diffusion (ISD) model/database in montmorillonite/bentonite systems. The main goal of the mechanistic model/database development is to provide a tool for a consistent explanation, prediction, and uncertainty assessment of K d as well as diffusion parameters needed for the quantification of radionuclide transport. The present report focuses on developing the thermodynamic sorption model (TSM) and on the quantification and handling of model uncertainties in applications, based on illustrating by example of Ni sorption on montmorillonite/bentonite. This includes 1) a summary of the present state of the art of thermodynamic sorption modeling, 2) a discussion of the selection of surface species and model design appropriate for the present purpose, 3) possible sources and representations of TSM uncertainties, and 4) details of modeling, testing and uncertainty evaluation for Ni sorption. Two fundamentally different approaches are presented and compared for representing TSM uncertainties: 1) TSM parameter uncertainties calculated by FITEQL optimization routines and some statistical procedure, 2) overall error estimated by direct comparison of modeled and experimental K d values. The overall error in K d is viewed as the best representation of model uncertainty in ISD model/database development. (author)

  9. The asymmetric effects of El Niño and La Niña on the East Asian winter monsoon and their simulation by CMIP5 atmospheric models

    Science.gov (United States)

    Guo, Zhun; Zhou, Tianjun; Wu, Bo

    2017-02-01

    El Niño-Southern Oscillation (ENSO) events significantly affect the year-by-year variations of the East Asian winter monsoon (EAWM). However, the effect of La Niña events on the EAWM is not a mirror image of that of El Niño events. Although the EAWM becomes generally weaker during El Niño events and stronger during La Niña winters, the enhanced precipitation over the southeastern China and warmer surface air temperature along the East Asian coastline during El Niño years are more significant. These asymmetric effects are caused by the asymmetric longitudinal positions of the western North Pacific (WNP) anticyclone during El Niño events and the WNP cyclone during La Niña events; specifically, the center of the WNP cyclone during La Niña events is westward-shifted relative to its El Niño counterpart. This central-position shift results from the longitudinal shift of remote El Niño and La Niña anomalous heating, and asymmetry in the amplitude of local sea surface temperature anomalies over the WNP. However, such asymmetric effects of ENSO on the EAWM are barely reproduced by the atmospheric models of Phase 5 of the Coupled Model Intercomparison Project (CMIP5), although the spatial patterns of anomalous circulations are reasonably reproduced. The major limitation of the CMIP5 models is an overestimation of the anomalous WNP anticyclone/cyclone, which leads to stronger EAWM rainfall responses. The overestimated latent heat flux anomalies near the South China Sea and the northern WNP might be a key factor behind the overestimated anomalous circulations.

  10. Cluster dynamics modeling of Mn-Ni-Si precipitates in ferritic-martensitic steel under irradiation

    Science.gov (United States)

    Ke, Jia-Hong; Ke, Huibin; Odette, G. Robert; Morgan, Dane

    2018-01-01

    Mn-Ni-Si precipitates (MNSPs) are known to be responsible for irradiation-induced hardening and embrittlement in structural alloys used in nuclear reactors. Studies have shown that precipitation of the MNSPs in 9-Cr ferritic-martensitic (F-M) alloys, such as T91, is strongly associated with heterogeneous nucleation on dislocations, coupled with radiation-induced solute segregation to these sinks. Therefore it is important to develop advanced predictive models for Mn-Ni-Si precipitation in F-M alloys under irradiation based on an understanding of the underlying mechanisms. Here we use a cluster dynamics model, which includes multiple effects of dislocations, to study the evolution of MNSPs in a commercial F-M alloy T91. The model predictions are calibrated by data from proton irradiation experiments at 400 °C. Radiation induced solute segregation at dislocations is evaluated by a continuum model that is integrated into the cluster dynamics simulations, including the effects of dislocations as heterogeneous nucleation sites. The result shows that MNSPs in T91 are primarily irradiation-induced and, in particular, both heterogeneous nucleation and radiation-induced segregation at dislocations are necessary to rationalize the experimental observations.

  11. [NiFe] hydrogenase structural and functional models: new bio-inspired catalysts for hydrogen evolution

    International Nuclear Information System (INIS)

    Oudart, Y.

    2006-09-01

    Hydrogenase enzymes reversibly catalyze the oxidation and production of hydrogen in a range close to the thermodynamic potential. The [NiFe] hydrogenase active site contains an iron-cyano-carbonyl moiety linked to a nickel atom which is in an all sulphur environment. Both the active site originality and the potential development of an hydrogen economy make the synthesis of functional and structural models worthy. To take up this challenge, we have synthesised mononuclear ruthenium models and more importantly, nickel-ruthenium complexes, mimicking some structural features of the [NiFe] hydrogenase active site. Ruthenium is indeed isoelectronic to iron and some of its complexes are well-known to bear hydrides. The compounds described in this study have been well characterised and their activity in proton reduction has been successfully tested. Most of them are able to catalyze this reaction though their electrocatalytic potentials remain much more negative compared to which of platinum. The studied parameters point out the importance of the complexes electron richness, especially of the nickel environment. Furthermore, the proton reduction activity is stable for several hours at good rates. The ruthenium environment seems important for this stability. Altogether, these compounds represent the very first catalytically active [NiFe] hydrogenase models. Important additional results of this study are the synergetic behaviour of the two metals in protons reduction and the evidence of a protonation step as the limiting step of the catalytic cycle. We have also shown that a basic site close to ruthenium improves the electrocatalytic potential of the complexes. (author)

  12. From Colloidal Monodisperse Nickel Nanoparticles to Well-Defined Ni/Al2O3Model Catalysts.

    Science.gov (United States)

    Zacharaki, Eirini; Beato, Pablo; Tiruvalam, Ramchandra R; Andersson, Klas J; Fjellvåg, Helmer; Sjåstad, Anja O

    2017-09-26

    In the past few decades, advances in colloidal nanoparticle synthesis have created new possibilities for the preparation of supported model catalysts. However, effective removal of surfactants is a prerequisite to evaluate the catalytic properties of these catalysts in any reaction of interest. Here we report on the colloidal preparation of surfactant-free Ni/Al 2 O 3 model catalysts. Monodisperse Ni nanoparticles (NPs) with mean particle size ranging from 4 to 9 nm were synthesized via thermal decomposition of a zerovalent precursor in the presence of oleic acid. Five weight percent Ni/Al 2 O 3 catalysts were produced by direct deposition of the presynthesized NPs on an alumina support, followed by thermal activation (oxidation-reduction cycle) for complete surfactant removal and surface cleaning. Structural and morphological characteristics of the nanoscale catalysts are described in detail following the propagation of the bulk and surface Ni species at the different treatment stages. Powder X-ray diffraction, electron microscopy, and temperature-programmed reduction experiments as well as infrared spectroscopy of CO adsorption and magnetic measurements were conducted. The applied thermal treatments are proven to be fully adequate for complete surfactant removal while preserving the metal particle size and the size distribution at the level attained by the colloidal synthesis. Compared with standard impregnated Ni/Al 2 O 3 catalysts, the current model materials display narrowed Ni particle size distributions and increased reducibility with a higher fraction of the metallic nickel atoms exposed at the catalyst surface.

  13. Kinetic modelling of the isomerization of N-Hexane using bifunctional Pt-Ni-MOR catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Brito, K.D.; Sousa, B.V.; Rodrigues, M.G.F.; Alves, J.J.N. [Universidade Federal de Campina Grande (UFCG), PB (Brazil). Unidade Academica de Engenharia Quimica], E-mail: jailson@deq.ufcg.edu.br

    2008-01-15

    The objective of the present work is to realize the kinetic modelling regarding deactivation of Pt-Ni catalysts present in mordenite zeolite and monitor the isomerization reaction of n-hexane. The catalysts have been prepared with different metal ratios for comparison in terms of ion exchange and characterization by the XRD technique, in order to correlate the catalytic behavior of the material with its properties. The catalysts were also evaluated during the isomerization reaction of n-hexane. According to the XRD analyses it was observed that the incorporation of the metals Pt and Ni in the structure of the mordenite zeolite did not change the X-Ray diffractograms after the ionic exchange process and calcination of the catalysts. Based on the results of the catalytic investigation, a kinetic model was proposed to deactivate the catalysts. By means of two correlations, the deactivation parameters were determined, allowing establishing the profile of the activity at any time, when the composition of one of the metals is known. According to the results of this work, there might be the possibility that the proposed model of deactivation is a result of coke formation. (author)

  14. Thermal aging modeling and validation on the Mo containing Fe-Cr-Ni alloys

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Ying [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Tan, Lizhen [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Busby, Jeremy T. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

    2015-04-01

    Thermodynamics of intermetallic phases in Fe-rich Fe-Cr-Ni-Mo alloys is critical knowledge to understand thermal aging effect on the phase stability of Mo-containing austenitic steels, which subsequently facilitates alloy design/improvement and degradation mitigation of these materials for reactor applications. Among the intermetallic phases, Chi (χ), Laves, and Sigma (σ) are often of concern because of their tendency to cause embrittlement of the materials. The focus of this study is thermal stability of the Chi and Laves phases as they were less studied compared to the Sigma phase. Coupled with thermodynamic modeling, thermal stability of intermetallic phases in Mo containing Fe-Cr-Ni alloys was investigated at 1000, 850 and 700 C for different annealing times. The morphologies, compositions and crystal structures of the precipitates of the intermetallic phases were carefully examined by scanning electron microscopy, electron probe microanalysis, X-ray diffraction, and transmission electron microscopy. Three key findings resulted from this study. First, the Chi phase is stable at high temperature, and with decreasing temperature it transforms into the Laves phase that is stable at low temperature. Secondly, Cr, Mo, Ni are soluble in both the Chi and Laves phases, with the solubility of Mo playing a major role in the relative stability of the intermetallic phases. Thirdly, in situ transformation from Chi phase to Laves phase was directly observed, which increased the local strain field, generated dislocations in the intermetallic phases, and altered the precipitate phase orientation relationship with the austenitic matrix. The thermodynamic models that were developed and validated were then applied to evaluating the effect of Mo on the thermal stability of intermetallic phases in type 316 and NF709 stainless steels.

  15. Directly observing catalytic intermediates of methane dry reforming (MDR) on model Ni(111) catalyst via in operando surface techniques

    Science.gov (United States)

    Yuan, Kaidi

    In this work, near ambient pressure x-ray photoelectron spectroscopy was used to trace the in operando catalytic intermediates of methane dry reforming on model Ni(111) catalyst. The following reactive carbon intermediates have been characterized from dissociation of CH4: *CH, *C1 (Ni3C), *Cn (n≥2) and clock-reconstructed Ni2C. They can develop into inert graphene, and the conditions for this transition have been explored. One the other hand, the oxygen intermediates from CO2 dissociation were also studied, which play an important role on restraining graphene growth. Their dynamic coverage decreases with increasing temperature, which is suggested the fundamental mechanism of regional carbon overspill and causes irreversible graphene formation. Therefore, solutions based on Ni-O stabilization were proposed in developing coking resisting catalysts.

  16. Dendritic solidification in undercooled Ni-Zr-Al melts: Experiments and modeling

    Energy Technology Data Exchange (ETDEWEB)

    Galenko, P.K., E-mail: Peter.Galenko@dlr.de [Institut fuer Materialsphysik im Weltraum, Deutsches Zentrum fuer Luft- und Raumfahrt (DLR), D-51170 Koeln (Germany); Reutzel, S.; Herlach, D.M. [Institut fuer Materialsphysik im Weltraum, Deutsches Zentrum fuer Luft- und Raumfahrt (DLR), D-51170 Koeln (Germany); Fries, S.G. [ICAMS, Ruhr-Universitaet Bochum, Stiepeler Strasse 129, D-44780 Bochum (Germany)] [SGF Scientific Consultancy, Arndtstr 9, D-52064 Aachen (Germany); Steinbach, I. [ICAMS, Ruhr-Universitaet Bochum, Stiepeler Strasse 129, D-44780 Bochum (Germany); Apel, M. [ACCESS eV, Intzestrasse 5, D-52072 Aachen (Germany)

    2009-12-15

    The kinetics of dendritic solidification in a ternary Ni{sub 98}Zr{sub 1}Al{sub 1} alloy is investigated experimentally in a range of melt undercoolings 40K{<=}{Delta}T{<=}320K. The growth velocity is measured for samples processed by the electromagnetic levitation technique using a high-speed video camera. With {Delta}T{<=}220K the measured growth rates are the same as those of a binary Ni{sub 99}Zr{sub 1} alloy. In the regime of rapid solidification, especially within the regime of thermal dendritic growth at {Delta}T{>=}220K, growth rates are decreased. Sharp-interface modeling predicts growth rates over the whole range of undercooling. Phase-field simulations give quantitative predictions for the dendritic growth velocity in the solute-controlled growth regime. Results show that the composition and temperature dependency of the thermodynamic data, e.g. liquidus slope and solute partition coefficient, are important for describing the alloys. Our findings give improved sharp-interface model predictions compared to calculations based on an approximation of the thermodynamic data derived from binary phase diagrams.

  17. Grain boundary segregation in FeCrNi model alloys; Korngrenzensegregation in FeCrNi-Modellegierungen

    Energy Technology Data Exchange (ETDEWEB)

    Schlueter, B.; Schneider, F.; Mummert, K. [Institut fuer Festkoerper- und Werkstofforschung Dresden e.V. (Germany); Muraleedharan, P. [Indira Gandhi Centre for Atomic Research, Kalpakkam (India). Div. of Metallurgy

    1998-12-31

    P and S segregate at the grain boundaries and thus increase susceptibility to intergranular corrosion at those sites. This could be proven by means of nitric acid-chromate tests and potentiostatic etching tests. There is a direct connection between loss in mass, mean depth of intergranular corrosion attacks, dissolution current density, and level of segregation-induced concentration of P and S at the grain boundaries. The segregation effect at these sites was found to be most evident in specimens of the examined Fe-Cr-Ni steel which had been heat-treated for 1000 hours at 550 C. However, segregation occurs also in materials that received a heat treatment of 400 C/5000 hours, while intergranular corrosion is observed only after heat treatment of 500 C/1000 hours. Apart from segregation of P, formation of Cr-rich phosphides is observed, which leads to depletion of Cr at the precipitates. (orig./CB) [Deutsch] P und S segregieren an die KG und erhoehen dort die IK-Anfaelligkeit. Dies konnte mit Hilfe von Salpetersaeure-Chromat- und Potentiostatischem Aetztest nachgewiesen werden. Es besteht ein direkter Zusammenhang zwischen Masseverlust, mittlerer IK-Angriffstiefe, Aufloesungsstromdichte und Hoehe der segregationsbedingten Anreicherungen von P und S an den KG. Der KG-Segregationseffekt am untersuchten Fe-Cr-Ni-Stahl ist im Waermebehandlungszustand 550 C/1000 h am deutlichsten ausgepraegt. Aber auch bereits bei 400 C/5000 h findet Segregation statt. IKSpRK tritt nur im Waermebehandlungszustand 550 C/1000 h auf. Neben der P-Segregation wird die Bildung Cr-reicher Phosphide beobachtet, die zur Abreicherung von Cr an den Ausscheidungen fuehrt. (orig.)

  18. Computational design of model Re/Ru bearing Ni-base superalloys

    Directory of Open Access Journals (Sweden)

    Vamsi K.V.

    2014-01-01

    Full Text Available It is well established that Re and Ru additions to Ni-base superalloys result in improved creep performance and phase stability. However, the role of Re and Ru and their synergetic effects are not well understood, and the first step in understanding these effects is to design alloys with controlled microstructural parameters. A computational approach was undertaken in the present work for designing model alloys with varying levels of Re and Ru. Thermodynamic and first principles calculations were employed complimentarily to design a set of alloys with varying Re and Ru levels, but which were constrained by constant microstructural parameters, i.e., phase fractions and lattice misfit across the alloys. Three ternary/quaternary alloys of type Ni-Al-xRe-yRu were thus designed. These compositions were subsequently cast, homogenized and aged. Experimental results suggest that while the measured volume fraction matches the predicted value in the Ru containing alloy, volume fraction is significantly higher than the designed value in the Re containing alloys. This is possibly due to errors in the thermodynamic database used to predict phase fraction and composition. These errors are also reflected in the mismatch between predicted and measured values of misfit.

  19. Trophic modeling of the Northern Humboldt Current Ecosystem, Part I: Comparing trophic linkages under La Niña and El Niño conditions

    Science.gov (United States)

    Tam, Jorge; Taylor, Marc H.; Blaskovic, Verónica; Espinoza, Pepe; Michael Ballón, R.; Díaz, Erich; Wosnitza-Mendo, Claudia; Argüelles, Juan; Purca, Sara; Ayón, Patricia; Quipuzcoa, Luis; Gutiérrez, Dimitri; Goya, Elisa; Ochoa, Noemí; Wolff, Matthias

    2008-10-01

    The El Niño of 1997-98 was one of the strongest warming events of the past century; among many other effects, it impacted phytoplankton along the Peruvian coast by changing species composition and reducing biomass. While responses of the main fish resources to this natural perturbation are relatively well known, understanding the ecosystem response as a whole requires an ecotrophic multispecies approach. In this work, we construct trophic models of the Northern Humboldt Current Ecosystem (NHCE) and compare the La Niña (LN) years in 1995-96 with the El Niño (EN) years in 1997-98. The model area extends from 4°S-16°S and to 60 nm from the coast. The model consists of 32 functional groups of organisms and differs from previous trophic models of the Peruvian system through: (i) division of plankton into size classes to account for EN-associated changes and feeding preferences of small pelagic fish, (ii) increased division of demersal groups and separation of life history stages of hake, (iii) inclusion of mesopelagic fish, and (iv) incorporation of the jumbo squid ( Dosidicus gigas), which became abundant following EN. Results show that EN reduced the size and organization of energy flows of the NHCE, but the overall functioning (proportion of energy flows used for respiration, consumption by predators, detritus and export) of the ecosystem was maintained. The reduction of diatom biomass during EN forced omnivorous planktivorous fish to switch to a more zooplankton-dominated diet, raising their trophic level. Consequently, in the EN model the trophic level increased for several predatory groups (mackerel, other large pelagics, sea birds, pinnipeds) and for fishery catch. A high modeled biomass of macrozooplankton was needed to balance the consumption by planktivores, especially during EN condition when observed diatoms biomass diminished dramatically. Despite overall lower planktivorous fish catches, the higher primary production required-to-catch ratio implied a

  20. Multi-Scale Computational Modeling of Ni-Base Superalloy Brazed Joints for Gas Turbine Applications

    Science.gov (United States)

    Riggs, Bryan

    Brazed joints are commonly used in the manufacture and repair of aerospace components including high temperature gas turbine components made of Ni-base superalloys. For such critical applications, it is becoming increasingly important to account for the mechanical strength and reliability of the brazed joint. However, material properties of brazed joints are not readily available and methods for evaluating joint strength such as those listed in AWS C3.2 have inherent challenges compared with testing bulk materials. In addition, joint strength can be strongly influenced by the degree of interaction between the filler metal (FM) and the base metal (BM), the joint design, and presence of flaws or defects. As a result, there is interest in the development of a multi-scale computational model to predict the overall mechanical behavior and fitness-for-service of brazed joints. Therefore, the aim of this investigation was to generate data and methodology to support such a model for Ni-base superalloy brazed joints with conventional Ni-Cr-B based FMs. Based on a review of the technical literature a multi-scale modeling approach was proposed to predict the overall performance of brazed joints by relating mechanical properties to the brazed joint microstructure. This approach incorporates metallurgical characterization, thermodynamic/kinetic simulations, mechanical testing, fracture mechanics and finite element analysis (FEA) modeling to estimate joint properties based on the initial BM/FM composition and brazing process parameters. Experimental work was carried out in each of these areas to validate the multi-scale approach and develop improved techniques for quantifying brazed joint properties. Two Ni-base superalloys often used in gas turbine applications, Inconel 718 and CMSX-4, were selected for study and vacuum furnace brazed using two common FMs, BNi-2 and BNi-9. Metallurgical characterization of these brazed joints showed two primary microstructural regions; a soft

  1. Microwave-assisted combustion synthesis of NiAl intermetallics in a single mode applicator: Modeling and optimisation

    International Nuclear Information System (INIS)

    Poli, G.; Sola, R.; Veronesi, P.

    2006-01-01

    The microwave-assisted combustion synthesis of NiAl intermetallics in a single mode applicator has been simulated numerically and performed with the aim of achieving the highest yields, energy efficiency and process reproducibility. The electromagnetic field modeling of the microwave system allowed to chose the proper experimental set-up and the materials more suitable for the application, minimising the reflected power and the risks of arcing. In all the experimental conditions tested, conversions of 3-5 g 1:1 atomic ratio Ni and Al powder compacts into NiAl ranged from 98.7% to 100%, requiring from 30 to 180 s with power from 500 to 1500 W. The optimisation procedure allowed to determine and quantify the effects of the main process variables on the ignition time, the NiAl yields and the specific energy consumption, leading to a fast, reproducible and cost-effective process of microwave-assisted combustion synthesis of NiAl intermetallics

  2. In situ hydrogenation of model compounds and raw bio-oil over Raney Ni catalyst

    International Nuclear Information System (INIS)

    Xu, Ying; Long, Jinxing; Liu, Qiying; Li, Yanbin; Wang, Chenguang; Zhang, Qi; Lv, Wei; Zhang, Xinghua; Qiu, Songbai; Wang, Tiejun; Ma, Longlong

    2015-01-01

    Graphical abstract: Over Raney Ni catalyst, the aqueous phase reforming (APR) of methanol could couple with the hydrogenation of the model compounds of bio-oil and the raw bio-oil. The hydrogen product from the APR of methanol could offer hydrogen source for the upgrading of the raw bio-oil. The main products of acetone and phenol were isopropanol and cyclohexanol. At 220 °C and 3 MPa, the conversion of acetone and phenol reached the highest point with 55.76% and 64.65% and the bio-oil was improved not only on the appearance but also on the composition significantly. The contents of ketone/aldehyde and organic acids decreased from 30.36% and 39.89% to 9.32% and 30.25% respectively. The contents of alcohols and esters increased from 8.89% and 4.9% to 16.33% and 20.53%. During the in situ hydrogenation process, hydrogenation and esterification were the main reactions in the bio-oil. - Highlights: • We proposed a novel hydrogenation method in mild condition without adding external hydrogen. • The methanol APR and hydrogenation of model compounds and the raw bio-oil could couple with each other. • The hydrogen generated in situ by the APR of methanol could be used for the hydrogenation of the raw bio oil. • After in situ hydrogenation, the appearance and composition of the bio oil was improved significantly. - Abstract: The conversion of renewable energy is one of the most important research fields. A novel upgrading method of bio-oil produced from fast pyrolysis of biomass was reported in the paper. Methanol, as hydrogenation liquid donor, was used in the hydrogenation process instead of hydrogen gas. The effects on the aqueous phase reforming (APR) of methanol and the in situ hydrogenation of model compounds (acetone and phenol) and bio-oil were investigated. The results showed that over Raney Ni catalyst, the in situ hydrogenation could couple with the APR of methanol. The conversions of acetone and phenol reached the highest point with 55.76% and 64

  3. Two-spring model for active compression textiles with integrated NiTi coil actuators

    Science.gov (United States)

    Holschuh, B.; Newman, D.

    2015-03-01

    This paper describes the development and implementation of a two-spring model to predict the performance of hybrid compression textiles combining passive elastic fabrics and integrated NiTi shape memory alloy (SMA) coil actuators. An analytic model that treats passive fabric-SMA coil systems as conjoined linear springs is presented to predict garment passive and active counter-pressure as a function of 11 design variables. For a fixed SMA coil design (encompassing five design variables), the model predicts that passive fabric material modulus, initial length, width and thickness determine both passive counter-pressure magnitude and activation stroke length, and that passive and active pressures are highly dependent on the relative unstretched lengths of the conjoined SMA-fabric system compared to the total limb circumference. Several passive fabrics were tested to determine their moduli and to generally assess the fabric linearity model assumption: two fabrics (spandex and neoprene) were found to behave linearly up to 200% strain, while two other fabrics (flat polyester elastic and a tri-laminate Lycra) were found to be nonlinear in the same strain envelope. Five hypothetical compression tourniquet designs are presented using experimentally determined fabric characteristics and previously studied SMA actuators developed at MIT. The performance of each tourniquet design is discussed with a specific focus on mechanical counter-pressure (MCP) space suit design requirements, with designs presented that achieve the full MCP design specification (\\gt 29.6 kPa) while minimizing (\\lt 5 mm) garment thickness. The modeling framework developed in this effort enables compression garment designers to tailor counter-pressure and activation stroke properties of active compression garments based on a variety of design parameters to meet a wide range of performance specifications.

  4. A microscopic model for gas diffusion dynamics in a [NiFe]-hydrogenase.

    Science.gov (United States)

    Wang, Po-hung; Best, Robert B; Blumberger, Jochen

    2011-05-07

    We describe and apply a microscopic model for the calculation of gas diffusion rates in a [NiFe]-hydrogenase. This enzyme has attracted much interest for use as a H(2) oxidising catalyst in biofuel cells, but a major problem is their inhibition by CO and O(2). In our model, the diffusive hopping of gas molecules in the protein interior is coarse grained using a master equation approach with transition rates estimated from equilibrium and non-equilibrium pulling simulations. Propagating the rate matrix in time, we find that the probability for a gas molecule to reach the enzyme active site follows a mono-exponential increase. Fits to a phenomenological rate law give an effective diffusion rate constant for CO that is in very good agreement with experimental measurements. We find that CO prefers to move along the canonical 'hydrophobic' main channel towards the active site, in contrast to O(2) and H(2), which were previously shown to explore larger fractions of the protein. Differences in the diffusion of the three gases are discussed in light of recent efforts to engineer a gas selectivity filter in the enzyme. This journal is © the Owner Societies 2011

  5. Modeling of half-Heusler compound NiMnSb within tight-binding approximation

    Science.gov (United States)

    Sugiyanto, Majidi, M. A.; Nanto, D.

    2017-07-01

    Heusler compounds are families of magnetic materials with general stoichiometry of either X2YZ (full-Heusler compound) or XYZ (half-Heusler compound), with X and Y being transition metal elements, and Z a main-group element. Their various potentials for technology development make them be still relevant as a subject of both experimental and theoretical studies. Half-Heusler compounds are generally crystallized in the C1b-type structure. The magnetic moments of such materials may be predicted using Slater-Pauling rule, giving m = (Nvalence electrons - 18)µB per formula unit. However, this simple counting rule does not always work for all compounds in this group. This motivates us to perform a theoretical study to investigate the mechanism of magnetic moment formation microscopically. As a case study, we focus on NiMnSb, a particular half-Heusler compound, for which comparison between existing experimental results and theoretical predictions of its magnetic moment has not yet been quite convincing. We model the system by constructing a tight-binding-based Hamiltonian, incorporating Hubbard repulsive as well as spin-spin interactions for the electrons occupying the d-orbitals. We solve the model using Green's function approach, and treat the interaction terms within the mean-field approximation. At this stage, we aim to formulate the computational algorithm for the overall calculation process. Our final goal is to compute the total magnetic moment per unit cell of this system and compare it with available experimental data.

  6. An analytical mechanical model to describe the response of NiTi rotary endodontic files in a curved root canal

    Energy Technology Data Exchange (ETDEWEB)

    Leroy, Agnes Marie Francoise [Department of Metallurgical and Materials Engineering, School of Engineering, Universidade Federal de Minas Gerais (UFMG), Belo Horizonte, MG (Brazil); Department of Mechanical and Materials Engineering, Ecole des Ponts Paristech (ENPC), Champs-sur-Marne (France); Bahia, Maria Guiomar de Azevedo [Department of Restorative Dentistry, Faculty of Dentistry, Universidade Federal de Minas Gerais (UFMG), Belo Horizonte, MG (Brazil); Ehrlacher, Alain [Department of Mechanical and Materials Engineering, Ecole des Ponts Paristech (ENPC), Champs-sur-Marne (France); Buono, Vicente Tadeu Lopes, E-mail: vbuono@demet.ufmg.br [Department of Metallurgical and Materials Engineering, School of Engineering, Universidade Federal de Minas Gerais (UFMG), Belo Horizonte, MG (Brazil)

    2012-08-01

    Aim: To build a mathematical model describing the mechanical behavior of NiTi rotary files while they are rotating in a root canal. Methodology: The file was seen as a beam undergoing large transformations. The instrument was assumed to be rotating steadily in the root canal, and the geometry of the canal was considered as a known parameter of the problem. The formulae of large transformations mechanics then allowed the calculation of the Green-Lagrange strain field in the file. The non-linear mechanical behavior of NiTi was modeled as a continuous piecewise linear function, assuming that the material did not reach plastic deformation. Criteria locating the changes of behavior of NiTi were established and the tension field in the file, and the external efforts applied on it were calculated. The unknown variable of torsion was deduced from the equilibrium equation system using a Coulomb contact law which solved the problem on a cycle of rotation. Results: In order to verify that the model described well reality, three-point bending experiments were managed on superelastic NiTi wires, whose results were compared to the theoretical ones. It appeared that the model gave a good mentoring of the empirical results in the range of bending angles that interested us. Conclusions: Knowing the geometry of the root canal, one is now able to write the equations of the strain and stress fields in the endodontic instrument, and to quantify the impact of each macroscopic parameter of the problem on its response. This should be useful to predict failure of the files under rotating bending fatigue, and to optimize the geometry of the files. - Highlights: Black-Right-Pointing-Pointer A mechanical model of the behavior of a NiTi endodontic instrument was developed. Black-Right-Pointing-Pointer The model was validated with results of three-point bending tests on NiTi wires. Black-Right-Pointing-Pointer The model is appropriate for the optimization of instruments' geometry.

  7. Ab initio and Atomic kinetic Monte Carlo modelling of segregation in concentrated FeCrNi alloys

    Science.gov (United States)

    Piochaud, J. B.; Becquart, C. S.; Domain, C.

    2014-06-01

    Internal structure of pressurised water reactors are made of austenitic materials. Under irradiation, the microstructure of these concentrated alloys evolves and solute segregation on grain boundaries or irradiation defects such as dislocation loops are observed to take place. In order to model and predict the microstructure evolution, a multiscale modelling approach needs to be developed, which starts at the atomic scale. Atomic Kinetic Monte Carlo (AKMC) modelling is the method we chose to provide an insight on defect mediated diffusion under irradiation. In that approach, we model the concentrated commercial steel as a FeCrNi alloy (γ-Fe70Cr20Ni10). As no reliable empirical potential exists at the moment to reproduce faithfully the phase diagram and the interactions of the elements and point defects, we have adjusted a pair interaction model on large amount of DFT calculations. The point defect properties in the Fe70Cr20Ni10, and more precisely, how their formation energy depends on the local environment will be presented and some AKMC results on thermal non equilibrium segregation and radiation induce segregation will be presented. The effect of Si on the segregation will also be discussed.

  8. Ab initio and atomic kinetic Monte Carlo modelling of segregation in concentrated FeCrNi alloys

    International Nuclear Information System (INIS)

    Piochaud, J.B.; Becquart, C.S.; Domain, C.

    2013-01-01

    Internal structure of pressurised water reactors are made of austenitic materials. Under irradiation, the microstructure of these concentrated alloys evolves and solute segregation on grain boundaries or irradiation defects such as dislocation loops are observed to take place. In order to model and predict the microstructure evolution, a multi-scale modelling approach needs to be developed, which starts at the atomic scale. Atomic Kinetic Monte Carlo (AKMC) modelling is the method we chose to provide an insight on defect mediated diffusion under irradiation. In that approach, we model the concentrated commercial steel as a FeCrNi alloy (γ-Fe 70 Cr 20 Ni 10 ). As no reliable empirical potential exists at the moment to reproduce faithfully the phase diagram and the interactions of the elements and point defects, we have adjusted a pair interaction model on large amount of DFT (Density Functional Theory) calculations. The point defect properties in the Fe 70 Cr 20 Ni 10 , and more precisely, how their formation energy depends on the local environment will be presented and some AKMC results on thermal non equilibrium segregation (TNES) and radiation induce segregation will be presented. The effect of Si on the segregation will also be discussed. Preliminary results show that it is the solute- grain boundaries interactions which drive TNES

  9. Catalytic reforming of toluene as tar model compound: effect of Ce and Ce-Mg promoter using Ni/olivine catalyst.

    Science.gov (United States)

    Zhang, Ruiqin; Wang, Huajian; Hou, Xiaoxue

    2014-02-01

    Tar produced by biomass gasification as a route of renewable energy must be removed before the gas can be used. This study was undertaken using toluene as a model tar compound for evaluating its steam reforming conversion with three Ni-based catalysts, Ni/olivine, Ni-Ce/olivine and Ni-Ce-Mg/olivine. Effects of Ce and Mg promoters on the reaction activity and coke deposition were studied. Overall the performance of Ce and Mg promoted Ni/olivine catalysts is better than that of only Ce promoter and Ni/olivine alone. The experimental results indicate that Ni-Ce-Mg/olivine catalysts could improve the resistance to carbon deposition, enhance energy gases yield and resist 10ppm H2S poison at 100mLmin(-1) for up to 400min. Furthermore, the activity of catalysts was related to the steam/carbon (S/C) ratios; at S/C ratio=5, T=790°C, space velocity=782h(-1) and t=2h, the Ni-Ce-Mg/olivine system yielded 89% toluene conversion, 5.6Lh(-1) product gas rate, 62.6mol% H2 content and 10% (mol useful gas mol(-1) toluene) energy yield. Moreover, at low S/C ratio, it had higher reaction activity and better ability to prevent coking. There is a small amount of carbon deposition in the form of amorphous carbon after 7h. Various characterization techniques such as XRD, FTIR and thermogravimetric were performed to investigate the coke deposition of Ni/olivine, Ni-Ce/olivine and Ni-Ce-Mg/olivine. It is suggested that 3% Ni-1% Ce-1% Mg/olivine was the most promising catalyst due to its minimum coke amount and the lower activation energy of coke burning. Copyright © 2014. Published by Elsevier Ltd.

  10. Stress Relaxation Effects in TiNi SMA During Superelastic Deformation: Experiment and Constitutive Model

    Science.gov (United States)

    Pieczyska, Elżbieta A.; Kowalewski, Zbigniew L.; Dunić, Vladimir Lj.

    2017-12-01

    This paper presents an investigation of thermomechanical effects related to the phenomena of stress relaxation occurring in TiNi SMA subjected to modified program of displacement-controlled tension. The deformation data were taken from testing machine, whereas the temperature changes accompanying the exothermic/endothermic martensite forward/reverse transformation were measured by infrared camera. At the advanced stages of the transformations, the strain was kept constant for a few minutes and the SMA load and temperature were recorded continuously. As a consequence, the stress and temperature changed significantly during the loading stops. A large stress drop, caused by the transformation, was observed during the relaxation stage in both courses of the SMA loading and unloading. Moreover, the non-uniform temperature distribution, reflecting macroscopically inhomogeneous transformation, lapsed while the strain was kept constant, yet restarted at the end of the relaxation stop and developed at the reloading stage. Along with the experimental results, the mechanical and thermal responses induced by the transformation were obtained by 3D coupled thermomechanical numerical analysis, realized in partitioned approach. Latent heat production was correlated with an amount of the martensitic volume fraction. The stress and temperature drops recorded during the experiment were satisfactorily reproduced by the model proposed for the SMA thermomechanical coupling.

  11. Origin of Ni-Cu Sulfide Deposits: Questioning 'High-Flux' Models'

    Science.gov (United States)

    Arndt, N. T.

    2015-12-01

    Magmatic sulfide ore bodies contain large amounts of sulfide with high concentrations of metals such as Ni, Cu and PGE. Their presence in relatively small intrusions commonly is attributed to the segregation and accumulation of sulfide droplets from magmas that flow rapidly through conduits. This 'high-flux' model is at odds with the following observations. Many ores appear to have been emplaced as magmatic breccias (Norilsk-Talnakh, Aguablanca) or crystal mushes (Jinchuan) containing a high proportion of sulfide. Such mixtures are very dense and could not have risen up through the crust from a deeper staging chamber. At Uitkomst and Platreef, screens of sedimentary rock maintaining the same orientation as adjacent sedimentary strata separate layers of ultramafic cumulates, some containing abundant sulfide ore. This geometry suggests that ultramafic mush and ore sulfides oozed into the sedimentary sequence, replacing less resistant strata. A mechanism explaining these observations is as follows: mafic-ultramafic intrusions both large and small do not differentiate in place but grow through the injection of magmas of differing compositions and crystallinity. Highly mafic magmas, particularly those charged with ferromagnesian crystals and sulfide, have high densities and they are injected into the lower parts of growing intrusions while less-dense, more evolved and/or plagioclase-rich magmas are injected at higher levels. Accumulation of sulfides probably occurs higher in the magma conduits and sulfide-rich mushes migrate or slump downwards in the conduit to form the ore bodies.

  12. Atomic scale modelling of Al and Ni(1 1 1) surface erosion under cluster impact

    CERN Document Server

    Zhurkin, E E

    2003-01-01

    We have studied sputtering of Al and Ni(1 1 1) surfaces under impact of Al sub N and Ni sub N clusters (1=13. The pronounced microcraters are formed in the impact region above a threshold cluster size of around N=13. As a sensitivity study, we show that interaction with electronic subsystem of the target has a strong influence on secondary emission, but almost does not affect the features of surface microstructure of irradiated target.

  13. A theoretical model of strong and moderate El Niño regimes

    Science.gov (United States)

    Takahashi, Ken; Karamperidou, Christina; Dewitte, Boris

    2018-02-01

    The existence of two regimes for El Niño (EN) events, moderate and strong, has been previously shown in the GFDL CM2.1 climate model and also suggested in observations. The two regimes have been proposed to originate from the nonlinearity in the Bjerknes feedback, associated with a threshold in sea surface temperature (T_c ) that needs to be exceeded for deep atmospheric convection to occur in the eastern Pacific. However, although the recent 2015-16 EN event provides a new data point consistent with the sparse strong EN regime, it is not enough to statistically reject the null hypothesis of a unimodal distribution based on observations alone. Nevertheless, we consider the possibility suggestive enough to explore it with a simple theoretical model based on the nonlinear Bjerknes feedback. In this study, we implemented this nonlinear mechanism in the recharge-discharge (RD) ENSO model and show that it is sufficient to produce the two EN regimes, i.e. a bimodal distribution in peak surface temperature (T) during EN events. The only modification introduced to the original RD model is that the net damping is suppressed when T exceeds T_c , resulting in a weak nonlinearity in the system. Due to the damping, the model is globally stable and it requires stochastic forcing to maintain the variability. The sustained low-frequency component of the stochastic forcing plays a key role for the onset of strong EN events (i.e. for T>T_c ), at least as important as the precursor positive heat content anomaly (h). High-frequency forcing helps some EN events to exceed T_c , increasing the number of strong events, but the rectification effect is small and the overall number of EN events is little affected by this forcing. Using the Fokker-Planck equation, we show how the bimodal probability distribution of EN events arises from the nonlinear Bjerknes feedback and also propose that the increase in the net feedback with increasing T is a necessary condition for bimodality in the RD

  14. Coulomb excitation $^{74}$Zn-$^{80}$Zn (N=50): probing the validity of shell-model descriptions around $^{78}$Ni

    CERN Multimedia

    A study of the evolution of the nuclear structure along the zinc isotopic chain close to the doubly magic nucleus $^{78}$Ni is proposed to probe recent shell-model calculations in this area of the nuclear chart. Excitation energies and connecting B(E2) values will be measured through multiple Coulomb excitation experiment with laser ionized purified beams of $^{74-80}$Zn from HIE ISOLDE. The current proposal request 30 shifts.

  15. A quantitative mechanistic description of Ni, Zn and Ca sorption on Na-Montmorillonite. Part III: Modelling

    International Nuclear Information System (INIS)

    Baeyens, B.; Bradbury, M.H.

    1995-07-01

    Titration and sorption measurements, carried out under a wide variety of conditions on Na-montmorillonite, were examined in terms of cation exchange and surface complexation mechanisms. A computer code called MINSORB was developed and used throughout this work. This code allowed the uptake of radionuclides by both mechanisms to be calculated simultaneously; also taking into account competitive reactions from other cations present. A stepwise iterative fitting/modelling procedure is described. For the case of Na-montmorillonite it is demonstrated that an electrostatic term in the surface complexation model is not required. A basic data set comprising of site capacities and protonation/deprotonation constants was defined, which was valid for all surface complexation sorption reactions. The main study was carried out with Ni, but impurity cations present in the system, particularly Zn, had to be examined in addition due to their competitive effects on Ni sorption. The surface complexation behaviour of Ni and Zn was investigated in detail to give intrinsic surface complexation constants on two of the ≡SOH type sites included in the model. The sorption of Mg, Ca and Mn is also considered, though in less detail, and estimated surface complexation constants for these nuclides are presented. Cation exchange was included in all of the calculations. Measured selectivity coefficients for Ni-Na, Zn-Na and Ca-Na exchange reactions are given. The model, with the derived parameters, allowed all the data from titration measurements through sorption edges to sorption isotherms to be calculated. (author) 31 figs., 9 tabs., refs

  16. Load partion in NiTi shape memory alloy polycrystals investigated by in-situ neutron diffraction and micromechanics modelling

    Czech Academy of Sciences Publication Activity Database

    Šittner, Petr; Novák, Václav; Lukáš, Petr; Lugovyy, Dmytro; Neov, Dimitar

    404-407, - (2002), s. 829-834 ISSN 0255-5476 R&D Projects: GA AV ČR IAA1048107; GA ČR GV202/97/K038 Institutional research plan: CEZ:AV0Z1010914 Keywords : shape memory alloy * neutron diffraction * martensitic transformation * NiTi * micromechanics modelling * load partition Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 0.613, year: 2002

  17. Nonlocal superelastic model of size-dependent hardening and dissipation in single crystal Cu-Al-Ni shape memory alloys.

    Science.gov (United States)

    Qiao, Lei; Rimoli, Julian J; Chen, Ying; Schuh, Christopher A; Radovitzky, Raul

    2011-02-25

    We propose a nonlocal continuum model to describe the size-dependent superelastic effect observed in recent experiments of single crystal Cu-Al-Ni shape memory alloys. The model introduces two length scales, one in the free energy and one in the dissipation, which account for the size-dependent hardening and dissipation in the loading and unloading response of micro- and nanopillars subject to compression tests. The information provided by the model suggests that the size dependence observed in the dissipation is likely to be associated with a nonuniform evolution of the distribution of the austenitic and martensitic phases during the loading cycle. © 2011 American Physical Society

  18. Modeling, Simulation, Additive Manufacturing, and Experimental Evaluation of Solid and Porous NiTi

    Science.gov (United States)

    Taheri Andani, Mohsen

    In recent years, shape memory alloys (SMAs) have entered a wide range of engineering applications in fields such as aerospace and medical applications. Nickel-titanium (NiTi) is the most commonly used SMAs due to its excellent functional characteristics (shape memory effect and superelasticity behavior). These properties are based on a solid-solid phase transformation between martensite and austenite. Beside these two characteristics, low stiffness, biocompatibility and corrosion properties of NiTi make it an attractive candidate for biomedical applications (e.g., bone plates, bone screws, and vascular stents). It is well know that manufacturing and processing of NiTi is very challenging. The functional properties of NiTi are significantly affected by the impurity level and due to the high titanium content, NiTi are highly reactive. Therefore, high temperature processed parts through methods such as melting and casting which result in increased impurity levels have inadequate structural and functional properties. Furthermore, high ductility and elasticity of NiTi, adhesion, work hardening and spring back effects make machining quite challenging. These unfavorable effects for machining cause significant tool wear along with decreasing the quality of work piece. Recently, additive manufacturing (AM) has gained significant attention for manufacturing NiTi. Since AM can create a part directly from CAD data, it is predicted that AM can overcome most of the manufacturing difficulties. This technique provides the possibility of fabricating highly complex parts, which cannot be processed by any other methods. Curved holes, designed porosity, and lattice like structures are some examples of mentioned complex parts. This work investigates manufacturing superelastic NiTi by selective laser melting (SLM) technique (using PXM by Phenix/3D Systems). An extended experimental study is conducted on the effect of subsequent heat treatments with different aging conditions on phase

  19. Length scale effects and multiscale modeling of thermally induced phase transformation kinetics in NiTi SMA

    Science.gov (United States)

    Frantziskonis, George N.; Gur, Sourav

    2017-06-01

    Thermally induced phase transformation in NiTi shape memory alloys (SMAs) shows strong size and shape, collectively termed length scale effects, at the nano to micrometer scales, and that has important implications for the design and use of devices and structures at such scales. This paper, based on a recently developed multiscale model that utilizes molecular dynamics (MDs) simulations at small scales and MD-verified phase field (PhF) simulations at larger scales, reports results on specific length scale effects, i.e. length scale effects in martensite phase fraction (MPF) evolution, transformation temperatures (martensite and austenite start and finish) and in the thermally cyclic transformation between austenitic and martensitic phase. The multiscale study identifies saturation points for length scale effects and studies, for the first time, the length scale effect on the kinetics (i.e. developed internal strains) in the B19‧ phase during phase transformation. The major part of the work addresses small scale single crystals in specific orientations. However, the multiscale method is used in a unique and novel way to indirectly study length scale and grain size effects on evolution kinetics in polycrystalline NiTi, and to compare the simulation results to experiments. The interplay of the grain size and the length scale effect on the thermally induced MPF evolution is also shown in this present study. Finally, the multiscale coupling results are employed to improve phenomenological material models for NiTi SMA.

  20. First-principles modeling of the Invar effect in Fe65Ni35 by the spin-wave method

    Science.gov (United States)

    Ruban, A. V.

    2017-05-01

    Thermal lattice expansion of the Invar Fe0.65Ni0.35 alloy is investigated in first-principles calculations using the spin-wave method, which is generalized here for the ferromagnetic state with short-range order. It is shown that magnetic short-range order effects make a substantial contribution to the equilibrium lattice constant and cannot be neglected in the accurate ab initio modeling of the thermal expansion in Fe-Ni alloys. We also demonstrate that at high temperatures, close to and above the magnetic transition, magnetic entropy associated with transverse and longitudinal spin fluctuations yields a noticeable contribution to the equilibrium lattice constant. The obtained theoretical results for the temperature dependent lattice constant are in semiquantitative agreement with the experimental data apart from the region close the magnetic transition.

  1. Improved properties of the catalytic model system Ni/Ru(0001)

    DEFF Research Database (Denmark)

    Egeberg, Rasmus; Chorkendorff, Ib

    2001-01-01

    ) illustrating the unique properties of metal-on-metal systems. The effect of enhanced reactivity is primarily ascribed to electronic effects induced by a straining of the Ni overlayer. The enhanced reactivity towards CH4 is accompanied by new features in the thermal desorption spectra of CO. The reactivity...... of the, system depends strongly on the annealing temperature. Molecular beam experiments at high translational energy are qualitatively different from thermal data showing a monotonic decrease of the CH4 sticking probability as Ni is added....

  2. Three dimensional wavefield modeling using the pseudospectral method; Pseudospectral ho ni yoru sanjigen hadoba modeling

    Energy Technology Data Exchange (ETDEWEB)

    Sato, T.; Matsuoka, T. [Japan Petroleum Exploration Corp., Tokyo (Japan); Saeki, T. [Japan National Oil Corp., Tokyo (Japan). Technology Research Center

    1997-05-27

    Discussed in this report is a wavefield simulation in the 3-dimensional seismic survey. With the level of the object of exploration growing deeper and the object more complicated in structure, the survey method is now turning 3-dimensional. There are several modelling methods for numerical calculation of 3-dimensional wavefields, such as the difference method, pseudospectral method, and the like, all of which demand an exorbitantly large memory and long calculation time, and are costly. Such methods have of late become feasible, however, thanks to the advent of the parallel computer. As compared with the difference method, the pseudospectral method requires a smaller computer memory and shorter computation time, and is more flexible in accepting models. It outputs the result in fullwave just like the difference method, and does not cause wavefield numerical variance. As the computation platform, the parallel computer nCUBE-2S is used. The object domain is divided into the number of the processors, and each of the processors takes care only of its share so that parallel computation as a whole may realize a very high-speed computation. By the use of the pseudospectral method, a 3-dimensional simulation is completed within a tolerable computation time length. 7 refs., 3 figs., 1 tab.

  3. Predicting the uptake of Cs, Co, Ni, Eu, Th and U on argillaceous rocks using sorption models for illite

    International Nuclear Information System (INIS)

    Marques Fernandes, Maria; Vér, Nóra; Baeyens, Bart

    2015-01-01

    Highlights: • Contaminant retention in argillaceous rocks controlled by sorption on clay minerals. • Cs, Ni, Co, Eu, Th and UO 2 sorption isotherm measurements on Boda and Opalinus Clay. • Boda and Opalinus Clay exhibit different mineralogies and porewater compositions. • Blind predictions using quasi-mechanistic sorption models developed for illite. • Good agreement between measurements and blind predictions. - Abstract: Reliable predictions of radiocontaminant migration are a requirement for the establishment of radioactive waste repositories. Parametrization of the necessary sorption models seems to be, however, extremely challenging given the multi-mineralic composition of the lithosphere. In this study it is shown for two argillaceous rocks – Boda and Opalinus Clay relevant for the Hungarian and Swiss repository concepts, respectively – that this task can be substantially simplified by taking into account only the most sorptive mineral fraction, namely the 2:1 clay minerals illite and illite/smectite mixed layers. Two different models were required to blind predict the sorption isotherms of Cs, Co, Ni, Eu, Th and UO 2 measured on the two clay rock samples in a synthetic porewater. Cs sorption was modelled with the generalised Cs (GCs) sorption model and the sorption of the other cations with the 2site protolysis non electrostatic surface complexation and cation exchange (2SPNE SC/CE) model. The 2SPNE SC/CE model for illite was extended with surface complexation reactions on weak sites for Co, Ni, Eu, UO 2 and on strong sites for Eu-carbonato complexes. Complementary to the sorption measurements and modelling, extended X-ray absorption fine structure (EXAFS) spectroscopy was used to probe the retention mechanism of Ni on illite, Boda and Opalinus Clay at higher loadings. The reliable blind predictions of the selected metal cations, which are representative for monovalent alkaline metals, divalent transition metals, lanthanides, and trivalent

  4. Nanostructure evolution under irradiation in FeMnNi alloys: A "grey alloy" object kinetic Monte Carlo model

    Science.gov (United States)

    Chiapetto, M.; Malerba, L.; Becquart, C. S.

    2015-07-01

    This work extends the object kinetic Monte Carlo model for neutron irradiation-induced nanostructure evolution in Fe-C binary alloys developed in [1], introducing the effects of substitutional solutes like Mn and Ni. The objective is to develop a model able to describe the nanostructural evolution of both vacancy and self-interstitial atom (SIA) defect cluster populations in Fe(C)MnNi neutron-irradiated model alloys at the operational temperature of light water reactors (∼300 °C), by simulating specific reference irradiation experiments. To do this, the effects of the substitutional solutes of interest are introduced, under simplifying assumptions, using a "grey alloy" scheme. Mn and Ni solute atoms are not explicitly introduced in the model, which therefore cannot describe their redistribution under irradiation, but their effect is introduced by modifying the parameters that govern the mobility of both SIA and vacancy clusters. In particular, the reduction of the mobility of point-defect clusters as a consequence of the presence of solutes proved to be key to explain the experimentally observed disappearance of detectable defect clusters with increasing solute content. Solute concentration is explicitly taken into account in the model as a variable determining the slowing down of self-interstitial clusters; small vacancy clusters, on the other hand, are assumed to be significantly slowed down by the presence of solutes, while for clusters bigger than 10 vacancies their complete immobility is postulated. The model, which is fully based on physical considerations and only uses a few parameters for calibration, is found to be capable of reproducing the experimental trends in terms of density and size distribution of the irradiation-induced defect populations with dose, as compared to the reference experiment, thereby providing insight into the physical mechanisms that influence the nanostructural evolution undergone by this material during irradiation.

  5. Ab initio study of the compound-energy modeling of multisublattice structures: The (hP6) Ni{sub 2}In-type intermetallics of the Ni–In–Sn system

    Energy Technology Data Exchange (ETDEWEB)

    Ramos de Debiaggi, S., E-mail: susana.ramos@fain.uncoma.edu.ar [Facultad de Ingeniería, Universidad Nacional del Comahue, Buenos Aires 1400, 8300 Neuquén (Argentina); Instituto de Investigación y Desarrollo en Ingeniería de Procesos, Biotecnología y Energías Alternativas – CONICET-UNCo (Argentina); González Lemus, N.V. [Facultad de Ingeniería, Universidad Nacional del Comahue, Buenos Aires 1400, 8300 Neuquén (Argentina); Deluque Toro, C. [Grupo de Nuevos Materiales, Universidad de la Guajira, Riohacha (Colombia); Fernández Guillermet, A. [CONICET - Instituto Balseiro, Centro Atómico Bariloche, Avda. Bustillo 9500, 8400 Bariloche (Argentina)

    2015-01-15

    Highlights: • A DFT study of the compounds involved in CALPHAD modeling of the Ni–In–Sn (hP6) phase. • Several three-sublattice compounds of Ni, In, Sn and vacancies are studied ab initio. • Structural, cohesive and thermodynamic properties and the electronic DOS are reported. • Trends in calculated properties are correlated with changes in electronic structure. • A picture of the chemical bonding trends for these s-p/d type compounds is discussed. - Abstract: The thermodynamic modeling of non-stoichiometric, multisublattice intermetallic phases using the Compound-Energy Formalism (CEF) involves the determination of parameters representing the Gibbs energy (G{sub m}) of binary compounds, the so-called “end-member compounds” (EMCs), which are often metastable or hypothetical. In current CALPHAD (i.e., “Calculation of Phase Diagrams”) work, these quantities are treated as free parameters to be determined by searching for the best fit to the available information in the optimization procedure. The general purpose of this paper is to propose a theoretical approach to the study of the EMCs which makes use of density-functional-theory (DFT) ab initio calculations. The present method is applied to the EMCs involved in the CEF modeling of the non-stoichiometric (hP6) Ni{sub 2}In-structure type phase of the Ni–In and Ni–In–Sn systems using the three-sublattice models (Ni){sub 1}(Ni,Va){sub 1}(In,Ni){sub 1} and (Ni,Va){sub 1}(Ni,Va){sub 1}(In,Ni,Sn){sub 1}, respectively. By means of systematic ab initio projected augmented waves (PAW) calculations using the VASP code we study the EMCs involved in the CEF formulations of the G{sub m} for this phase in the binary and the ternary systems. Specifically, we study the twelve EMCs corresponding to the following sublattice occupations: (Ni){sub 1}(Ni){sub 1}(In){sub 1}, which is usually described as Ni:Ni:In (i.e., a compound with formula “Ni{sub 2}In”), Ni:Ni:Ni (i.e., “Ni{sub 3}”), Ni:Ni:Sn (“Ni

  6. Phase-field modeling of coring during solidification of Au–Ni alloy using quaternions and CALPHAD input

    International Nuclear Information System (INIS)

    Fattebert, J.-L.; Wickett, M.E.; Turchi, P.E.A.

    2014-01-01

    A numerical method for the simulation of microstructure evolution during the solidification of an alloy is presented. The approach is based on a phase-field model including a phase variable, an orientation variable given by a quaternion, the alloy composition and a uniform temperature field. Energies and diffusion coefficients used in the model rely on thermodynamic and kinetic databases in the framework of the CALPHAD methodology. The numerical approach is based on a finite volume discretization and an implicit time-stepping algorithm. Numerical results for solidification and accompanying coring effect in a Au–Ni alloy are used to illustrate the methodology

  7. Creep behaviour and microstructure changes of model cast Ni-Cr-W-C alloys

    Czech Academy of Sciences Publication Activity Database

    Kvapilová, Marie; Kuchařová, Květa; Sklenička, Václav; Svoboda, Milan; Hrbáček, K.

    2011-01-01

    Roč. 10, - (2011), s. 839-844 E-ISSN 1877-7058. [ICM11 -International Conference on The Mechanical Behavior of Materials /11./. Lake Como, 05.06.2011-09.06.2011] Institutional research plan: CEZ:AV0Z20410507 Keywords : cast Ni based superalloy * creep properties * phase stability Subject RIV: JG - Metallurgy

  8. Predictability of two types of El Niño and their climate impacts in boreal spring to summer in coupled models

    Science.gov (United States)

    Lee, Ray Wai-Ki; Tam, Chi-Yung; Sohn, Soo-Jin; Ahn, Joong-Bae

    2017-12-01

    The predictability of the two El Niño types and their different impacts on the East Asian climate from boreal spring to summer have been studied, based on coupled general circulation models (CGCM) simulations from the APEC Climate Center (APCC) multi-model ensemble (MME) hindcast experiments. It was found that both the spatial pattern and temporal persistence of canonical (eastern Pacific type) El Niño sea surface temperature (SST) are much better simulated than those for El Niño Modoki (central Pacific type). In particular, most models tend to have El Niño Modoki events that decay too quickly, in comparison to those observed. The ability of these models in distinguishing between the two types of ENSO has also been assessed. Based on the MME average, the two ENSO types become less and less differentiated in the model environment as the forecast leadtime increases. Regarding the climate impact of ENSO, in spring during canonical El Niño, coupled models can reasonably capture the anomalous low-level anticyclone over the western north Pacific (WNP)/Philippine Sea area, as well as rainfall over coastal East Asia. However, most models have difficulties in predicting the springtime dry signal over Indochina to South China Sea (SCS) when El Niño Modoki occurs. This is related to the location of the simulated anomalous anticyclone in this region, which is displaced eastward over SCS relative to the observed. In boreal summer, coupled models still exhibit some skills in predicting the East Asian rainfall during canonical El Nino, but not for El Niño Modoki. Overall, models' performance in spring to summer precipitation forecasts is dictated by their ability in capturing the low-level anticyclonic feature over the WNP/SCS area. The latter in turn is likely to be affected by the realism of the time mean monsoon circulation in models.

  9. Nanostructure evolution under irradiation of Fe(C)MnNi model alloys for reactor pressure vessel steels

    Energy Technology Data Exchange (ETDEWEB)

    Chiapetto, M., E-mail: mchiapet@sckcen.be [SCK-CEN, Nuclear Materials Science Institute, Boeretang 200, B-2400 Mol (Belgium); Unité Matériaux Et Transformations (UMET), UMR 8207, Université de Lille 1, ENSCL, F-59600 Villeneuve d’Ascq Cedex (France); Becquart, C.S. [Unité Matériaux Et Transformations (UMET), UMR 8207, Université de Lille 1, ENSCL, F-59600 Villeneuve d’Ascq Cedex (France); Laboratoire commun EDF-CNRS Etude et Modélisation des Microstructures pour le Vieillissement des Matériaux (EM2VM) (France); Domain, C. [EDF R& D, Département Matériaux et Mécanique des Composants, Les Renardières, F-77250 Moret sur Loing (France); Laboratoire commun EDF-CNRS Etude et Modélisation des Microstructures pour le Vieillissement des Matériaux (EM2VM) (France); Malerba, L. [SCK-CEN, Nuclear Materials Science Institute, Boeretang 200, B-2400 Mol (Belgium)

    2015-06-01

    Radiation-induced embrittlement of bainitic steels is one of the most important lifetime limiting factors of existing nuclear light water reactor pressure vessels. The primary mechanism of embrittlement is the obstruction of dislocation motion produced by nanometric defect structures that develop in the bulk of the material due to irradiation. The development of models that describe, based on physical mechanisms, the nanostructural changes in these types of materials due to neutron irradiation are expected to help to better understand which features are mainly responsible for embrittlement. The chemical elements that are thought to influence most the response under irradiation of low-Cu RPV steels, especially at high fluence, are Ni and Mn, hence there is an interest in modelling the nanostructure evolution in irradiated FeMnNi alloys. As a first step in this direction, we developed sets of parameters for object kinetic Monte Carlo (OKMC) simulations that allow this to be done, under simplifying assumptions, using a “grey alloy” approach that extends the already existing OKMC model for neutron irradiated Fe–C binary alloys [1]. Our model proved to be able to describe the trend in the buildup of irradiation defect populations at the operational temperature of LWR (∼300 °C), in terms of both density and size distribution of the defect cluster populations, in FeMnNi model alloys as compared to Fe–C. In particular, the reduction of the mobility of point-defect clusters as a consequence of the presence of solutes proves to be key to explain the experimentally observed disappearance of detectable point-defect clusters with increasing solute content.

  10. Atomistic modeling to investigate the favored composition for metallic glass formation in the Ca-Mg-Ni ternary system.

    Science.gov (United States)

    Zhao, S; Li, J H; An, S M; Li, S N; Liu, B X

    2017-05-17

    A realistic interatomic potential was first constructed for the Ca-Mg-Ni system and then applied to Monte Carlo simulations to predict the favored composition for metallic glass formation in the ternary system. The simulations not only predict a hexagonal composition region, within which the Ca-Mg-Ni metallic glass formation is energetically favored, but also pinpoint an optimized sub-region within which the amorphization driving force, i.e. the energy difference between the solid solution and disordered phase, is larger than that outside. The simulations further reveal that the physical origin of glass formation is the solid solution collapsing when the solute atom exceeds the critical solid solubility. Further structural analysis indicates that the pentagonal bi-pyramids dominate in the optimized sub-region. The large atomic size difference between Ca, Mg and Ni extends the short-range landscape and facilitates the development of a hybridized packing model in the medium-range, and eventually enhancing the glass formation in the system. The predictions are well supported by the experimental observations reported so far, and could be of help for designing the ternary glass formation.

  11. Modeling the effects of temperature and time of homogenization annealing on the hardness of PdNi5 alloy

    Directory of Open Access Journals (Sweden)

    Ivanović Aleksandra T.

    2014-01-01

    Full Text Available Experimental design methodology represents a powerful tool for the analysis and optimization of various processes. PdNi5 alloy is used in the in the production process of nitric acid, as Pd-catalyst-trap. The role of Pd-catalyst-trap consists in reduction of volatile platinum oxide from gas flow to the metal form and retention of platinum metal on the surface of Pd catalyst-trap. Fundamental knowledge about this alloy and its practical use in reduction of volatile platinum oxide, can be improved by experimental planning and statistical analysis. In this study, the effects of annealed temperature and annealed time on the hardness of PdNi5 alloy were evaluated and compared. Full factorial experimental design at three levels was applied. Statistically significant factors were determined considering of hardness of PdNi5 alloy as a system response. By regression analysis, the mathematical model for process description was derived. The correlation between predicted and experimental values was high (R2=0,976 . In the investigated ranges of parameters, the obtained empirical equation can be applied for the prediction of system response. [Projekat Ministarstva nauke Republike Srbije, br TR 34029: Razvoj tehnologije proizvodnje Pd katalizatora-hvatača za smanjenje gubitaka platine u visokotemperaturnim procesima katalize

  12. MECHANISTIC KINETIC MODELS FOR STEAM REFORMING OF CONCENTRATED CRUDE ETHANOL ON NI/AL2O3 CATALYST

    Directory of Open Access Journals (Sweden)

    O. A. OLAFADEHAN

    2015-05-01

    Full Text Available Mechanistic kinetic models were postulated for the catalytic steam reforming of concentrated crude ethanol on a Ni-based commercial catalyst at atmosphere pressure in the temperature range of 673-863 K, and at different catalyst weight to the crude ethanol molar flow rate ratio (in the range 0.9645-9.6451 kg catalyst h/kg mole crude ethanol in a stainless steel packed bed tubular microreactor. The models were based on Langmuir-Hinshelwood-Hougen-Watson (LHHW and Eley-Rideal (ER mechanisms. The optimization routine of Nelder-Mead simplex algorithm was used to estimate the inherent kinetic parameters in the proposed models. The selection of the best kinetic model amongst the rival kinetic models was based on physicochemical, statistical and thermodynamic scrutinies. The rate determining step for the steam reforming of concentrated crude ethanol on Ni/Al2O3 catalyst was found to be surface reaction between chemisorbed CH3O and O when hydrogen and oxygen were adsorbed as monomolecular species on the catalyst surface. Excellent agreement was obtained between the experimental rate of reaction and conversion of crude ethanol, and the simulated results, with ADD% being ±0.46.

  13. Early stages of the decomposition reaction in a Ni-13%Al alloy - polazired small-angle neutron scattering and clusterdynamic modelling; Fruehstadien der Entmischung in einer Ni-13at%Al-Legierung - polarisierte Neutronen-Kleinwinkelstreuung und clusterdynamische Modellierung

    Energy Technology Data Exchange (ETDEWEB)

    Staron, P. [GKSS-Forschungszentrum Geesthacht GmbH (Germany). Inst. fuer Werkstofforschung

    1997-12-31

    In this work the early stages of the decomposition reaction in a supersaturated Ni-13at%Al alloy at temperatures of 450, 500 and 550 C were investigated by means of small and wide-angle scattering of polarized neutrons. To determine the early stage decomposition kinetics requires the size distributions of extremely small precipitate clusters to be measured. By measuring over an appropriate region of scattering vectors and reducing the incoherent background with an isotopically taylored sample, size distributions of clusters with radii as small as 0.4 nm could be determined. A model which describes the formation of ordered precipitates in alloys with a low nucleation energy (like Ni-Al) is required to interpret the measured decomposition kinetics. In the present work a cluster-dynamics model was for the first time used to study the decomposition in Ni-Al alloys. The clusterdynamic modelling of the measured decomposition kinetics, as well as a reinterpretation of the results of former investigations, has shown that the character of the decomposition reaction in supersaturated Ni-Al alloys strongly depends on their initial supersaturation. Classical nucleation only occurs at low initial supersaturations. As the initial supersaturation increases, the classical nucleation reaction turns into a continuous coarsening of an initial size distribution of nucleation-free formed clusters. (orig.) 62 refs.

  14. Assessing the link between Atlantic Niño 1 and drought over West Africa using CORDEX regional climate models

    Science.gov (United States)

    Adeniyi, Mojisola Oluwayemisi; Dilau, Kabiru Alabi

    2018-02-01

    The skill of Coordinated Regional Climate Downscaling Experiment (CORDEX) models (ARPEGE, CCLM, HIRHAM, RACMO, REMO, PRECIS, RegCM3, RCA, WRF and CRCM) in simulating the climate (precipitation, temperature and drought) of West Africa is determined using a process-based metric. This is done by comparing the CORDEX models' simulated and observed correlation coefficients between Atlantic Niño Index 1 (ATLN1) and the climate over West Africa. Strong positive correlation is observed between ATLN1 and the climate parameters at the Guinea Coast (GC). The Atlantic Ocean has Niño behaviours through the ATLN indices which influence the climate of the tropics. Drought has distinct dipole structure of correlation with ATLN1 (negative at the Sahel); precipitation does not have distinct dipole structure of correlation, while temperature has almost a monopole correlation structure with ATLN1 over West Africa. The magnitude of the correlation increases with closeness to the equatorial eastern Atlantic. Correlations between ATLN1 and temperature are mostly stronger than those between ATLN1 and precipitation over the region. Most models have good performance over the GC, but ARPEGE has the highest skill at GC. The PRECIS is the most skilful over Savannah and RCA over Sahel. These models can be used to downscale the projected climate at the region of their highest skill.

  15. Hybrid plasma-catalytic steam reforming of toluene as a biomass tar model compound over Ni/Al₂O₃ catalysts

    OpenAIRE

    Liu, SY; Mei, DH; Nahil, MA; Gadkari, S; Gu, S; Williams, PT; Tu, X

    2017-01-01

    In this study, plasma-catalytic steam reforming of toluene as a biomass tar model compound was carried out in a coaxial dielectric barrier discharge (DBD) plasma reactor. The effect of Ni/Al2O3 catalysts with different nickel loadings (5–20 wt%) on the plasma-catalytic gas cleaning process was evaluated in terms of toluene conversion, gas yield, by-products formation and energy efficiency of the plasma-catalytic process. Compared to the plasma reaction without a catalyst, the combination of D...

  16. Load partition in NiTi shape memory alloy polycrystals investigated by in-situ neutron diffraction and micromechanics modelling

    Czech Academy of Sciences Publication Activity Database

    Šittner, P.; Novák, V.; Lukáš, Petr; Lugovyy, Dmytro; Neov, Dimitar; Tovar, M.

    2002-01-01

    Roč. 404, č. 4 (2002), s. 829-834 ISSN 0255-5476. [Proceedings of the European conference on residual stresses /6./. Coimbra, 10.07.2002-13.07.2002] R&D Projects: GA AV ČR IAA1048107; GA ČR GV202/97/K038; GA AV ČR KSK1010104 Keywords : shape memory alloy * neutron diffraction * martensitic transformation * NiTi * micromechanics modelling * load partition Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 0.613, year: 2002

  17. Pressure effects on martensitic transformation under quenching process in a molecular dynamics model of NiAl alloy

    International Nuclear Information System (INIS)

    Kazanc, S.; Ozgen, S.; Adiguzel, O.

    2003-01-01

    The solid-solid phase transitions in NiAl alloys occur by the temperature changes and application of a pressure on the system. Both types of transitions are called martensitic transformation and have displacive and thermoelastic characters. Pressure effects on thermoelastic transformation in Ni 62.5 Al 37.5 alloy model have been studied by means of molecular dynamics method proposed by Parrinello-Rahman. Interaction forces between atoms in the model system were calculated by Lennard-Jones potential energy function. Thermodynamics and structural analysis of the martensitic transformations under hydrostatic pressure during the quenching processes have been performed. The simulation runs have been carried out in different hydrostatic pressures changing from zero to 40.65 GPa during the quenching process of the model alloy. At the zero and nonzero pressures, the system with B2-type ordered structure undergoes the product phase with L1 0 -type ordered structure by Bain distortion in the first step of martensitic transformation under the quenching process. The increase in hydrostatic pressure causes decrease in the formation time of the product phase, and twin-like lattice distortion is observed in low temperature L1 0 phase

  18. Modeling evidence for enhanced El Niño-Southern Oscillation amplitude during the Last Glacial Maximum

    Science.gov (United States)

    An, S.-I.; Timmermann, A.; Bejarano, L.; Jin, F.-F.; Justino, F.; Liu, Z.; Tudhope, A. W.

    2004-12-01

    We present a numerical eigenmode analysis of an intermediate El Niño-Southern Oscillation (ENSO) model which is driven by present-day observed background conditions as well as by simulated background conditions for the Last Glacial Maximum (LGM) about 21,000 years ago. The background conditions are obtained from two LGM simulations which were performed with the National Center for Atmospheric Research climate system model (CSM1.4) and an Earth system model of intermediate complexity (ECBilt-CLIO). Our analysis clearly shows that the leading present-day unstable recharge-discharge mode changes its stability as well as its frequency during LGM conditions. Simulated LGM background conditions were favorable to support large-amplitude self-sustained interannual ENSO variations in the tropical Pacific. Our analysis indicates that off-equatorial climate conditions as well as a shoaling of the thermocline play a crucial role in amplifying the LGM ENSO mode.

  19. Phase-field modeling of the microstructure evolution and heterogeneous nucleation in solidifying ternary Al–Cu–Ni alloys

    International Nuclear Information System (INIS)

    Kundin, Julia; Pogorelov, Evgeny; Emmerich, Heike

    2015-01-01

    We have investigated the microstructure evolution during the isothermal and non-isothermal solidification of ternary Al–Cu–Ni alloys by means of a general multi-phase-field model for an arbitrary number of phases. The stability requirements for the model functions on every dual interface guarantee the absence of “ghost” phases. The aim was to generate a realistic microstructure by coupling the thermodynamic parameters of the phases and the thermodynamically consistent phase-field evolution equations. It is shown that the specially constructed thermal noise terms disturb the stability on the dual interfaces and can produce heterogeneous nucleation of product phases at energetically favorable points. Similar behavior can be observed in triple junctions where the heterogeneous nucleation of a fourth phase is more favorable. Finally, the model predicts the growth of a combined eutectic-like and peritectic-like structure that is comparable to the observed experimental microstructure in various alloys

  20. Interpretation of seismic section by acoustic modeling. Study of large amplitude events; Hadoba modeling ni yoru jishin tansa danmen no kaishaku. Kyoshinhaba event ni taisuru kosatsu

    Energy Technology Data Exchange (ETDEWEB)

    Tamagawa, T.; Matsuoka, T.; Sato, T. [Japan Petroleum Exploration Corp., Tokyo (Japan); Minegishi, M.; Tsuru, T. [Japan National Oil Corp., Tokyo (Japan)

    1996-05-01

    A large amplitude event difficult to interpret was discovered in the overlap section in offset data beyond 10km targeting at deep structures, and the event was examined. A wave field modeling was carried out by use of a simplified synclinal structure model because it had been estimated that the large amplitude event had something to do with a synclinal structure. A pseudospectral program was used for modeling the wave field on the assumption that the synclinal structure model would be an acoustic body and that the surface would contain free boundaries and multiple reflection. It was found as the result that a discontinuous large amplitude event is mapped out in the synclinal part of the overlap section when a far trace is applied beyond the structure during a CMP overlap process. This can be attributed to the concentration of energy produced by multiple reflection in the synclinal part and by the reflection waves beyond the critical angle. Accordingly, it is possible that phenomena similar to those encountered in the modeling process are emerging during actual observation. 2 refs., 8 figs.

  1. Study of fuel control strategy based on an fuel behavior model for starting conditions; Nenryo kyodo model ni motozuita shidoji no nenryo hosei hosho ni tsuite no kosatsu

    Energy Technology Data Exchange (ETDEWEB)

    Nakajima, Y.; Uchida, M.; Iwano, H.; Oba, H. [Nissan Motor Co. Ltd., Tokyo (Japan)

    1997-10-01

    We have applied a fuel behavior model to a fuel injection system which we call SOFIS (Sophisticated and Optimized Fuel Injection System) so that we get air/fuel ratio control accuracy and good driveability. However the fuel behavior under starting conditions is still not clear. To meet low emission rules and to get better driveability under starting conditions, better air/fuel ratio control is necessary. Now we have understood the ignition timing, injection timing, and injection pulse width required in such conditions. In former days, we analyzed the state of the air/fuel mixture under cold conditions and made a new fuel behavior model which considered fuel loss such as hydrocarbons and dissolution into oil and so on. Al this time, we have applied this idea to starting. We confirm this new model offers improved air/fuel ratio control. 6 refs., 9 figs., 3 tabs.

  2. Thermally activated dislocation creep model for primary water stress corrosion cracking of NiCrFe Alloys

    International Nuclear Information System (INIS)

    Hall, M.M. Jr.

    1995-01-01

    There is a growing awareness that environmentally assisted creep plays an important role in intergranular stress corrosion cracking (IGSCC) of NiCrFe alloys in the primary coolant water environment of a pressurized water reactor (PWR). The expected creep mechanism is the thermally activated glide of dislocations. This mode of deformation is favored by the relatively low temperature of PWR operation combined with the large residual stresses that are most often identified as responsible for the SCC failure of plant components. Stress corrosion crack growth rate (CGR) equations that properly reflect the influence of this mechanism of crack tip deformation are required for accurate component life predictions. A phenomenological IGSCC-CGR model, which is based on an apriori assumption that the IGSCC-CGR is controlled by allow temperature dislocation creep mechanism, is developed in this report. Obstacles to dislocation creep include solute atoms such as carbon, which increase the lattice friction force, and forest dislocations, which can be introduced by cold prestrain. Dislocation creep also may be environmentally assisted due to hydrogen absorption at the crack tip. The IGSCC-CGR model developed here is based on an assumption that crack growth occurs by repeated fracture events occurring within an advancing crack-tip creep-fracture zone. Thermal activation parameters for stress corrosion cracking are obtained by fitting the CGR model to IGSCC-CGR data obtained on NiCrFe alloys, Alloy X-750 and Alloy 600. These IGSCC-CGR activation parameters are compared to activation parameters obtained from creep and stress relaxation tests. Recently reported CGR data, which exhibit an activation energy that depends on yield stress and the applied stress intensity factor, are used to benchmark the model. Finally, the effects of matrix carbon concentration, grain boundary carbides and absorbed hydrogen concentration are discussed within context of the model. (author). 19 refs, 7 figs

  3. Perturbation method of studying the EI Niño oscillation with two parameters by using the delay sea-air oscillator model

    International Nuclear Information System (INIS)

    Du Zeng-Ji; Lin Wan-Tao; Mo Jia-Qi

    2012-01-01

    The EI Niño-southern oscillation (ENSO) is an interannual phenomenon involved in tropical Pacific ocean-atmosphere interactions. In this paper, we develop an asymptotic method of solving the nonlinear equation using the ENSO model. Based on a class of the oscillator of the ENSO model, a approximate solution of the corresponding problem is studied employing the perturbation method

  4. Modelling Plasticity of Ni3Al-Based L12 Intermetallic Single Crystals. II. Two-Step (T1) and T2) Deformation Behaviour (Postprint

    National Research Council Canada - National Science Library

    Choi, Y. S; Dimiduk, D. M; Uchic, M. D; Parthasarathy, T. A

    2007-01-01

    The two-step (T1 and T2) deformation behaviour of Ni3Al-based single crystals was modelled under the framework of a new constitutive model proposed by Y.S. Choi, D.M. Dimiduk, M.D. Uchic, et al. [Phil. Mag. 87 1939 (2007...

  5. Artificial neural networks as a multivariate calibration tool: modelling the Fe-Cr-Ni system in X-ray fluorescence spectroscopy

    NARCIS (Netherlands)

    Bos, A.; Bos, A.; Bos, M.; van der Linden, W.E.

    1993-01-01

    The performance of artificial neural networks (ANNs) for modeling the Cr---Ni---Fe system in quantitative x-ray fluorescence spectroscopy was compared with the classical Rasberry-Heinrich model and a previously published method applying the linear learning machine in combination with singular value

  6. Model experiments on imaging subsurface fracture permeability by pulsed Doppler borehole televiewer; Pulse doppler borehole televiewer ni yoru kiretsu tosuisei hyoka ni kansuru model jikken

    Energy Technology Data Exchange (ETDEWEB)

    Inagaki, Y.; Niitsuma, H. [Tohoku University, Sendai (Japan). Faculty of Engineering

    1996-05-01

    This paper reports model experiments to evaluate flow rates of fluids passing through a fracture by using a Doppler borehole televiewer (DBHTV). A supersonic transducer disposed on a well axis transmits transmission pulses, and a transducer receives scattered waves generated by particulates in water and waves reflected on a well wall. This signal is applied with time gating to extract only the scattered waves from particulates in the vicinity of the well wall. Deriving spectra in the recorded Doppler signal obtains flow velocity components in the direction of the well radius. A model was made with a polyvinylchloride pipe with a diameter of 14.6 cm to simulate a well, to which an aluminum pipe with an inner diameter of 2 mm is connected to be used as a simulated fracture, and mud water is circulated in the pipe. The result of deriving a passed flow volume in this model by integrating flow rate distribution derived by using the above method to a predetermined range in the vicinity of the fracture showed a good proportional relationship with actual flow rate in the simulated fracture. 1 ref., 7 figs.

  7. Three-dimensional modeling for deformation of austenitic NiTi shape memory alloys under high strain rate

    Science.gov (United States)

    Yu, Hao; Young, Marcus L.

    2018-01-01

    A three-dimensional model for phase transformation of shape memory alloys (SMAs) during high strain rate deformation is developed and is then calibrated based on experimental results from an austenitic NiTi SMA. Stress, strain, and martensitic volume fraction distribution during high strain rate deformation are simulated using finite element analysis software ABAQUS/standard. For the first time, this paper presents a theoretical study of the microscopic band structure during high strain rate compressive deformation. The microscopic transformation band is generated by the phase front and leads to minor fluctuations in sample deformation. The strain rate effect on phase transformation is studied using the model. Both the starting stress for transformation and the slope of the stress-strain curve during phase transformation increase with increasing strain rate.

  8. The Impact of Canonical and Non-canonical El Niño on Atlantic Tropical Cyclone Activity: High-resolution Tropical Channel Model Simulations

    Science.gov (United States)

    Patricola, C. M.; Chang, P.; Saravanan, R.

    2013-12-01

    Tropical Pacific sea surface temperature (SST) variability during the El Niño-Southern Oscillation (ENSO) influences seasonal Atlantic tropical cyclone activity by modulating vertical wind shear and tropospheric temperature in the tropical Atlantic, with warmer than average SST during El Niño suppressing Atlantic tropical cyclones. The location of maximum SST warming during El Niño varies from the East Pacific (canonical) to Central Pacific (non-canonical/Modoki). This study investigates how the location and magnitude of maximum tropical Pacific warming impacts Atlantic tropical cyclones, and through what mechanisms. Climate simulations are performed to supplement observationally based studies, which yield conflicting results and rely on a relatively short data record that is complicated by factors other than ENSO, such as Atlantic SST variability. The simulations are run with the Weather Research and Forecasting (WRF) model configured as a tropical channel model at a relatively fine horizontal resolution of 27 km compared to the current generation of global climate models that typically use a 50 - 100 km grid. Monthly climatological SST is prescribed in the control simulation, and mechanistic experiments are forced by tropical Pacific SST patterns characteristic of Central Pacific and East Pacific El Niño. Seasonal accumulated cyclone energy is used to evaluate the response in Atlantic tropical cyclone activity to Central and East Pacific El Niño, and the response in atmospheric conditions relevant for tropical cyclones is diagnosed using a genesis potential index.

  9. Separation of Cd and Ni from multicomponent aqueous solutions by nanofiltration and characterization of membrane using IT model

    International Nuclear Information System (INIS)

    Chaudhari, Latesh B.; Murthy, Z.V.P.

    2010-01-01

    Removal of heavy metals from wastewater is of critical importance due to their high toxicity and tendency to accumulate in living organisms. In the present work, performance of a nanofiltration (NF) membrane has been studied to separate cadmium and nickel ions from multicomponent aqueous solutions at different operating conditions. It is observed that the separation of cadmium and nickel ions increases with increase in applied pressure and decreases with increase in feed concentration at a constant feed flow rate. The maximum observed solutes rejection of cadmium and nickel ions are 80.57% and 85.27% for CdCl 2 -NiCl 2 -water system and 97.26% and 98.90% for CdSO 4 -NiSO 4 -water system, respectively, for an initial feed concentration of 0.005 g/L. This difference in rejection is due to the charge density of the anions. It is also observed that the order of solute rejection sequence is inversely proportional to the diffusion coefficient. The NF membrane is characterized by an irreversible thermodynamics (IT) based Spiegler-Kedem model, coupled with film theory. Boundary-layer thickness and membrane transport parameters are estimated using Levenberg-Marquadt method. The estimated parameters are used to predict the membrane performance and found that the predicted values are in satisfactory agreement with the experimental results.

  10. Physical models of size-dependent nanofilament formation and rupture in NiO resistive switching memories

    Energy Technology Data Exchange (ETDEWEB)

    Ielmini, D; Nardi, F; Cagli, C, E-mail: ielmini@elet.polimi.it [Dipartimento di Elettronica e Informazione-Politecnico di Milano and IU.NET, Piazza L. da Vinci 32, I-20133 Milano (Italy)

    2011-06-24

    NiO films display unipolar resistance switching characteristics, due to the electrically induced formation and rupture of nanofilaments. While the applicative interest for possible use in highly dense resistance switching memory (RRAM) is extremely high, switching phenomena pose strong fundamental challenges in understanding the physical mechanisms and models. This work addresses the set and reset mechanisms for the formation and rupture of nanofilaments in NiO RRAM devices. Reset is described in terms of thermally-accelerated diffusion and oxidation processes, and its resistance dependence is explained by size-dependent Joule heating and oxidation. The filament is described as a region with locally-enhanced doping, resulting in an insulator-metal transition driven by structural and chemical defects. The set mechanism is explained by a threshold switching effect, triggering chemical reduction and a consequent local increase of metallic doping. The possible use of the observed resistance-dependent reset and set parameters to improve the memory array operation and variability is finally discussed.

  11. Atomic kinetic Monte Carlo model based on ab initio data: Simulation of microstructural evolution under irradiation of dilute Fe-CuNiMnSi alloys

    International Nuclear Information System (INIS)

    Vincent, E.; Becquart, C.S.; Domain, C.

    2007-01-01

    The embrittlement of pressure vessel steels under radiation has been long ago correlated with the presence of Cu solutes. Other solutes such as Ni, Mn and Si are now suspected to contribute also to the embrittlement. The interactions of these solutes with radiation induced point defects thus need to be characterized properly in order to understand the elementary mechanisms behind the formation of the clusters formed upon radiation. Ab initio calculations based on the density functional theory have been performed to determine the interactions of point defects with solute atoms in dilute FeX alloys (X = Cu, Mn, Ni or Si) in order to build a database used to parameterise an atomic kinetic Monte Carlo model. Some results of irradiation damage in dilute Fe-CuNiMnSi alloys obtained with this model are presented

  12. Atomic kinetic Monte Carlo model based on ab initio data: Simulation of microstructural evolution under irradiation of dilute Fe CuNiMnSi alloys

    Science.gov (United States)

    Vincent, E.; Becquart, C. S.; Domain, C.

    2007-02-01

    The embrittlement of pressure vessel steels under radiation has been long ago correlated with the presence of Cu solutes. Other solutes such as Ni, Mn and Si are now suspected to contribute also to the embrittlement. The interactions of these solutes with radiation induced point defects thus need to be characterized properly in order to understand the elementary mechanisms behind the formation of the clusters formed upon radiation. Ab initio calculations based on the density functional theory have been performed to determine the interactions of point defects with solute atoms in dilute FeX alloys (X = Cu, Mn, Ni or Si) in order to build a database used to parameterise an atomic kinetic Monte Carlo model. Some results of irradiation damage in dilute Fe-CuNiMnSi alloys obtained with this model are presented.

  13. Prediction of overpotential and effective thickness of Ni/YSZ anode for solid oxide fuel cell by improved species territory adsorption model

    Science.gov (United States)

    Nagasawa, Tsuyoshi; Hanamura, Katsunori

    2017-06-01

    The reliability of analytical model for hydrogen oxidation at Ni/YSZ anode in solid oxide fuel cell named as species territory adsorption model has been improved by introducing referenced thermodynamic and kinetic parameters predicted by density function theory calculations. The model can explicitly predict anode overpotential using unknown values of quantities of state for oxygen migration process in YSZ near a triple phase boundary (TPB), frequency factor for hydrogen oxidation, and effective anode thickness. The former two are determined through careful fitting process between the predicted and experimental results of Ni/YSZ cermet and Ni-patterned anodes. This makes it possible to estimate effective anode thickness, which tends to increase with temperature in six kinds of Ni/YSZ anodes in references. In addition, the comparison between the proposed model and a published numerical simulation indicates that the model can predict more precise dependence of anode overpotential on steam partial pressure than that by Butler-Volmer equation with empirical exchange current density. The introduction of present model into numerical simulation instead of Butler-Volmer equation can give more accurate prediction of anode polarization.

  14. Fracture mechanics behavior of a Ni-Fe superalloy sheath for superconducting fusion magnets. Pt. 2. Magnet life analysis model

    International Nuclear Information System (INIS)

    Kim, J.H.

    1997-01-01

    For pt.1 see ibid., p.251-67,(1997). From previous results of fatigue crack growth and fracture toughness measurements for a Ni-Fe base superalloy, a primary candidate for the International Thermonuclear Experimental Reactor (ITER) central solenoid (CS) conduit, we derive an improved magnet life analysis model from the framework of Newman and Raju. For the superalloy conduit with an initial semielliptical surface crack in its thickness direction, the model predicts the evolution of crack aspect ratio for a wide range of initial crack geometries under pure tension and bending fatigue. The prediction of final fracture due to fatigue crack growth using the linear elastic fracture mechanics approach is shown to be underconservative. An alternative model based on Newman's elastic-plastic fracture toughness parameter is derived for the base metal with nearly semicircular cracks. The improved life analysis model taking into account the fatigue and fracture behavior is applied to the ITER CS magnet and the results are compared with those from earlier models. Accounting for the crack shape evolution leads to significantly longer life compared to assuming a constant aspect ratio. For the superalloy base metal we find that the expected fatigue life of engineering design activity design of the CS magnet is about eight times the design requirement. Even the conceptual design activity design with a free-standing CS meets the life requirement when analyzed by the improved model. (orig.)

  15. Anisotropy and magnetostriction as corrections for the Heisenberg model at the example of the molecule {l_brace}Ni{sub 4}Mo{sub 12}{r_brace}; Anisotropie und Magnetostriktion als Korrekturen zum Heisenberg-Modell am Beispiel des Molekuels {l_brace}Ni{sub 4}Mo{sub 12}{r_brace}

    Energy Technology Data Exchange (ETDEWEB)

    Brueger, Mirko

    2008-07-15

    In the first part of this thesis the different effects of the molecular magnetism were extensively considered and the possibility of their occurence in {l_brace}Ni{sub 4}Mo{sub 12}{r_brace} checked. In the second part of this thesis different models for the description of experimental results were presented. thereby the results of ESR, SQUIO, and high-field pulse measurements on {l_brace}Ni{sub 4}Mo{sub 12}{r_brace} are described.

  16. Development of Computational Tools for Modeling Thermal and Radiation Effects on Grain Boundary Segregation and Precipitation in Fe-Cr-Ni-based Alloys

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Ying [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

    2017-08-01

    This work aims at developing computational tools for modeling thermal and radiation effects on solute segregation at grain boundaries (GBs) and precipitation. This report described two major efforts. One is the development of computational tools on integrated modeling of thermal equilibrium segregation (TES) and radiation-induced segregation (RIS), from which synergistic effects of thermal and radiation, pre-existing GB segregation have been taken into consideration. This integrated modeling was used in describing the Cr and Ni segregation in the Fe-Cr-Ni alloys. The other effort is thermodynamic modeling on the Fe-Cr-Ni-Mo system which includes the major alloying elements in the investigated alloys in the Advanced Radiation Resistant Materials (ARRM) program. Through thermodynamic calculation, we provide baseline thermodynamic stability of the hardening phase Ni2(Cr,Mo) in selected Ni-based super alloys, and contribute knowledge on mechanistic understanding on the formation of Ni2(Cr,Mo) in the irradiated materials. The major outcomes from this work are listed in the following: 1) Under the simultaneous thermal and irradiation conditions, radiation-induced segregation played a dominant role in the GB segregation. The pre-existing GB segregation only affects the subsequent radiation-induced segregation in the short time. For the same element, the segregation tendency of Cr and Ni due to TES is opposite to it from RIS. The opposite tendency can lead to the formation of W-shape profile. These findings are consistent with literature observation of the transitory W-shape profile. 2) While TES only affects the distance of one or two atomic layers from GBs, the RIS can affect a broader distance from GB. Therefore, the W-shape due to pre-existing GB segregation is much narrower than that due to composition gradient formed during the transient state. Considering the measurement resolution of Auger or STEM analysis, the segregation tendency due to RIS should play a dominant

  17. Modelling of CH4 multiple-reforming within the Ni-YSZ anode of a solid oxide fuel cell

    Science.gov (United States)

    Tran, Dang Long; Tran, Quang Tuyen; Sakamoto, Mio; Sasaki, Kazunari; Shiratori, Yusuke

    2017-08-01

    A new approach for the modelling of the simultaneous dry and steam reforming of CH4 (methane multiple-reforming (MMR)) within the Ni-YSZ anode of a solid oxide fuel cell (SOFC) is introduced in this paper. MMR is modelled by using artificial neural network (ANN) and fuzzy inference system (FIS) that can express the gas composition and temperature dependences of the consumption or the production rate of gaseous species involved in MMR. The necessary parameters for this approach are determined from the measured reforming kinetics for an anode-supported cell (ASC) fuelled by a CH4-CO2-H2O-N2 mixture. The developed MMR model is incorporated into a 3D-CFD planar ASC model to calculate the SOFC performance, and the calculated results match well with experimental values for the feed of simulated biogas (CH4/CO2 = 1) and H2. The established SOFC model considering MMR is a powerful tool to simulate the performance of internal reforming SOFC.

  18. Simulation of Ni-63 based nuclear micro battery using Monte Carlo modeling

    International Nuclear Information System (INIS)

    Kim, Tae Ho; Kim, Ji Hyun

    2013-01-01

    The radioisotope batteries have an energy density of 100-10000 times greater than chemical batteries. Also, Li ion battery has the fundamental problems such as short life time and requires recharge system. In addition to these things, the existing batteries are hard to operate at internal human body, national defense arms or space environment. Since the development of semiconductor process and materials technology, the micro device is much more integrated. It is expected that, based on new semiconductor technology, the conversion device efficiency of betavoltaic battery will be highly increased. Furthermore, the radioactivity from the beta particle cannot penetrate a skin of human body, so it is safer than Li battery which has the probability to explosion. In the other words, the interest for radioisotope battery is increased because it can be applicable to an artificial internal organ power source without recharge and replacement, micro sensor applied to arctic and special environment, small size military equipment and space industry. However, there is not enough data for beta particle fluence from radioisotope source using nuclear battery. Beta particle fluence directly influences on battery efficiency and it is seriously affected by radioisotope source thickness because of self-absorption effect. Therefore, in this article, we present a basic design of Ni-63 nuclear battery and simulation data of beta particle fluence with various thickness of radioisotope source and design of battery

  19. Multiscale Modeling of Polycrystalline NiTi Shape Memory Alloy under Various Plastic Deformation Conditions by Coupling Microstructure Evolution and Macroscopic Mechanical Response

    Directory of Open Access Journals (Sweden)

    Li Hu

    2017-10-01

    Full Text Available Numerical modeling of microstructure evolution in various regions during uniaxial compression and canning compression of NiTi shape memory alloy (SMA are studied through combined macroscopic and microscopic finite element simulation in order to investigate plastic deformation of NiTi SMA at 400 °C. In this approach, the macroscale material behavior is modeled with a relatively coarse finite element mesh, and then the corresponding deformation history in some selected regions in this mesh is extracted by the sub-model technique of finite element code ABAQUS and subsequently used as boundary conditions for the microscale simulation by means of crystal plasticity finite element method (CPFEM. Simulation results show that NiTi SMA exhibits an inhomogeneous plastic deformation at the microscale. Moreover, regions that suffered canning compression sustain more homogeneous plastic deformation by comparison with the corresponding regions subjected to uniaxial compression. The mitigation of inhomogeneous plastic deformation contributes to reducing the statistically stored dislocation (SSD density in polycrystalline aggregation and also to reducing the difference of stress level in various regions of deformed NiTi SMA sample, and therefore sustaining large plastic deformation in the canning compression process.

  20. Multiscale Modeling of Polycrystalline NiTi Shape Memory Alloy under Various Plastic Deformation Conditions by Coupling Microstructure Evolution and Macroscopic Mechanical Response.

    Science.gov (United States)

    Hu, Li; Jiang, Shuyong; Zhou, Tao; Tu, Jian; Shi, Laixin; Chen, Qiang; Yang, Mingbo

    2017-10-13

    Numerical modeling of microstructure evolution in various regions during uniaxial compression and canning compression of NiTi shape memory alloy (SMA) are studied through combined macroscopic and microscopic finite element simulation in order to investigate plastic deformation of NiTi SMA at 400 °C. In this approach, the macroscale material behavior is modeled with a relatively coarse finite element mesh, and then the corresponding deformation history in some selected regions in this mesh is extracted by the sub-model technique of finite element code ABAQUS and subsequently used as boundary conditions for the microscale simulation by means of crystal plasticity finite element method (CPFEM). Simulation results show that NiTi SMA exhibits an inhomogeneous plastic deformation at the microscale. Moreover, regions that suffered canning compression sustain more homogeneous plastic deformation by comparison with the corresponding regions subjected to uniaxial compression. The mitigation of inhomogeneous plastic deformation contributes to reducing the statistically stored dislocation (SSD) density in polycrystalline aggregation and also to reducing the difference of stress level in various regions of deformed NiTi SMA sample, and therefore sustaining large plastic deformation in the canning compression process.

  1. Stochastic processes in climate modeling: from Lorenz to the El-Niño recharge oscillator and beyond

    Science.gov (United States)

    Ghil, M.; Chekroun, M. D.; Simonnet, E.

    2009-04-01

    In the past few years, much of the climate community's work has gone toward building highly detailed, IPCC-class general circulation models (GCMs) capable of simulating climate change. In this context, subgrid-scale physics has increasingly been modeled using stochastic processes, but the broader consequences of this approach have not yet been sufficiently explored. Stochastic subgrid-scale parametrizations have substantial non-local effects on the low-frequency dynamics itself. Moreover, due to the random forcing present in these parametrizations, traditional dynamical systems concepts — e.g., strange attractors and deterministic bifurcations — are no longer appropriate. In this talk, we present and apply mathematical concepts and tools developed by L. Arnold and his Bremen school during the last two decades. These tools have not been widely exploited so far in climate research, although they offer powerful theoretical and numerical ways of investigating stochastic models. More specifically, we use random dynamical systems (RDS) theory to analyze the stochastic dynamics of climate models. To illustrate our approach, we consider at first simple conceptual models. The first example is the well-known 3-variable Lorenz (1963) model, to which we add multiplicative noise. We show how to obtain a full description of the resulting stochastic dynamics by computing this model's random attractor and its associated invariant measure. The second example is Timmermann and Jin's (GRL, 2002) nonlinear recharge-discharge model of the El Niño/Southern Oscillation (ENSO), a model that captures several essential features of ENSO physics. A multiplicative noise term is added to this TJ model to represent wind bursts. Numerical simulations of the modified TJ model's random attractor show that Smale horseshoes are excited by the multiplicative noise, even for a parameter regime in which a Hopf bifurcation occurs in the deterministic system; such intricate structures only arise in

  2. The nonlinear unloading behavior of a typical Ni-based superalloy during hot deformation: a unified elasto-viscoplastic constitutive model

    Science.gov (United States)

    Chen, Ming-Song; Lin, Y. C.; Li, Kuo-Kuo; Chen, Jian

    2016-09-01

    In authors' previous work (Chen et al. in Appl Phys A. doi: 10.1007/s00339-016-0371-6, 2016), the nonlinear unloading behavior of a typical Ni-based superalloy was investigated by hot compressive experiments with intermediate unloading-reloading cycles. The characters of unloading curves were discussed in detail, and a new elasto-viscoplastic constitutive model was proposed to describe the nonlinear unloading behavior of the studied Ni-based superalloy. Still, the functional relationships between the deformation temperature, strain rate, pre-strain and the parameters of the proposed constitutive model need to be established. In this study, the effects of deformation temperature, strain rate and pre-strain on the parameters of the new constitutive model proposed in authors' previous work (Chen et al. 2016) are analyzed, and a unified elasto-viscoplastic constitutive model is proposed to predict the unloading behavior at arbitrary deformation temperature, strain rate and pre-strain.

  3. A Critical Review of Models of the H-2/H2O/Ni/SZ Electrode Kinetics

    DEFF Research Database (Denmark)

    Mogensen, Mogens Bjerg; Høgh, Jens Valdemar Thorvald; Hansen, Karin Vels

    2007-01-01

    experimental findings that a useful model must be able to explain such as difference in sensitivity to poisoning by H2S due to differences in the detailed composition of the SZ and large change in apparent activation energy by change in cermet preparation. Finally, we will point out some elements, which seem...... important for any realistic and useful mathematical model of the H-2/H2O/Ni/SZ electrode....

  4. Modelling of the Ni(II) removal from aqueous solutions onto grape stalk wastes in fixed-bed column.

    Science.gov (United States)

    Valderrama, César; Arévalo, Jaime A; Casas, Ignasi; Martínez, María; Miralles, Nuria; Florido, Antonio

    2010-02-15

    Grape stalk wastes generated in the wine production process were used for the removal of nickel (II) from aqueous solution. The experimental breakthrough curves were obtained in fixed-bed columns. Experiments we carry out in order to evaluate the influence of inlet metal concentration (30 and 70 mg L(-1)) and the regeneration process in a double sorption cycle. The CXTFIT code was used to fit the experimental data and to determine the transport and sorption parameters of the convective-dispersive equation (CDE) and the two-site deterministic non-equilibrium (TSM/CDE) model by adjusting the models to the experimental breakthrough curves (BTC). The results showed that bed capacity as well as transport and sorption parameters were affected by the initial metal concentration, at the highest Ni(II) concentration the grape stalks column saturated quickly leading to earlier breakthrough. The sorption capacity of the sorbent was slightly reduced in a double sorption cycle, while the recovery of the metal in the desorption step was ranging between 80% and 85% in both cycles.

  5. Late time optical spectra from the Ni56 model for Type I Supernovae

    International Nuclear Information System (INIS)

    Axelrod, T.S.

    1980-04-01

    A numerical model has been created that produces self-consistent optical spectra, temperatures, and ionization states for a homologously expanding spherical shell which at t = 0 is assumed to consist of pure Nickel 56, and is further assumed to have density independent of radius within the shell. A brief summary is given of the model, followed by some results from the calculations

  6. Modelling the fine and coarse fraction of Pb, Cd, As and Ni air concentration in Spain

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez, M. A.; Vivanco, M. G.

    2015-07-01

    Lead, cadmium, arsenic and nickel are present in the air due to natural and anthropogenic emissions, normally joined to particles. Human health and ecosystems can be damaged by high atmospheric levels of these metals, since they can be introduced in organisms via inhalation or ingestion. Small particles are inhaled and embebed in lungs and alveolus more easily than coarse particles. The CHIMERE model is a eulerian air quality model extensively used in air quality modelling. Metals have been recently included in this model in a special version developed in the CIEMAT modelling group (Madrid, Spain). Vivanco et al. (2011) and Gonzalez et al. (2012) showed an evaluation of the model performance for some metals in Spain and Europe. In these studies, metals were considered as fine particles. Nevertheless there is some observational evidence of the presence of some metals also in the coarse fraction. For this reason, a new attempt of modelling metals considering a fine (<2.5 μm) and coarse (2.5-10 μm) fraction has been done. Measurements of metal concentration in PM10, PM2.5 and PM1 recorded in Spain were used to obtain the new metal particle distribution size. On the other hand, natural emissions, not considered in the above mentioned studies, were implemented in the model, by considering metal emissions associated to dust resuspensiont. An evaluation of the new version is presented and discussed for two domains in Spain, centered on Barcelona and Huelva respectively. (Author)

  7. Modelling the fine and coarse fraction of Pb, Cd, As and Ni air concentration in Spain

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez, M.A.; Vivanco, M.

    2015-07-01

    Lead, cadmium, arsenic and nickel are present in the air due to natural and anthropogenic emissions, normally joined to particles. Human health and ecosystems can be damaged by high atmospheric levels of these metals, since they can be introduced in organisms via inhalation or ingestion. Small particles are inhaled and embebed in lungs and alveolus more easily than coarse particles. The CHIMERE model is a eulerian air quality model extensively used in air quality modelling. Metals have been recently included in this model in a special version developed in the CIEMAT modelling group (Madrid, Spain). Vivanco et al. (2011) and González et al. (2012) showed an evaluation of the model performance for some metals in Spain and Europe. In these studies, metals were considered as fine particles. Nevertheless there is some observational evidence of the presence of some metals also in the coarse fraction. For this reason, a new attempt of modelling metals considering a fine (<2.5 μm) and coarse (2.5-10 μm) fraction has been done. Measurements of metal concentration in PM10, PM2.5 and PM1 recorded in Spain were used to obtain the new metal particle distribution size. On the other hand, natural emissions, not considered in the above mentioned studies, were implemented in the model, by considering metal emissions associated to dust resuspensiont. An evaluation of the new version is presented and discussed for two domains in Spain, centered on Barcelona and Huelva respectively. (Author)

  8. Modelling the fine and coarse fraction of Pb, Cd, As and Ni air concentration in Spain

    International Nuclear Information System (INIS)

    Gonzalez, M. A.; Vivanco, M. G.

    2015-01-01

    Lead, cadmium, arsenic and nickel are present in the air due to natural and anthropogenic emissions, normally joined to particles. Human health and ecosystems can be damaged by high atmospheric levels of these metals, since they can be introduced in organisms via inhalation or ingestion. Small particles are inhaled and embebed in lungs and alveolus more easily than coarse particles. The CHIMERE model is a eulerian air quality model extensively used in air quality modelling. Metals have been recently included in this model in a special version developed in the CIEMAT modelling group (Madrid, Spain). Vivanco et al. (2011) and Gonzalez et al. (2012) showed an evaluation of the model performance for some metals in Spain and Europe. In these studies, metals were considered as fine particles. Nevertheless there is some observational evidence of the presence of some metals also in the coarse fraction. For this reason, a new attempt of modelling metals considering a fine (<2.5 μm) and coarse (2.5-10 μm) fraction has been done. Measurements of metal concentration in PM10, PM2.5 and PM1 recorded in Spain were used to obtain the new metal particle distribution size. On the other hand, natural emissions, not considered in the above mentioned studies, were implemented in the model, by considering metal emissions associated to dust resuspensiont. An evaluation of the new version is presented and discussed for two domains in Spain, centered on Barcelona and Huelva respectively. (Author)

  9. Computational modelling of solid-state reactions in the Ni- Si systems induced by pulsed lasers

    Czech Academy of Sciences Publication Activity Database

    Přikryl, Petr; Cháb, Vladimír; Černý, R.

    1995-01-01

    Roč. 63, - (1995), s. 357-363 ISSN 0377-0427. [International Symposium on Mathematical Modelling and Computational Methods MODELLING 94. Prague, 29.08.1994-02.09.1994] R&D Projects: GA ČR GA202/93/2383 Impact factor: 0.373, year: 1995

  10. The genome of the Hi5 germ cell line from Trichoplusia ni, an agricultural pest and novel model for small RNA biology.

    Science.gov (United States)

    Fu, Yu; Yang, Yujing; Zhang, Han; Farley, Gwen; Wang, Junling; Quarles, Kaycee A; Weng, Zhiping; Zamore, Phillip D

    2018-01-29

    We report a draft assembly of the genome of Hi5 cells from the lepidopteran insect pest, Trichoplusia ni , assigning 90.6% of bases to one of 28 chromosomes and predicting 14,037 protein-coding genes. Chemoreception and detoxification gene families reveal T. ni -specific gene expansions that may explain its widespread distribution and rapid adaptation to insecticides. Transcriptome and small RNA data from thorax, ovary, testis, and the germline-derived Hi5 cell line show distinct expression profiles for 295 microRNA- and >393 piRNA-producing loci, as well as 39 genes encoding small RNA pathway proteins. Nearly all of the W chromosome is devoted to piRNA production, and T. ni siRNAs are not 2´- O -methylated. To enable use of Hi5 cells as a model system, we have established genome editing and single-cell cloning protocols. The T. ni genome provides insights into pest control and allows Hi5 cells to become a new tool for studying small RNAs ex vivo. © 2018, Fu et al.

  11. Catalytic Steam Reforming of Toluene as a Model Compound of Biomass Gasification Tar Using Ni-CeO2/SBA-15 Catalysts

    Directory of Open Access Journals (Sweden)

    Erik Dahlquist

    2013-07-01

    Full Text Available Nickel supported on SBA-15 doped with CeO2 catalysts (Ni-CeO2/SBA-15 was prepared, and used for steam reforming of toluene which was selected as a model compound of biomass gasification tar. A fixed-bed lab-scale set was designed and employed to evaluate the catalytic performances of the Ni-CeO2/SBA-15 catalysts. Experiments were performed to reveal the effects of several factors on the toluene conversion and product gas composition, including the reaction temperature, steam/carbon (S/C ratio, and CeO2 loading content. Moreover, the catalysts were subjected to analysis of their carbon contents after the steam reforming experiments, as well as to test the catalytic stability over a long experimental period. The results indicated that the Ni-CeO2/SBA-15 catalysts exhibited promising capabilities on the toluene conversion, anti-coke deposition and catalytic stability. The toluene conversion reached as high as 98.9% at steam reforming temperature of 850 °C and S/C ratio of 3 using the Ni-CeO2(3wt%/SBA-15 catalyst. Negligible coke formation was detected on the used catalyst. The gaseous products mainly consisted of H2 and CO, together with a little CO2 and CH4.

  12. Multi-scale modelling of Suzuki segregation in γ′ precipitates in Ni and Co-base superalloys

    Directory of Open Access Journals (Sweden)

    Srimannarayana P.

    2014-01-01

    Full Text Available The high temperature strength of alloys with (γ + γ′ microstructure is primarily due to the resistance of the ordered precipitate to cutting by matrix dislocations. Such shearing requires higher stresses since it involves the creation of a planar fault. Planar fault energy is known to be dependent on composition. This implies that the composition on the fault may be different from that in the bulk for energetic reasons. Such segregation (or desegregation of specific alloying elements to the fault may result in Suzuki strengthening which has not been explored extensively in these systems. In this work, segregation (or desegregation of alloying elements to planar faults was studied computationally in Ni3(Al,Ti and Co3(W,Al type γ′ precipitates. The composition dependence of APB energy and heat of mixing were evaluated from first principle electronic structure calculations. A phase field model incorporating the first principles results, was used to simulate the motion of an extended superdislocation under stress concurrently with composition evolution. Results reveal that in both systems, significant (desegregation occurs on equilibration. On application of stress, solutes were dragged along with the APB in some cases. Additionally, it was also noted the velocity of the superdislocation under an applied stress is strongly dependent on atomic mobility (i.e. diffusivity.

  13. Thermo-Electrical Mathematical Model for Prediction of Ni-Cr Hot-Wire Temperature in Free Air and Inside Small Circular Cavities

    DEFF Research Database (Denmark)

    Petkov, Kiril; Hattel, Jesper Henri

    2017-01-01

    A one-dimensional thermo-electrical mathematical model describing the heating and cooling of thin Ni-Cr20% wires is presented. The model is applied for wires in a free air environment and to wires placed in small circular cavities formed by expanded polystyrene material. The basis of the model...... to select an appropriate heat transfer coefficient for the time-dependent heating and cooling of a wire. The model is tested against experimental data and is found to be in a good agreement with previous investigations. Based on the findings, expressions for the heat transfer coefficient of a hot wire...

  14. A macroscopic multi-mechanism based constitutive model for the thermo-mechanical cyclic degeneration of shape memory effect of NiTi shape memory alloy

    Science.gov (United States)

    Yu, Chao; Kang, Guozheng; Kan, Qianhua

    2017-06-01

    A macroscopic based multi-mechanism constitutive model is constructed in the framework of irreversible thermodynamics to describe the degeneration of shape memory effect occurring in the thermo-mechanical cyclic deformation of NiTi shape memory alloys (SMAs). Three phases, austenite A, twinned martensite Mt and detwinned martensite Md, as well as the phase transitions occurring between each pair of phases (A→ M t, Mt→ A, A→ M d, Md→ A, and Mt→ M d) are considered in the proposed model. Meanwhile, two kinds of inelastic deformation mechanisms, martensite transformation-induced plasticity and reorientation-induced plasticity, are used to explain the degeneration of shape memory effects of NiTi SMAs. The evolution equations of internal variables are proposed by attributing the degeneration of shape memory effect to the interaction between the three phases ( A, Mt, and Md) and plastic deformation. Finally, the capability of the proposed model is verified by comparing the predictions with the experimental results of NiTi SMAs. It is shown that the degeneration of shape memory effect and its dependence on the loading level can be reasonably described by the proposed model.

  15. Modeling of Gas Diffusion in Ni/YSZ Electrodes in CO2 and Co-electrolysis

    DEFF Research Database (Denmark)

    Duhn, Jakob Dragsbæk; Jensen, Anker Degn; Wedel, Stig

    2017-01-01

    to prevent its formation. For prediction of carbon formation, the gas composition in the electrode must be known. In this work, the diffusion of gases in the electrode has been modeled with the dusty gas model in 1 and 2 dimensions, and the effect of tortuosity, porosity, temperature, electrode thickness......Carbon formation may occur during CO2 and CO2/H2O electrolysis using solid oxide electrolyzer cells due to the Boudouard reaction (2CO →  CO2 + C(s)). Formed carbon may disintegrate the cell structure and it is therefore of importance to be able to predict when carbon is formed, and take actions......, pore diameter, current density, pitch and rib width has been investigated. It is shown that diffusion limitations on reactant/product transport may lead to carbon formation. The parameters describing the microstructure and the dimensions of the cathode channels and interconnect ribs are found to have...

  16. May common model biases reduce CMIP5's ability to simulate the recent Pacific La Niña-like cooling?

    Science.gov (United States)

    Luo, Jing-Jia; Wang, Gang; Dommenget, Dietmar

    2018-02-01

    Over the recent three decades sea surface temperate (SST) in the eastern equatorial Pacific has decreased, which helps reduce the rate of global warming. However, most CMIP5 model simulations with historical radiative forcing do not reproduce this Pacific La Niña-like cooling. Based on the assumption of "perfect" models, previous studies have suggested that errors in simulated internal climate variations and/or external radiative forcing may cause the discrepancy between the multi-model simulations and the observation. But the exact causes remain unclear. Recent studies have suggested that observed SST warming in the other two ocean basins in past decades and the thermostat mechanism in the Pacific in response to increased radiative forcing may also play an important role in driving this La Niña-like cooling. Here, we investigate an alternative hypothesis that common biases of current state-of-the-art climate models may deteriorate the models' ability and can also contribute to this multi-model simulations-observation discrepancy. Our results suggest that underestimated inter-basin warming contrast across the three tropical oceans, overestimated surface net heat flux and underestimated local SST-cloud negative feedback in the equatorial Pacific may favor an El Niño-like warming bias in the models. Effects of the three common model biases do not cancel one another and jointly explain 50% of the total variance of the discrepancies between the observation and individual models' ensemble mean simulations of the Pacific SST trend. Further efforts on reducing common model biases could help improve simulations of the externally forced climate trends and the multi-decadal climate fluctuations.

  17. Stochastic estimation of nuclear level density in the nuclear shell model: An application to parity-dependent level density in 58Ni

    Directory of Open Access Journals (Sweden)

    Noritaka Shimizu

    2016-02-01

    Full Text Available We introduce a novel method to obtain level densities in large-scale shell-model calculations. Our method is a stochastic estimation of eigenvalue count based on a shifted Krylov-subspace method, which enables us to obtain level densities of huge Hamiltonian matrices. This framework leads to a successful description of both low-lying spectroscopy and the experimentally observed equilibration of Jπ=2+ and 2− states in 58Ni in a unified manner.

  18. Oxidative-reforming of model biogas over NiO/Al2O3 catalysts: The influence of the variation of support synthesis conditions

    International Nuclear Information System (INIS)

    Asencios, Yvan J.O.; Elias, Kariny F.M.; Assaf, Elisabete M.

    2014-01-01

    Graphical abstract: - Highlights: • Precipitation pH and ageing T °C of Al 2 O 3 influenced the performance of Ni/Al 2 O 3 . • Ni catalysts supported on Al 2 O 3 obtained at pH 7 recorded high conversion values. • Catalysts supported on Al 2 O 3 obtained at pH 7 and 80 °C are promissory for reforming of biogas. • Catalysts supported on Al 2 O 3 obtained at pH 6 deactivated readily during reaction. - Abstract: In this study, nickel catalysts (20 wt%) supported on γ-Al 2 O 3 were prepared by the impregnation method. The γ-Al 2 O 3 , was synthesized by precipitation of bayerite gel obtained from aluminum scrap. The synthetic conditions of the bayerite gel varied as follows: precipitation pH ranging from 6 to 7; ageing temperature ranging from 25 to 80 °C, the calcination temperature for all samples was 500 °C. The catalysts and the supports were analyzed by temperature programmed reduction (H 2 -TPR), X-ray diffraction (XRD), physisorption of N 2 (BET), X-ray absorption near-edge structure (XANES) and scanning electron microscopy (SEM). Isopropanol decomposition reactions over the catalysts were carried out to evaluate their acidity. SEM images of the spent catalysts showed that the morphology of the carbon formed during the reaction is of the filamentous type. The TPR analysis of the catalysts showed the presence of NiO species weakly interacted with the support as well as stoichiometric and non-stoichiometric nickel aluminate, the reduction of these species was also observed by XANES analysis. XRD analysis of the fresh catalyst showed peaks assigned to NiO, NiAl 2 O 4 and γ-Al 2 O 3 . The best catalysts (samples NiAl7-25 and NiAl7-80) synthesized in this report showed high stability and high conversion values (CH 4 (70%) and CO 2 (78%)). These catalysts showed better performance than the catalyst supported on commercial γ-Al 2 O 3 , which showed a high coke formation which affected the course of the reaction. The γ-Al 2 O 3 synthesized from bayerite

  19. Oxidative-reforming of model biogas over NiO/Al{sub 2}O{sub 3} catalysts: The influence of the variation of support synthesis conditions

    Energy Technology Data Exchange (ETDEWEB)

    Asencios, Yvan J.O., E-mail: yvan.jesus@unifesp.br [Departamento de Ciências do Mar, Universidade Federal de São Paulo, Av. Alm. Saldanha da Gama, 89, Ponta da Praia, CEP: 11030-400, Santos-SP (Brazil); Elias, Kariny F.M. [Instituto de Química de São Carlos, Universidade de São Paulo, Av. Trabalhador Sãocarlense, 400, 13560-970, São Carlos-SP (Brazil); Assaf, Elisabete M., E-mail: eassaf@iqsc.usp.br [Instituto de Química de São Carlos, Universidade de São Paulo, Av. Trabalhador Sãocarlense, 400, 13560-970, São Carlos-SP (Brazil)

    2014-10-30

    Graphical abstract: - Highlights: • Precipitation pH and ageing T °C of Al{sub 2}O{sub 3} influenced the performance of Ni/Al{sub 2}O{sub 3}. • Ni catalysts supported on Al{sub 2}O{sub 3} obtained at pH 7 recorded high conversion values. • Catalysts supported on Al{sub 2}O{sub 3} obtained at pH 7 and 80 °C are promissory for reforming of biogas. • Catalysts supported on Al{sub 2}O{sub 3} obtained at pH 6 deactivated readily during reaction. - Abstract: In this study, nickel catalysts (20 wt%) supported on γ-Al{sub 2}O{sub 3} were prepared by the impregnation method. The γ-Al{sub 2}O{sub 3}, was synthesized by precipitation of bayerite gel obtained from aluminum scrap. The synthetic conditions of the bayerite gel varied as follows: precipitation pH ranging from 6 to 7; ageing temperature ranging from 25 to 80 °C, the calcination temperature for all samples was 500 °C. The catalysts and the supports were analyzed by temperature programmed reduction (H{sub 2}-TPR), X-ray diffraction (XRD), physisorption of N{sub 2} (BET), X-ray absorption near-edge structure (XANES) and scanning electron microscopy (SEM). Isopropanol decomposition reactions over the catalysts were carried out to evaluate their acidity. SEM images of the spent catalysts showed that the morphology of the carbon formed during the reaction is of the filamentous type. The TPR analysis of the catalysts showed the presence of NiO species weakly interacted with the support as well as stoichiometric and non-stoichiometric nickel aluminate, the reduction of these species was also observed by XANES analysis. XRD analysis of the fresh catalyst showed peaks assigned to NiO, NiAl{sub 2}O{sub 4} and γ-Al{sub 2}O{sub 3}. The best catalysts (samples NiAl7-25 and NiAl7-80) synthesized in this report showed high stability and high conversion values (CH{sub 4} (70%) and CO{sub 2} (78%)). These catalysts showed better performance than the catalyst supported on commercial γ-Al{sub 2}O{sub 3}, which showed a

  20. Incorporating bioavailability into toxicity assessment of Cu-Ni, Cu-Cd, and Ni-Cd mixtures with the extended biotic ligand model and the WHAM-F(tox) approach.

    Science.gov (United States)

    Qiu, Hao; Vijver, Martina G; He, Erkai; Liu, Yang; Wang, Peng; Xia, Bing; Smolders, Erik; Versieren, Liske; Peijnenburg, Willie J G M

    2015-12-01

    There are only a limited number of studies that have developed appropriate models which incorporate bioavailability to estimate mixture toxicity. Here, we explored the applicability of the extended biotic ligand model (BLM) and the WHAM-F(tox) approach for predicting and interpreting mixture toxicity, with the assumption that interactions between metal ions obey the BLM theory. Seedlings of lettuce Lactuca sativa were exposed to metal mixtures (Cu-Ni, Cu-Cd, and Ni-Cd) contained in hydroponic solutions for 4 days. Inhibition to root elongation was the endpoint used to quantify the toxic response. Assuming that metal ions compete with each other for binding at a single biotic ligand, the extended BLM succeeded in predicting toxicity of three mixtures to lettuce, with more than 82% of toxicity variation explained. There were no significant differences in the values of f(mix50) (i.e., the overall amounts of metal ions bound to the biotic ligand inducing 50% effect) for the three mixture combinations, showing the possibility of extrapolating these values to other binary metal combinations. The WHAM-F(tox) approach showed a similar level of precision in estimating mixture toxicity while requiring fewer parameters than the BLM-f(mix) model. External validation of the WHAM-F(tox) approach using literature data showed its applicability for other species and other mixtures. The WHAM-F(tox) model is suitable for delineating mixture effects where the extended BLM also applies. Therefore, in case of lower data availability, we recommend the lower parameterized WHAM-F(tox) as an effective approach to incorporate bioavailability in quantifying mixture toxicity.

  1. A multiscale modelling study of Ni-Cr crack tip initial stage oxidation at different stress intensities

    International Nuclear Information System (INIS)

    Das, Nishith Kumar; Tirtom, Ismail; Shoji, Tetsuo

    2010-01-01

    In this study, different scale analyses have been performed to understand the very beginning stage of the Ni-Cr(1 1 1) binary alloy surface oxidation mechanism. The finite elements method (FEM) has been applied to find the stress intensity effect on a compact tension (CT) specimen crack tip, and a 2-μm rectangular region has been prepared for the quasi-continuum (QC) model. The displacement load calculated by FEM was applied at the upper and lower boundaries of the QC model. The obtained atomic positions of the deformed crystal structure were considered for quantum chemical molecular dynamics (QCMD) analysis by placing water molecules on the surface. Water molecules dissociate on the top site followed by the quick diffusion of hydrogen atoms on the surface through the hollow sites. Hydrogen is easily transported into the lattice due to its small atomic size. Increases in stress intensity factor (K) act to deform the structure, which augments oxygen penetration and reduces hydrogen diffusion time; as a consequence, changes in K result in an increase of metallic surface oxidation. Oxygen preferentially bonds with chromium to develop a protective passive film on the surface, and the quickly diffused hydrogen is trapped on the metal surface. Hydrogen bonds with the metal by receiving electrons and, therefore, works as an oxidant on the surface and weakens the metal atomic bond at the primary stage. Initially, the oxidized surface forms a strong bond with oxygen, resulting in the breakage of metal-metal bonds. Therefore, this hydrogen action enhances the very early stage surface oxidation.

  2. Simulation of the microstructural evolution under irradiation of dilute Fe-CuNiMnSi alloys by atomic kinetic monte Carlo model based on ab initio data

    International Nuclear Information System (INIS)

    Vincent, E.; Domain, C.; Vincent, E.; Becquart, C.S.

    2008-01-01

    Full text of publication follows. The embrittlement and the hardening of pressure vessel steels under radiation has been correlated with the presence solutes such as Cu, Ni, Mn and Si. Indeed it has been observed that under irradiation, these solutes tend to gather to form more or less dilute clusters. The interactions of these solutes with radiation induced point defects thus need to be characterised properly in order to understand the elementary mechanisms behind the formation of these clusters. Ab initio calculations based on the density functional theory have been performed to determine the interactions of point defects (vacancies as well as interstitials) with solute atoms in dilute FeX alloys (X Cu, Mn, Ni or Si) in order to build a database used to parameterize an atomic kinetic Monte Carlo model. The model has been applied to simulate thermal ageing as well as irradiation conditions in dilute Fe-CuNiMnSi alloys. Results obtained with this model will be presented. (authors)

  3. A Reliability Model for Ni-BaTiO3-Based (BME) Ceramic Capacitors

    Science.gov (United States)

    Liu, Donhang

    2014-01-01

    The evaluation of multilayer ceramic capacitors (MLCCs) with base-metal electrodes (BMEs) for potential NASA space project applications requires an in-depth understanding of their reliability. The reliability of an MLCC is defined as the ability of the dielectric material to retain its insulating properties under stated environmental and operational conditions for a specified period of time t. In this presentation, a general mathematic expression of a reliability model for a BME MLCC is developed and discussed. The reliability model consists of three parts: (1) a statistical distribution that describes the individual variation of properties in a test group of samples (Weibull, log normal, normal, etc.), (2) an acceleration function that describes how a capacitors reliability responds to external stresses such as applied voltage and temperature (All units in the test group should follow the same acceleration function if they share the same failure mode, independent of individual units), and (3) the effect and contribution of the structural and constructional characteristics of a multilayer capacitor device, such as the number of dielectric layers N, dielectric thickness d, average grain size r, and capacitor chip size S. In general, a two-parameter Weibull statistical distribution model is used in the description of a BME capacitors reliability as a function of time. The acceleration function that relates a capacitors reliability to external stresses is dependent on the failure mode. Two failure modes have been identified in BME MLCCs: catastrophic and slow degradation. A catastrophic failure is characterized by a time-accelerating increase in leakage current that is mainly due to existing processing defects (voids, cracks, delamination, etc.), or the extrinsic defects. A slow degradation failure is characterized by a near-linear increase in leakage current against the stress time; this is caused by the electromigration of oxygen vacancies (intrinsic defects). The

  4. Studies on surface tension effect for free surface flow around floating models; Futai mokei mawari no jiyu hyomenryu ni oyobosu hyomen choryoku no eikyo ni kansuru kenkyu

    Energy Technology Data Exchange (ETDEWEB)

    Suzuki, K. [Yokohama National Univ., Yokohama (Japan). Faculty of Engineering; Akiba, H. [Toyo Construction Co. Ltd., Tokyo (Japan)

    1996-12-31

    The effect of surface tension on free surface flow around floating models is discussed experimentally and numerically. Three-dimensional free surface flow around vertical circular cylinders floating in a circulating water channel was visually observed, where a surface-active agent was added to water. The results are analyzed using Weber number. The numerical analysis was done for vertical cylinder and CY100 models using the Rankine source method. Weber number of at least around 120 is necessary to eliminate the effect of surface tension from free surface flow around the CY100 model. The numerical analysis for the cylinder model needs simulation with wavelength shorter than that of free surface wave used by the Rankine source method. The model for the resistance test should be at least around 7m long to eliminate the effect of surface tension at Froude number of 0.1 or higher. 15 refs., 12 figs., 2 tabs.

  5. Bond-versus-site doping models for off-chain-doped Haldane-gap system Y2BaNiO5

    International Nuclear Information System (INIS)

    Lou Jizhong; Qin Shaojin; Su Zhaobin; Yu Lu

    1998-09-01

    Using the density matrix renormalization-group technique, we calculate the impurity energy levels for two different effective models of off-chain doping for quasi-one-dimensional Heisenberg chain compound Y 2 BaNiO 5 : ferromagnetic bond doping and antiferromagnetic site spin-1/2 doping. Thresholds of the impurity strength for the appearance of localized states are found for both models. However, the ground-state and low-energy excitations for weak impurity strength are different for these two models and the difference can be detected by experiments. (author)

  6. Characterization and Modeling I(V of the Gate Schottky Structures HEMTs Ni/Au/AlInN/GaN

    Directory of Open Access Journals (Sweden)

    N. Benyahya

    2014-05-01

    Full Text Available In this paper, we have studied the Schottky contact of Ni/Au/AlInN/GaN HEMTs. The current–voltage Igs (Vgs of Ni/Au/AlInN/GaN structures were investigated at room temperature. The electrical parameters such as ideality factor (2.3, barrier height (0.72 eV and series resistance (33 W were evaluated from I(V data, the threshold voltage (-2.42 V, the 2D gas density (1.35 ´ 1013 cm-2 and barrier height (0.94 eV were evaluated from C(V data.

  7. Modeling of time-dependent inelastic deformation of CFRP laminates; CFRP sekisozai ni taisuru jikan izon hidansei henkei no modeling

    Energy Technology Data Exchange (ETDEWEB)

    Kanagawa, Y.; Murakami, S.; Mizobe, T. [Nagoya University, Nagoya (Japan). Faculty of Engineering; Fujii, T. [Daihatsu Motor Co. Ltd., Osaka (Japan)

    1997-07-15

    A constitutive model for describing the inelastic deformation of unidirectional and symmetric angle-ply CFRP (Carbon Fiber Reinforced Plastics) laminates is developed. The kinematic hardening creep flow law of Malinin and Khadjinsky and the evolution equation of Armstrong and Frederick are extended to describe the creep deformation of anisotropic materials. In order to express anisotropic hardening, back stress taking account of anisotropic inelastic strain sensitivity is incorporated into the creep constitutive equation. Then, the resulting model is applied to analyze the time-dependent inelastic deformation of symmetric angle-ply laminates. Comparison between the prediction and the experimental observation shows that the present model can describe well the time-dependent inelastic behavior under different loadings. 12 refs., 10 figs.

  8. Three dimensional reflection velocity analysis based on velocity model scan; Model scan ni yoru sanjigen hanshaha sokudo kaiseki

    Energy Technology Data Exchange (ETDEWEB)

    Minegishi, M.; Tsuru, T. [Japan National Oil Corp., Tokyo (Japan); Matsuoka, T. [Japan Petroleum Exploration Corp., Tokyo (Japan)

    1996-05-01

    Introduced herein is a reflection wave velocity analysis method using model scanning as a method for velocity estimation across a section, the estimation being useful in the construction of a velocity structure model in seismic exploration. In this method, a stripping type analysis is carried out, wherein optimum structure parameters are determined for reflection waves one after the other beginning with those from shallower parts. During this process, the velocity structures previously determined for the shallower parts are fixed and only the lowest of the layers undergoing analysis at the time is subjected to model scanning. To consider the bending of ray paths at each velocity boundaries involving shallower parts, the ray path tracing method is utilized for the calculation of the reflection travel time curve for the reflection surface being analyzed. Out of the reflection wave travel time curves calculated using various velocity structure models, one that suits best the actual reflection travel time is detected. The degree of matching between the calculated result and actual result is measured by use of data semblance in a time window provided centering about the calculated reflective wave travel time. The structure parameter is estimated on the basis of conditions for the maximum semblance. 1 ref., 4 figs.

  9. Quantum-mechanical calculation of H on Ni(001) using a model potential based on first-principles calculations

    DEFF Research Database (Denmark)

    Mattsson, T.R.; Wahnström, G.; Bengtsson, L.

    1997-01-01

    First-principles density-functional calculations of hydrogen adsorption on the Ni (001) surface have been performed in order to get a better understanding of adsorption and diffusion of hydrogen on metal surfaces. We find good agreement with experiments for the adsorption energy, binding distance...

  10. Isothermal structural relaxation of Fe40Ni40B20 metallic glass in the relaxation times spectrum model

    NARCIS (Netherlands)

    Csach, K; Haruyama, O; Kasardova, A; Ocelik, Vaclav

    1997-01-01

    The structural relaxation of amorphous as-quenched Fe40Ni40B20 sample was investigated during isothermal annealing at temperatures close to 400 degrees C by: (i) the residual electrical resistance measured at liquid N-2 temperature; (ii) the in-situ electrical resistance; and (iii) the length

  11. Microscopic Optical Model Analysis of 7Be+ 58Ni Elastic Scattering System at ELab=23.2 MeV

    Directory of Open Access Journals (Sweden)

    Mikail DİREKÇİ

    2016-11-01

    Full Text Available Özet. Bu çalışmamızda, 7Be zayıf bağlı (Sα = 1.586 MeV  ve (7Beà 3He + 4He kabuk yapısına sahip egzotik çekirdeğinin 58Ni kararlı çekirdeği üzerine ELab=23.2 MeV’lik laboratuar gelme enerjisinde gönderilmesi sonucu elde edilen Elastik Saçılma açısal dağılım datası analiz edilmiştir. Zayıf-bağlı ve kabuk yapıya sahip bu çekirdek, Coulomb alanına veya hedef çekirdeğin nükleer alanına yaklaştıkça kabuk yapıyı oluşturan bileşenlere parçalanma ya da bileşenlerin hedef çekirdeğe transfer olasılığı çok büyüktür. İncelenen saçılma sistemi Optik Model (OM çerçevesinde analiz edilmiştir. İlk olarak, saçılma sisteminin açısal dağılım datası, nükleer potansiyelin reel ve sanal kısımları Woods-Saxon (WS formunda alınarak fenomenolojik olarak tekrardan incelenmiştir. İkinci olarak, saçılma sistemi 7Be çekirdeği için Gaussian and 3-parametreli Fermi(3p-F fenomenolojik madde yoğunluk dağılımlarının sırasıyla Çift-Katlı integral metodunda kullanılması elde edilen potansiyeller ile analiz edilmiştir. Fenomenolojik ve mikroskobik optik model analizinin karşılaştırılması ve literatürde ilk kez 7Be çekirdeği için 2 farklı madde yoğunluk dağılımı önerilerek saçılma sisteminin analizi amaçlanmıştır. Büyük soğurulma yarıçapı(rw değeri için teorik ve deneysel sonuçlar arasındaki uyumun gayet iyi olduğu ve küçük hata oranları, χ2/N elde edilmiştir.Anahtar Kelimeler: Zayıf bağlı çekirdek, Optik Model, Çift-Katlı potansiyel, Madde Yoğunluğu Abstract. In this study, angular distribution for the elastic scattering of 7Be which is weakly-bound (Sα = 1.586 MeV  and known as a well pronounced 3He + 4He cluster structure on 58Ni target have been analyzed at laboratory energy of 23.2 MeV. Therefore this nucleus has a large probability to breakup into its constituent cluster features, while approaching the Coulomb or nuclear field

  12. Quantum model of a solid-state spin qubit: Ni cluster on a silicon surface by the generalized spin Hamiltonian and X-ray absorption spectroscopy investigations

    Energy Technology Data Exchange (ETDEWEB)

    Farberovich, Oleg V. [School of Physics and Astronomy, Beverly and Raymond Sackler Faculty of Exact Sciences, Tel Aviv University, Tel Aviv 69978 (Israel); Research Center for Nanoscale Structure of Matter, Southern Federal University, Zorge 5, 344090 Rostov-on-Don (Russian Federation); Voronezh State University, Voronezh 394000 (Russian Federation); Mazalova, Victoria L., E-mail: mazalova@sfedu.ru [Research Center for Nanoscale Structure of Matter, Southern Federal University, Zorge 5, 344090 Rostov-on-Don (Russian Federation); Soldatov, Alexander V. [Research Center for Nanoscale Structure of Matter, Southern Federal University, Zorge 5, 344090 Rostov-on-Don (Russian Federation)

    2015-11-15

    We present here the quantum model of a Ni solid-state electron spin qubit on a silicon surface with the use of a density-functional scheme for the calculation of the exchange integrals in the non-collinear spin configurations in the generalized spin Hamiltonian (GSH) with the anisotropic exchange coupling parameters linking the nickel ions with a silicon substrate. In this model the interaction of a spin qubit with substrate is considered in GSH at the calculation of exchange integrals J{sub ij} of the nanosystem Ni{sub 7}–Si in the one-electron approach taking into account chemical bonds of all Si-atoms of a substrate (environment) with atoms of the Ni{sub 7}-cluster. The energy pattern was found from the effective GSH Hamiltonian acting in the restricted spin space of the Ni ions by the application of the irreducible tensor operators (ITO) technique. In this paper we offer the model of the quantum solid-state N-spin qubit based on the studying of the spin structure and the spin-dynamics simulations of the 3d-metal Ni clusters on the silicon surface. The solution of the problem of the entanglement between spin states in the N-spin systems is becoming more interesting when considering clusters or molecules with a spectral gap in their density of states. For quantifying the distribution of the entanglement between the individual spin eigenvalues (modes) in the spin structure of the N-spin system we use the density of entanglement (DOE). In this study we have developed and used the advanced high-precision numerical techniques to accurately assess the details of the decoherence process governing the dynamics of the N-spin qubits interacting with a silicon surface. We have studied the Rabi oscillations to evaluate the N-spin qubits system as a function of the time and the magnetic field. We have observed the stabilized Rabi oscillations and have stabilized the quantum dynamical qubit state and Rabi driving after a fixed time (0.327 μs). The comparison of the energy

  13. Accuracy of FEM 3-D modeling in the electromagnetic methods; Denjiho ni okeru FEM 3 jigen modeling no seido

    Energy Technology Data Exchange (ETDEWEB)

    Sasaki, Y. [Kyushu University, Fukuoka (Japan). Faculty of Engineering

    1996-10-01

    Analytical methods considering 3-D resistivity distribution, in particular, finite element method (FEM) were studied to improve the reliability of electromagnetic exploration. Integral equation, difference calculus, FEM and hybrid method are generally used as computational 3-D modeling method. FEM is widely used in various fields because FEM can easily handle complicated shapes and boundaries. However, in electromagnetic method, the assumption of continuous electric field is pointed out as important problem. The normal (orthogonal) component of current density should be continuous at the boundary between media with different conductivities, while this means that the normal component of electric field is discontinuous. In FEM, this means that current channeling is not properly considered, resulting in poor accuracy. Unless this problem is solved, FEM modeling is not practical. As one of the solutions, it is promising to specifically incorporate interior boundary conditions into element equation. 4 refs., 11 figs.

  14. Deep sedimentary structure model beneath the Osaka plain; Osaka heiya ni okeru shinbu chika kozo no model ka

    Energy Technology Data Exchange (ETDEWEB)

    Miyakoshi, K.; Kagawa, T.; Echigo, T. [Osaka Soil Test, Osaka (Japan)

    1997-05-27

    Restructuring was carried out on a sedimentary basin structure model of the Osaka plain including Osaka Bay by using newly obtained underground structural data. After the Hygoken-nanbu Earthquake of 1995, a large number of underground structure investigations have been performed in Osaka Bay and urban areas of Kobe and Osaka. However, very few surveys have been done in areas peripheral to Osaka Prefecture, such as the Ikoma area. Therefore, an attempt has been made to increase the number of measuring points to acquire underground structural data of these areas. Estimation of basic rock depths has utilized the dominant cycles in H/V spectra obtained from micro vibration survey, and good correlation of the base rock depths derived by a refraction exploration and a deep-bed boring investigation. With regard to bed division and P- and S- wave velocities in sedimentary beds in the Osaka sedimentary basin, an underground structure model was prepared, which was divided into four beds according to the refraction exploration and the micro vibration investigation. Data obtained by using this model agreed well with depth data acquired from physical exploration and other types of investigations. However, no good agreement was recognized in the data for such areas where the basic depth changes abruptly as the Rokko fault and the Osaka bay fault. 6 refs., 8 figs., 2 tabs.

  15. Three-dimensional TDEM modeling using finite-difference method; Sabunho ni yoru TDEM ho no sanjigen modeling

    Energy Technology Data Exchange (ETDEWEB)

    Noguchi, K.; Endo, M. [Waseda University, Tokyo (Japan). School of Science and Engineering

    1997-10-22

    Study is made on the theory of three-dimensional modelling of TDEM (Time Domain Electromagnetic) method based on the theory of Wang and Hohmann. A difference scheme is built and investigation is conducted about calculation accuracy with attention paid especially to space and time division, and the obtained optimum value is compared with the analytical solution for a homogeneous medium. As the result, it becomes possible to have a high-accuracy TDEM response thanks to the obtained optimum parameter. In an example, a response is determined in the case of a high-resistivity body in presence near the ground surface. Calculation is performed under the given conditions of a medium 100 ohm/m in resistivity, anomalous bodies 200, 500, 1000, 2000,5000, and 10,000 ohm/m in resistivity, respectively, and a distance in the direction of depth of 20m. The result indicates that it is possible to estimate the effect of the ground surface terrain on a TDEM response. Since the effect of the ground surface terrain emerges at the initial part of a response, it is inferred that consideration of terrain is mandatory in building a model if it is for interpreting the subsurface structure in detail. 5 refs., 7 figs.

  16. Model-supported interpretation of the electrochemical characteristics of solid oxide fuel cells with Ni/YSZ cermet anodes; Modellgestuetzte Interpretation der elektrochemischen Charakteristik von Festoxid-Brennstoffzellen mit Ni/YSZ-Cermetanoden

    Energy Technology Data Exchange (ETDEWEB)

    Gewies, Stefan

    2009-01-29

    This work presents the development, validation and application of a multiscale model for the detailed description of a solid oxide fuel cell (SOFC) with a Ni/YSZ (nickel/yttria-stabilized zirconia) cermet anode. The aim of the study is the identification of the physico-chemical loss processes, as seen in impedance spectra and polarization curves. The model consists of an elementary kinetic description of the electrochemistry including the development of an electrical double layer at the electrode/electrolyte interface of the cermet anode, a homogenized description of charge and gas-phase transport in the electrodes as well as a macroscopic description of convective and diffusive mass transport in the gas phase above the electrodes. For the rst time this study allows for a complete description of the impedance spectra of a diffusively fuel-supplied cermet anode. By comparing simulations with experiments on symmetrical cells (University of Karlsruhe) three dominant loss processes could be identified. The model was extended to account for the description of segmented SOFCs. In correspondence with experimental data (German Aerospace Center) the simulations show strong gradients in current densities and gas concentrations. (orig.)

  17. Three-dimensional TDEM modeling using integral equation method. 2; Sekibun hoteishikiho ni yoru TDEM no sanjigen modeling. 2

    Energy Technology Data Exchange (ETDEWEB)

    Noguchi, K.; Endo, M. [Waseda University, Tokyo (Japan). School of Science and Engineering

    1996-05-01

    A study was made about integral equation-assisted numerical calculation in a time domain electromagnetic (TDEM) 3D modeling. The total number of cells should be minimized now that the time required for calculation depends a great deal upon the total number of cells. On the assumption of a thin plate-like layer of anomaly in presence, with its center positioned just below the receiving point and with its entirety buried in a homogeneous 100 Ohm m medium, the correlation between the distance and the maximum cell length in the horizontal direction and the method of dividing were examined. As the result, it was found that a dividing method respecting the exponential function shortens the calculation time and that, for obtaining a true response and for minimizing the calculation time, the length of the horizontal side of the cell nearest to the transmission source needs be set to be not more than 1/2 of the distance. It was also found that the length of the side in the direction of depth of the topmost cell needs be set to be not more than approximately 1/3 of the depth of the upper surface of the plate-shaped anomaly. 2 refs., 10 figs., 2 tabs

  18. Excitations of the unstable nuclei 48Ni and 49Ni

    International Nuclear Information System (INIS)

    Kamerdzhiev, S.P.; Tselyaev, V.I.

    2002-01-01

    The isoscalar E1 and E2 resonances in the proton-rich nuclei 48,49 Ni and the {f 7/2 x3 - } multiplet in 49 Ni have been calculated taking into account the single-particle continuum exactly. The analogous calculations for the mirror nuclei 48 Ca and 49 Sc are presented. The models used are the continuum random-phase approximation (RPA) for 48 Ni, 48 Ca and the odd RPA for 49 Ni, 49 Sc, where the latter has been developed recently and describes both single particle and collective excitations of an odd nucleus on a common basis. In all four nuclei, we obtained a distinct splitting of the isoscalar E1 resonance into 1(ℎ/2π)ω and 3(ℎ/2π)ω peaks at about 11 MeV and 30 MeV, respectively. The main part of the isoscalar E1 energy-weighted sum rule (EWSR) is exhausted by the 3(ℎ/2π)ω resonances. The 1(ℎ/2π)ω resonances exhaust about 35% of this EWSR in 48,49 Ni and about 22% in 48 Ca and 49 Sc. All seven {f 7/2 x3 - } multiplet members in 49 Ni are calculated to be in the 6-8 MeV energy region and have noticeable escape widths

  19. Composite Ni/NiO-Cr2O3Catalyst for Alkaline Hydrogen Evolution Reaction.

    Science.gov (United States)

    Bates, Michael K; Jia, Qingying; Ramaswamy, Nagappan; Allen, Robert J; Mukerjee, Sanjeev

    2015-03-12

    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 NiO x and Cr 2 O 3 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/NiO x sites, the oxide acts as a sink for OH ads , 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 x content and that the Cr 2 O 3 appears to stabilize the composite NiO x component under HER conditions (where NiO x would typically be reduced to metallic Ni 0 ). Furthermore, in contrast to Pt, the Ni(O x )/Cr 2 O 3 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.

  20. Composite Ni/NiO-Cr2O3 Catalyst for Alkaline Hydrogen Evolution Reaction

    Energy Technology Data Exchange (ETDEWEB)

    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.

  1. Mathematical modeling of Fe(II), Cu(II), Ni(II) and Zn(II) removal in a horizontal rotating tubular bioreactor.

    Science.gov (United States)

    Rezić, Tonči; Zeiner, Michaela; Santek, Božidar; Novak, Srđan

    2011-11-01

    Industrial wastewaters polluted with toxic heavy metals are serious ecological and environmental problem. Therefore, in this study multi-heavy metals (Fe(2+), Cu(2+), Ni(2+) and Zn(2+)) removal process with mixed microbial culture was examined in the horizontal rotating tubular bioreactor (HRTB) by different combinations of process parameters. Hydrodynamic conditions and biomass sorption capacity have main impact on the removal efficiency of heavy metals: Fe(2+) 95.5-79.0%, Ni(2+) 92.7-54.8%, Cu(2+) 87.7-54.9% and Zn(2+) 81.8-38.1%, respectively. On the basis of experimental results, integral mathematical model of removal heavy metals in the HRTB was established. It combines hydrodynamics (mixing), mass transfer and kinetics to define bioprocess conduction in the HRTB. Mixing in the HRTB was described by structured cascade model and metal ion removal by two combined diffusion-adsorption models, respectively. For Langmuir model, average variances between experimental and simulated concentrations of metal ions were in the range of 1.22-10.99 × 10(-3) and for the Freundlich model 0.12-3.98 × 10(-3), respectively. On the basis of previous facts, it is clear that developed integral bioprocess model with Freundlich model is more efficient in the prediction of concentration of metal ions in the HRTB. Furthermore, the results obtained also pointed out that the established model is at the same time accurate and robust and therefore it has great potential for use in the scale-up procedure.

  2. Statistical physics modeling of hydrogen desorption from LaNi{sub 4.75}Fe{sub 0.25}: Stereographic and energetic interpretations

    Energy Technology Data Exchange (ETDEWEB)

    Wjihi, Sarra [Unité de Recherche de Physique Quantique, 11 ES 54, Faculté des Science de Monastir (Tunisia); Dhaou, Houcine [Laboratoire des Etudes des Systèmes Thermiques et Energétiques (LESTE), ENIM, Route de Kairouan, 5019 Monastir (Tunisia); Yahia, Manel Ben; Knani, Salah [Unité de Recherche de Physique Quantique, 11 ES 54, Faculté des Science de Monastir (Tunisia); Jemni, Abdelmajid [Laboratoire des Etudes des Systèmes Thermiques et Energétiques (LESTE), ENIM, Route de Kairouan, 5019 Monastir (Tunisia); Lamine, Abdelmottaleb Ben, E-mail: abdelmottaleb.benlamine@gmail.com [Unité de Recherche de Physique Quantique, 11 ES 54, Faculté des Science de Monastir (Tunisia)

    2015-12-15

    Statistical physics treatment is used to study the desorption of hydrogen on LaNi{sub 4.75}Fe{sub 0.25}, in order to obtain new physicochemical interpretations at the molecular level. Experimental desorption isotherms of hydrogen on LaNi{sub 4.75}Fe{sub 0.25} are fitted at three temperatures (293 K, 303 K and 313 K), using a monolayer desorption model. Six parameters of the model are fitted, namely the number of molecules per site n{sub α} and n{sub β}, the receptor site densities N{sub αM} and N{sub βM}, and the energetic parameters P{sub α} and P{sub β}. The behaviors of these parameters are discussed in relationship with desorption process. A dynamic study of the α and β phases in the desorption process was then carried out. Finally, the different thermodynamical potential functions are derived by statistical physics calculations from our adopted model.

  3. Preparation of one-step NiO/Ni-CGO composites using factorial design

    International Nuclear Information System (INIS)

    Araujo, A.J.M. de; Sousa, A R.O. de; Camposa, L.F.A.; Macedo, D.A.; Loureiro, F. J.A.; Fagg, D.P.

    2016-01-01

    This work deals with the synthesis, processing and characterization of NiO/Ni- CGO composite materials as potential solid oxide fuel cell (SOFC) anodes. The particulate materials were obtained by a one-step synthesis method and characterized by thermal analysis (prior to calcination) and X-ray diffraction (calcined powder). The ceramic processing of samples containing from 30 to 70 wt.% NiO was carried out by factorial design. Besides the NiO content controlled during the chemical synthesis, the impacts of the pore-former content (citric acid, used in proportions of 0, 7.5 and 15 wt.%) and the sintering temperature (1300, 1350 and 1400 °C) were also investigated. The open porosity of NiO-CGO composites and reduced Ni-CGO cermets was modeled as a function of factors (NiO content, citric acid content and sintering temperature) and interaction of factors. (author)

  4. Temperature dependent forward current-voltage characteristics of Ni/Au Schottky contacts on AlGaN/GaN heterostructures described by a two diodes model

    Science.gov (United States)

    Greco, Giuseppe; Giannazzo, Filippo; Roccaforte, Fabrizio

    2017-01-01

    This paper reports on the temperature dependence of Ni/Au Schottky contacts on AlGaN/GaN heterostructures. The electrical properties of the Schottky barrier were monitored by means of forward current-voltage (I-V) measurements, while capacitance-voltage measurements were used to determine the properties of the two dimensional electron gas. The forward I-V characteristics of Schottky diodes revealed a strong deviation from the ideal behavior, which could not be explained by a standard thermionic emission model. Thus, the Ni/AlGaN/GaN system has been described by a "two diode model," considering the presence of a second barrier height at the AlGaN/GaN heterojunction. Following this approach, the anomalous I-V curves could be explained and the value of the flat-band barrier height (at zero-electric field) could be correctly determined, thus resulting in good agreement with literature data based on photoemission measurements.

  5. Experimental and numerical investigations of the failure behaviour of 15NiCuMoNb5 pipes by usage of fracture and damage mechanics concepts. Pt. 2. Modellization of failure by damage models

    International Nuclear Information System (INIS)

    Klingbeil, D.; Kiyak, Y.

    1999-01-01

    The 4-point bending tests carried out with pipes made of 15NiCuMoNb5 with outer 90 circumferential flaw were simulated using the FE method and a damage model for including the process of ductile crack growth. It could be shown that the input data for geometry of the pipes and bearings must be very exact, so as to enable correct description and consideration of the measured forces and displacements in the numerical analysis. (orig./CB) [de

  6. Exclusive study of Ni+Ni and Ni+Au central collisions: phase coexistence and spinodal decomposition; Etude exclusive des collisions centrales Ni+Ni et Ni+Au: coexistence de phase et decomposition spinodale

    Energy Technology Data Exchange (ETDEWEB)

    Guiot, B

    2002-12-01

    The INDRA multidetector allowed us to study the Ni+Ni collisions at 32A MeV and the Ni+Au collisions at 52,4 MeV. Central collisions leading to 'quasi-fused' systems were isolated using multidimensional analysis techniques: the Discriminant Analysis and the Principal Component Analysis. Comparison with a statistical model shows that the selected events are compatible with thermodynamical equilibrium. The average thermal excitation energy is 5A MeV for both systems. Calculations of heat capacities show that the deexcitation of the hot sources are akin to a liquid-gas phase transition of nuclear matter. Indeed heat capacities exhibit a negative branch as expected for a phase transition of a finite system. The dynamics of this phase transition has been investigated by applying the charge correlation method. An enhanced production of events with equal-sized fragments has been evidenced for Ni+Au at 52A MeV. No signal was found for Ni+Ni at 32A MeV. Finally this method was improved by taking into account the total charge conservation. The signal is seen more clearly for Ni+Au at 52A MeV, but is ambiguous for Ni+Ni at 32A MeV. The path followed in the state diagram, or the involved time scales, seem to be different for these systems. (authors)

  7. Model bimetallic Pd-Ni automotive exhaust catalysts. Influence of thermal aging and hydrocarbon self-poisoning

    Energy Technology Data Exchange (ETDEWEB)

    Hungria, A.B.; Martinez-Arias, A. [Instituto de Catalisis y Petroleoquimica, CSIC, C/Marie Curie 2, Campus Cantoblanco, 28049 Madrid (Spain); Calvino, J.J. [Dpto. de Ciencia de los Materiales e Ingenieria Metalurgica y Quimica Inorganica, Facultad de Ciencias, Universidad de Cadiz, 11510 Puerto Real, Cadiz (Spain); Anderson, J.A. [Surface Chemistry and Catalysis Group, Department of Chemistry, University of Aberdeen, AB24 3UE Scotland (United Kingdom)

    2006-02-22

    Bimetallic Pd-Ni catalysts supported on Al{sub 2}O{sub 3} and (Ce,Zr)O{sub x}/Al{sub 2}O{sub 3} were examined with respect to their catalytic performance for the elimination of CO, NO and C{sub 3}H{sub 6} under stoichiometric conditions. The effects of a thermal aging treatment at 1273K, reactant competition in the presence of the hydrocarbon and the influence of the presence of nickel in the catalyst have been analysed by XRD, HREM, catalytic activity measurements and in situ DRIFTS spectroscopy. Self-poisoning effects, induced by the presence of the hydrocarbon in the reactant mixture, were identified as the main factor affecting the light-off activity. While a Ni-induced preferential interaction between Pd and the Ce-Zr mixed oxide component appears, in general terms, to be beneficial for the catalytic performance of the fresh (Ce,Zr)O{sub x}/Al{sub 2}O{sub 3}-supported bimetallic catalyst, it is shown to be detrimental for the aged system as a consequence of a facilitated degradation of the (Ce,Zr)O{sub x} component and encapsulation of the active palladium particles. (author)

  8. Exclusive study of Ni+Ni and Ni+Au central collisions: phase coexistence and spinodal decomposition

    International Nuclear Information System (INIS)

    Guiot, B.

    2002-12-01

    The INDRA multidetector allowed us to study the Ni+Ni collisions at 32A MeV and the Ni+Au collisions at 52,4 MeV. Central collisions leading to 'quasi-fused' systems were isolated using multidimensional analysis techniques: the Discriminant Analysis and the Principal Component Analysis. Comparison with a statistical model shows that the selected events are compatible with thermodynamical equilibrium. The average thermal excitation energy is 5A MeV for both systems. Calculations of heat capacities show that the deexcitation of the hot sources are akin to a liquid-gas phase transition of nuclear matter. Indeed heat capacities exhibit a negative branch as expected for a phase transition of a finite system. The dynamics of this phase transition has been investigated by applying the charge correlation method. An enhanced production of events with equal-sized fragments has been evidenced for Ni+Au at 52A MeV. No signal was found for Ni+Ni at 32A MeV. Finally this method was improved by taking into account the total charge conservation. The signal is seen more clearly for Ni+Au at 52A MeV, but is ambiguous for Ni+Ni at 32A MeV. The path followed in the state diagram, or the involved time scales, seem to be different for these systems. (authors)

  9. Nitriding behavior of Ni and Ni-based binary alloys

    Energy Technology Data Exchange (ETDEWEB)

    Fonovic, Matej

    2015-01-15

    precipitate-free microstructure known as expanded austenite or S-phase, which can enhance surface hardness, fatigue properties and corrosion properties.Nitriding of multicomponent Ni-based alloys is usually applied in the industry. Nevertheless, the understanding of nitriding is mostly based on phenomenological research and experience. Thereby there is still absence of complete understanding of nitriding of Ni-based alloys, which requires further detailed investigations. Since studying the nitrided multicomponent alloys is complicated, in this thesis fundamental investigations were performed on pure nickel and binary Ni-based model alloys.This thesis focuses on the nitriding behavior of pure nickel, which will result with an thermodynamic evaluation of the Ni-N system. Furthermore, deeper insights in the nitriding behavior of the binary Ni-based alloys is obtained upon nitriding Ni-4 wt.% Ti and Ni-2 wt.% Ti (Ni-5 at.% Ti and Ni-2.5 at.% Ti) alloys. Thereby, the development of large residual macrostresses parallel to the surface of the specimen is related with the N concentration gradient in the nitrided zone.

  10. Characterization and modeling of the magnetic field-induced strain and work output in Ni2MnGa magnetic shape memory alloys

    International Nuclear Information System (INIS)

    Kiefer, B.; Karaca, H.E.; Lagoudas, D.C.; Karaman, I.

    2007-01-01

    This paper is concerned with the experimental characterization and the constitutive modeling of magnetic shape memory alloys (MSMA), in terms of their applicability as actuator materials. The key properties that determine the actuation characteristics are the magnetic field-induced strain (MFIS) and the blocking stress. With the goal of increasing the corresponding actuation output, a material selection strategy was followed which was aimed at obtaining a higher magnetocrystalline anisotropy energy, while keeping the detwinning stress low. This was achieved by choosing a composition in which the separation of the Curie temperature and the martensitic transformation temperatures was large, and then selecting an operating temperature just below the phase transformation temperature. In the selected Ni 51.1 Mn 24.0 Ga 24.9 composition a more than 50% increase of the actuation work output was observed, compared to corresponding data reported in the literature for other off-stoichiometric compositions of the Ni 2 MnGa intermetallic compound. The second part of the paper describes a phenomenological constitutive model that predicts the MFIS hysteresis curves observed in the first part. The model is concerned with the field-induced reorientation of martensitic variants and changes in the magnetic microstructure. Dissipative effects are captured by introducing internal state variables into the free energy function. In its most general form the contributing energy terms are the elastic strain energy, the Zeeman energy, the magnetocrystalline anisotropy energy and appropriate mixing terms. Typical loading cases are considered and the accuracy of the model predictions is evaluated by comparison with the experimental data presented in the first part of this work

  11. A macroscopic constitutive model of temperature-induced phase transition of polycrystalline Ni{sub 2}MnGa by directional solidification

    Energy Technology Data Exchange (ETDEWEB)

    Zhu, Yuping, E-mail: zhuyuping@126.com; Gu, Yunling; Liu, Hongguang

    2015-02-25

    Directional solidification technology has been widely used to improve the properties of polycrystalline Ni{sub 2}MnGa materials. Mechanical training can adjust the internal organizational structures of the materials, reduce the stress of twin boundaries motion, and then result in larger strain at lower outfield levels. In this paper, we test the microscopic structure of Ni{sub 2}MnGa polycrystalline ferromagnetic shape memory alloy produced by directional solidification and compress it along two axes successively for mechanical training. The influences of pre-compressive stresses on the temperature-induced strains are analyzed. The macroscopic mechanical behaviors show anisotropy. According to the generating mechanism of the macroscopic strain, a three-dimensional constitutive model is established. Based on thermodynamic method, the kinetic equations of the martensitic transformation and inverse transformation are presented considering the driving force and energy dissipation. The prediction curves of temperature-induce strains along two different directions are investigated. And the results coincide well with the experiment data. It well explains the macroscopic anisotropy mechanical behaviors and fits for using in engineering.

  12. Synaptic long-term potentiation realized in Pavlov's dog model based on a NiOx-based memristor

    Science.gov (United States)

    Hu, S. G.; Liu, Y.; Liu, Z.; Chen, T. P.; Yu, Q.; Deng, L. J.; Yin, Y.; Hosaka, Sumio

    2014-12-01

    Synaptic Long-Term Potentiation (LTP), which is a long-lasting enhancement in signal transmission between neurons, is widely considered as the major cellular mechanism during learning and memorization. In this work, a NiOx-based memristor is found to be able to emulate the synaptic LTP. Electrical conductance of the memristor is increased by electrical pulse stimulation and then spontaneously decays towards its initial state, which resembles the synaptic LTP. The lasting time of the LTP in the memristor can be estimated with the relaxation equation, which well describes the conductance decay behavior. The LTP effect of the memristor has a dependence on the stimulation parameters, including pulse height, width, interval, and number of pulses. An artificial network consisting of three neurons and two synapses is constructed to demonstrate the associative learning and LTP behavior in extinction of association in Pavlov's dog experiment.

  13. First-principles modeling of interfaces between solids with large lattice mismatch: The prototypical CoO(111)/Ni(111) interface

    KAUST Repository

    Grytsiuk, Sergii

    2012-11-28

    In this work we investigate the CoO(111)/Ni(111) interface by first-principles calculations, focusing on its structure and stability. To satisfy the approximate 5:6 ratio of the CoO and Ni lattice constants, we construct a supercell with 5×5 Co (O) and 6×6 Ni atoms per layer in the bulk regions. For the interface Ni layer and the adjacent Ni layer we consider different configurations and study the binding energy. We show for an ideal CoO interface terminated by 5×5 O atoms that the structure is more stable if there are 5×5 Ni atoms next to it instead of 6×6 as in the bulk. In addition, we observe that a transition layer with 31 or 33 Ni atoms located between the interface 5×5 Ni and bulk 6×6 Ni layers (which partially reflects the structures of both these layers) enhances the stability of the CoO/Ni interface. The electronic and magnetic modifications induced by the interface formation are discussed.

  14. Adsorption of Cs+, Ni2+ and lanthanides onto a kaolinite and Na-montmorillonite up to 1500C: an experimental and modeling study

    International Nuclear Information System (INIS)

    Tertre, E.

    2005-10-01

    The motivation for this study is to assess the temperature effect on the clay minerals sorption properties. Sorption and desorption of Cs + , Ni 2+ et Ln 3+ onto a montmorillonite and a kaolinite were performed by batch experiments between 25 and 150 C, and in different pH and ionic strengths conditions. Sorption enthalpies varying between 0 and 80 kJ/mol were then calculated. For europium, surface spectroscopic analyses confirmed that the mechanism involved is adsorption, including at 150 C. Moreover, this method allowed us to obtain qualitatively the different adsorption equilibrium occurring during the reaction. An acid/base study of the clay surfaces was performed in order to assess the temperature effect on the surface charge of these minerals. Then, a surface complexation model including edge sites and structural sites was proposed to interpret the acid/base data and the europium sorption data. (author)

  15. Effects of Rhenium Addition on the Temporal Evolution of the Nanostructure and Chemistry of a Model Ni-Cr-Al Superalloy. 1; Experimental Observations

    Science.gov (United States)

    Yoon, Kevin E.; Noebe, Ronald D.; Seidman, David N.

    2006-01-01

    The temporal evolution of the nanostructure and chemistry of a model Ni-8.5 at.% Cr-10 at. % Al alloy, with the addition of 2 at.% Re, aged at 1073 K from 0.25 to 264 h, was studied. Transmission electron microscopy and atom-probe tomography were used to measure the number density and mean radius of the gamma prime (L1(sub 2) structure)-precipitates and the chemistry of the gamma prime-precipitates and the gamma (face-centered cubic)-matrix, including the partitioning behavior of all alloying elements between the gamma- and gamma prime-phases and the segregation behavior at gamma/gamma prime interfaces. The precipitates remained spheroidal for an aging time of up to 264 h and, unlike commercial nickel-based superalloys containing Re, there was not confined (nonmonotonic) Re segregation at the gamma/gamma prime interfaces.

  16. Asymmetry of inter-El Niño and -La Niña diversity

    Science.gov (United States)

    Kim, S.; Kug, J. S.

    2016-12-01

    Over the North Pacific, there is a distinctive asymmetry of inter-El Niño and -La Niña diversity in atmospheric teleconnection patterns, indicating a strong diversity during La Niña events. Recent studies suggested that the typical patterns of the extratopical teleconnections associated with El Niño-Southern Oscillation (ENSO) are predominantly explained by the relative roles of the equatorial central Pacific (CP) and western North Pacific (WNP) precipitation anomalies. We find that the diversity of WNP precipitation anomalies is greater during La Niña events than during El Niño events. It also implies that the diversity of WNP precipitation anomalies during La Niña events is responsible for the diversity in the extratropical teleconnection. Since the relationship of anomalous sea surface temperature (SST) to precipitation is quite sensitive for SST in the range of 27-28°C, the WNP precipitation differences located over the warm pool among La Niña events lead to considerable teleconnection changes. In addition, we find here that the CMIP5 models well simulate the overall diversity in the tropical precipitation and extratropical teleconnection patterns during La Niña events, but it fails to reproduce a detailed pattern difference of atmospheric teleconnection in inter-La Niña events.

  17. [NiFe] hydrogenase structural and functional models: new bio-inspired catalysts for hydrogen evolution; Modeles structuraux et fonctionnels du site actif des hydrogenases [NiFe]: de nouveaux catalyseurs bio-inspires pour la production d'hydrogene

    Energy Technology Data Exchange (ETDEWEB)

    Oudart, Y

    2006-09-15

    Hydrogenase enzymes reversibly catalyze the oxidation and production of hydrogen in a range close to the thermodynamic potential. The [NiFe] hydrogenase active site contains an iron-cyano-carbonyl moiety linked to a nickel atom which is in an all sulphur environment. Both the active site originality and the potential development of an hydrogen economy make the synthesis of functional and structural models worthy. To take up this challenge, we have synthesised mononuclear ruthenium models and more importantly, nickel-ruthenium complexes, mimicking some structural features of the [NiFe] hydrogenase active site. Ruthenium is indeed isoelectronic to iron and some of its complexes are well-known to bear hydrides. The compounds described in this study have been well characterised and their activity in proton reduction has been successfully tested. Most of them are able to catalyze this reaction though their electrocatalytic potentials remain much more negative compared to which of platinum. The studied parameters point out the importance of the complexes electron richness, especially of the nickel environment. Furthermore, the proton reduction activity is stable for several hours at good rates. The ruthenium environment seems important for this stability. Altogether, these compounds represent the very first catalytically active [NiFe] hydrogenase models. Important additional results of this study are the synergetic behaviour of the two metals in protons reduction and the evidence of a protonation step as the limiting step of the catalytic cycle. We have also shown that a basic site close to ruthenium improves the electrocatalytic potential of the complexes. (author)

  18. Synthesis and characterization of Ni(III)N3S2 complexes as active site models for the oxidized form of nickel superoxide dismutase.

    Science.gov (United States)

    Chiang, Chien-Wei; Chu, Yun-Li; Chen, Hong-Ling; Kuo, Ting-Shen; Lee, Way-Zen

    2014-05-19

    Nickel complexes, [Ni(H2BA(R)TPP)](ClO4)2 (R = Ph for 1 or iPr for 2), supported by a pentadentate ligand H2BA(R)TPP were synthesized and oxidized to form Ni(III) species having a N3S2 coordination environment to mimic the active site of the oxidized form of nickel superoxide dismutase (NiSODox). The Ni(III) species 2(+) exhibited a rhombic signal with g values at 2.15, 2.12 and 2.02 similar to that of NiSODox. DFT calculations revealed that 2(+) has an unpaired electron primarily located in the dz2 orbital of the Ni(III) center, which strongly overlaps with the pz orbital of the axial pyridine nitrogen of H2BA(Pr)TPP. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. Composite Ni/NiO-Cr2O3 Catalyst for Alkaline Hydrogen Evolution Reaction

    Science.gov (United States)

    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

  20. Continuum mechanics simulations of NiO/Ni-YSZ composites during reduction and re-oxidation

    DEFF Research Database (Denmark)

    Pihlatie, Mikko; Frandsen, Henrik Lund; Kaiser, Andreas

    2010-01-01

    Repeated reduction–oxidation (redox) cycles on Ni-based solid oxide fuel cells (SOFC) have been experimentally well investigated and are known to be detrimental to the thermomechanical stability of the composites, especially on anode supported structures. In the present work the mechanistic...... for the dimensional change arises from the volumetric change related to the phase change NiO ↔ Ni. The measurable change in bulk length is given by the ceramic YSZ backbone as a response to the stress created by the chemical strain. The different subprocesses described in the model for YSZ were elastic and anelastic...... expansion, diffusional creep, grain boundary sliding (GBS) and microcracking due to excessive stress. In the Ni/NiO phase, nonelastic strains in terms of diffusional and power law creep were implemented, and additionally for NiO deformation due to microcracking and/or pseudoplasticity. Semi...

  1. The magnetic moment of Ni in the Laves phase compound GdNi2

    International Nuclear Information System (INIS)

    Yano, Kazuo; Umehara, Izuru; Miyazawa, Tomoaki; Adachi, Yoshiya; Sato, Kiyoo

    2005-01-01

    Magnetization and inverse susceptibility of the Laves phase compound GdNi 2 were investigated and analyzed in detail by employing molecular-field analysis. Both the temperature dependence of the magnetization and the Curie-Weiss (C-W) law-like linear relationship of inverse susceptibility are reproduced in terms of a two-sublattice model and it is seen that the magnetic structure of GdNi 2 is ferrimagnetic and Ni in GdNi 2 retains a magnetic moment of about 0.24μ B

  2. An Analysis of Interannual Variabilities in High Cloud Cover from AIRS Data: Imprints of the El Niño-Southern Oscillation and Comparison to Models

    Science.gov (United States)

    Yung, Y. L.; Antilla, K.; Mak, S. N.; Chang, T. M.; Li, K. F.; Su, H.; Wong, S.; Jiang, J. H.

    2014-12-01

    Using data from the Atmospheric Infrared Sounder (AIRS), we examine how global high cloud cover varies over time in the decade from 2003 to 2012, with a focus on identifying dominant modes of variabilities and associated spatial patterns, and relate them to sea surface temperature (SST). By performing Empirical Orthogonal Function (EOF) analysis on satellite observations of high cloud cover, the El Niño-Southern Oscillation (ENSO) — including both EP-ENSO (canonical ENSO) and CP-ENSO (ENSO Modoki) — is found to be the leading source of variability in high cloud cover. High cloud distributions are further shown to be closely associated with SST variations. The observations are compared to simulations from 20 AMIP5 models. In general, the models are able to simulate the first EOF, the EP-ENSO, in the data. However, only about half of the AMIP5 models could realistically reproduce the second EOF, the CP-ENSO. Improved understanding of high cloud variabilities will advance climate model simulations and facilitate more accurate predictions of future climate, specifically the climate response to increasing greenhouse gases such as CO2.

  3. Hydrotreatment of solvolytically liquefied lignocellulosic biomass over NiMo/Al2O3 catalyst: Reaction mechanism, hydrodeoxygenation kinetics and mass transfer model based on FTIR

    International Nuclear Information System (INIS)

    Grilc, M.; Likozar, B.; Levec, J.

    2014-01-01

    Raw residual wood biomass, containing cellulose, hemicellulose and lignin, was liquefied at low temperature by ultrasound-assisted solvolysis and acidolysis by glycerol, diethylene glycol and p-toluenesulfonic acid. Liquefied biomass was consequently upgraded by hydrotreatment utilizing heterogeneous catalysis over NiMo/Al 2 O 3 bifunctional catalyst. Effects of temperature (200−350 °C), heating rate (2.5–10.0 K min −1 ), hydrogen/nitrogen pressure (2−8 MPa), mixing (250−1000 min −1 ), hydrogen donor solvent (tetralin) and catalyst contents on deoxygenation were established. Reactions of liquefaction products, such as levulinic acid, were quantified based on their functional groups by Fourier transform infrared spectroscopy, whereas catalyst was examined by scanning electron microscopy, energy-dispersive X-ray spectroscopy (EDX) and X-ray diffraction analysis (XRD). Chemical kinetics of hydrodeoxygenation (HDO), decarbonylation and decarboxylation were determined by originally developed lumped model, based on reaction mechanisms and pathways, while the external mass transfer resistance proved to be negligible under the applied hydrodynamic conditions. The presence of hydrocracking reactions was confirmed by a decrease in product viscosity, and the upgrade for energetic or fuel applications by measurements of calorific value. - Highlights: • Liquefaction of waste lignocellulosic biomass with glycerol at low temperature. • Hydrotreatment, hydrocracking and hydrodeoxygenation of liquefied waste biomass. • Deoxygenation using heterogeneous catalysis over NiMo/Al 2 O 3 bifunctional catalyst. • Proposal of reaction mechanism; chemical kinetics and mass transfer considerations. • Effect of temperature, heating rate, pressure, mixing, solvent and catalyst content

  4. Three-dimensional deformation response of a NiTi shape memory helical-coil actuator during thermomechanical cycling: experimentally validated numerical model

    Science.gov (United States)

    Dhakal, B.; Nicholson, D. E.; Saleeb, A. F.; Padula, S. A., II; Vaidyanathan, R.

    2016-09-01

    Shape memory alloy (SMA) actuators often operate under a complex state of stress for an extended number of thermomechanical cycles in many aerospace and engineering applications. Hence, it becomes important to account for multi-axial stress states and deformation characteristics (which evolve with thermomechanical cycling) when calibrating any SMA model for implementation in large-scale simulation of actuators. To this end, the present work is focused on the experimental validation of an SMA model calibrated for the transient and cyclic evolutionary behavior of shape memory Ni49.9Ti50.1, for the actuation of axially loaded helical-coil springs. The approach requires both experimental and computational aspects to appropriately assess the thermomechanical response of these multi-dimensional structures. As such, an instrumented and controlled experimental setup was assembled to obtain temperature, torque, degree of twist and extension, while controlling end constraints during heating and cooling of an SMA spring under a constant externally applied axial load. The computational component assesses the capabilities of a general, multi-axial, SMA material-modeling framework, calibrated for Ni49.9Ti50.1 with regard to its usefulness in the simulation of SMA helical-coil spring actuators. Axial extension, being the primary response, was examined on an axially-loaded spring with multiple active coils. Two different conditions of end boundary constraint were investigated in both the numerical simulations as well as the validation experiments: Case (1) where the loading end is restrained against twist (and the resulting torque measured as the secondary response) and Case (2) where the loading end is free to twist (and the degree of twist measured as the secondary response). The present study focuses on the transient and evolutionary response associated with the initial isothermal loading and the subsequent thermal cycles under applied constant axial load. The experimental

  5. Computational modelling of Ti50Pt50-xMx shape memory alloys (M: Ni, Ir or Pd and x = 6.25-43.75 at.%)

    CSIR Research Space (South Africa)

    Modiba, Rosinah M

    2017-09-01

    Full Text Available The ab initio density functional theory approach was employed to study the effect of Ni, Ir or Pd addition to the TiPt shape memory alloy. The supercell approach in VASP was used to substitute Pt with 6.25, 18.75, 25.00, 31.25 and 43.75 at.% Ni, Ir...

  6. A climate model study of an intense Asian Monsoon in a La Niña-like climate of MIS-13

    Science.gov (United States)

    Karami, M. P.; Berger, A.; Herold, N.; Yin, Q. Z.

    2012-04-01

    Studying the paleo-monsoon during past interglacials is a valuable approach to improve our understanding of the monsoon system in present-day and future climates. We focus on Marine Isotopic stage 13 (MIS-13; ~0.5 Ma) which was a relatively cool interglacial, but with a paradoxically intense monsoonal precipitation over eastern and southern Asia. Our main goal is to understand the physics-based mechanism driving the intense monsoon, specifically the East Asian Summer Monsoon (EASM), during MIS-13. We applied both an intermediate complexity model (LOVECLIM) as well as fully coupled general circulation models (HadCM3 and CCSM3) to simulate pre-industrial and MIS-13 climates. The boundary conditions for MIS-13 were chosen for 506 ka with Northern-Hemisphere (NH) summer at perihelion and a CO2 concentration of 240 ppm. For pre-industrial, NH-winter occurring at perihelion and a CO2 concentration of 280 ppm were prescribed. Preliminary analysis of the model results shows different atmospheric and oceanic features in MIS-13 compared to the pre-industrial which could affect the EASM. The Northern Pacific Subtropical High (NPSH), which is an important factor in controlling the EASM, strengthened and extended to the northwest in MIS-13 partially due to cooling of the central Pacific Ocean. This in turn brought more moisture from the Central Pacific to the EASM-region and caused a northwestward shift and bending of the low-level jet along East Asia. The change in the low-level jet subsequently increased the meridional wind velocity at 850 mbar in the EASM-region providing more moisture from the tropical Pacific and Indian Oceans. In addition, higher sea-surface temperature in the Indian Ocean during MIS-13 further increased the source of moisture for the EASM. The Asian low, which is another component of the EASM-system, also shifted eastward moving the rain band northward. Moreover, it was found that MIS-13 had a dominant La Niña condition in the tropical Pacific. La Ni

  7. Improving the long-lead predictability of El Niño using a novel forecasting scheme based on a dynamic components model

    Science.gov (United States)

    Petrova, Desislava; Koopman, Siem Jan; Ballester, Joan; Rodó, Xavier

    2017-02-01

    El Niño (EN) is a dominant feature of climate variability on inter-annual time scales driving changes in the climate throughout the globe, and having wide-spread natural and socio-economic consequences. In this sense, its forecast is an important task, and predictions are issued on a regular basis by a wide array of prediction schemes and climate centres around the world. This study explores a novel method for EN forecasting. In the state-of-the-art the advantageous statistical technique of unobserved components time series modeling, also known as structural time series modeling, has not been applied. Therefore, we have developed such a model where the statistical analysis, including parameter estimation and forecasting, is based on state space methods, and includes the celebrated Kalman filter. The distinguishing feature of this dynamic model is the decomposition of a time series into a range of stochastically time-varying components such as level (or trend), seasonal, cycles of different frequencies, irregular, and regression effects incorporated as explanatory covariates. These components are modeled separately and ultimately combined in a single forecasting scheme. Customary statistical models for EN prediction essentially use SST and wind stress in the equatorial Pacific. In addition to these, we introduce a new domain of regression variables accounting for the state of the subsurface ocean temperature in the western and central equatorial Pacific, motivated by our analysis, as well as by recent and classical research, showing that subsurface processes and heat accumulation there are fundamental for the genesis of EN. An important feature of the scheme is that different regression predictors are used at different lead months, thus capturing the dynamical evolution of the system and rendering more efficient forecasts. The new model has been tested with the prediction of all warm events that occurred in the period 1996-2015. Retrospective forecasts of these

  8. Experimental consideration on the contact resistance caused by the distribution of contact spots with the contact model using electrolyte bath; Denkai yokuso wo mochiita sesshoku model ni yoru sesshokuten no bunpu to sesshoku teiko tokusei ni kansuru jikkenteki kosatsu

    Energy Technology Data Exchange (ETDEWEB)

    Aichi, H. [Daido Institute of Technology, Aichi (Japan); Miyachi, I. [Aichi Institute of Technology, Aichi (Japan)

    1996-09-20

    Electric contact members are classified by the form such as a point, a line, and a plane. Particularly, the point contact member which makes a small circular contact spot is basis of the contact form. Also, the plane contact member will make many contact spots which are different in size and distributing over the contacting portion. Authors have been developing the contact model to measure the contact resistance. In this model, it is available to select the size, the number, and the arrangement of contact spots by the macroscopical contact spots which are formed with some metal electrodes arranged in electrolyte solution of dilute sulfuric acid. In this paper, the fundamental characteristics of the contact resistance caused by the construction of current are investigated with 1 to 3 contact spot models. Then the relations between the contact resistance and the distribution of the contact spots are examined with 2 to 9 multi-contact spot models. As the results, it is cleared that the proposed contact model presents the successful experimental method for the analysis of the contact resistance. 9 refs., 8 tabs.

  9. Considerations on FEM modeling in analyzing buckling and plastic collapse of a detection control; Boto panel no zakutsu sosei hokai kaiseki ni okeru FEM model ka ni kansuru kosatsu

    Energy Technology Data Exchange (ETDEWEB)

    Yao, T.; Fujikubo, M.; Yanagihara, D.; Irisawa, M. [Hiroshima University, Hiroshima (Japan). Faculty of Engineering

    1997-10-01

    Buckling and plastic collapse of upper decks and bottom outer plates of a hull results directly in longitudinal bending collapse of the hull. Therefore, discussions were given on analysis for pressure destruction strength of a detection control panel which assumes an upper deck and a bottom outer plate. Pressure destruction behavior of the panting panel is a complex phenomenon accompanying non-linearity and geometrical non-linearity of the materials. Its whole phenomenon may be analyzed by using the finite element method (FEM) as a principle, but the analysis is not efficient. Therefore, considerations were given in relation to modeling when using the FEM. The considerations were given on a panel attached with flat steel panting members with respect to the modeling scope which considers the buckling mode according to the aspect ratio of the panel partitioned by the deflection control members. If the local buckling mode of the panel is an even number wave mode in the longitudinal direction, a triple span model is required. A modeling scope for a case of being subjected to water pressure and in-plane compression was considered on a panel attached with angle-type steel members having non-symmetric cross section. In this case, a triple bay model is more preferable to reproduce the behavior under water pressure loading. 1 ref., 6 figs.

  10. Advances in Electrochemical Models for Predicting the Cycling Performance of Traction Batteries: Experimental Study on Ni-MH and Simulation Développement de modèles électrochimiques de batteries de traction pour la prédiction de performances : étude expérimentale de batteries NiMH et simulations

    Directory of Open Access Journals (Sweden)

    Bernard J.

    2009-11-01

    Full Text Available Rigorous electrochemical models to simulate the cycling performance of batteries have been successfully developed and reported in the literature. They constitute a very promising approach for State-of-Charge (SoC estimation based on the physics of the cell with regards to other methods since SoC is an internal parameter of these physical models. However, the computational time needed to solve electrochemical battery models for online applications requires to develop a simplified physics-based battery model. In this work, our goal is to present and validate an advanced 0D-electrochemical model of a Ni-MH cell, as an example. This lumped-parameter model will be used to design an extended Kalman filter to predict the SoC of a Ni-MH pack. It is presented, followed by an extensive experimental study conducted on Ni-MH cells to better understand the mechanisms of physico-chemical phenomena occurring at both electrodes and support the model development. The last part of the paper focuses on the evaluation of the model with regards to experimental results obtained on Ni-MH sealed cells but also on the related commercial HEV battery pack. Des modèles électrochimiques fins permettant de simuler le comportement de batteries ont été développés avec succès et reportés dans la littérature. Ils constituent une alternative aux méthodes classiques pour estimer l’état de charge (SoC pour State of Charge des batteries, cette variable étant ici un paramètre interne du modèle physique. Cependant, pour les applications embarquées, il est nécessaire de développer des modèles simplifiés sur la base de ces modèles physiques afin de diminuer le temps de calcul nécessaire à la résolution des équations. Ici, nous présenterons à titre d’exemple un modèle électrochimique 0D avancé d’un accumulateur NiMH et sa validation. Ce modèle à paramètres concentrés sera utilisé pour réaliser un filtre de Kalman qui permettra la prédiction de l

  11. Electron energy-loss spectroscopy study of NiTi shape memory alloys

    International Nuclear Information System (INIS)

    Yang, Z.Q.; Schryvers, D.

    2008-01-01

    Electron energy loss spectroscopy (EELS) investigations were carried out on NiTi shape memory alloys. The composition of lens-shaped precipitates is determined to be Ni 4 Ti 3 by model-based EELS quantification, and the Ni-depleted zone in the B2 matrix surrounding the Ni 4 Ti 3 precipitates was quantified. The Young's modulus Y m of the B2 matrix with 51 at.% Ni and the Ni 4 Ti 3 precipitates was evaluated to be about 124 and 175 GPa, respectively. The intensity of the Ni L 3 edge for the precipitate is slightly higher than that for the B2 phase

  12. Phase-Field Modeling of Sigma-Phase Precipitation in 25Cr7Ni4Mo Duplex Stainless Steel

    Science.gov (United States)

    Malik, Amer; Odqvist, Joakim; Höglund, Lars; Hertzman, Staffan; Ågren, John

    2017-10-01

    Phase-field modeling is used to simulate the formation of sigma phase in a model alloy mimicking a commercial super duplex stainless steel (SDSS) alloy, in order to study precipitation and growth of sigma phase under linear continuous cooling. The so-called Warren-Boettinger-McFadden (WBM) model is used to build the basis of the multiphase and multicomponent phase-field model. The thermodynamic inconsistency at the multiple junctions associated with the multiphase formulation of the WBM model is resolved by means of a numerical Cut-off algorithm. To make realistic simulations, all the kinetic and the thermodynamic quantities are derived from the CALPHAD databases at each numerical time step, using Thermo-Calc and TQ-Interface. The credibility of the phase-field model is verified by comparing the results from the phase-field simulations with the corresponding DICTRA simulations and also with the empirical data. 2D phase-field simulations are performed for three different cooling rates in two different initial microstructures. A simple model for the nucleation of sigma phase is also implemented in the first case. Simulation results show that the precipitation of sigma phase is characterized by the accumulation of Cr and Mo at the austenite-ferrite and the ferrite-ferrite boundaries. Moreover, it is observed that a slow cooling rate promotes the growth of sigma phase, while a higher cooling rate restricts it, eventually preserving the duplex structure in the SDSS alloy. Results from the phase-field simulations are also compared quantitatively with the experiments, performed on a commercial 2507 SDSS alloy. It is found that overall, the predicted morphological features of the transformation and the composition profiles show good conformity with the empirical data.

  13. Three-dimensional magnetotelluric modeling using SLDM method; Supekutoru bunkai wo fukashita ranchosu process ni motozuku MT ho sanjigen keisan

    Energy Technology Data Exchange (ETDEWEB)

    Yamane, K.; Takasugi, S. [GERD Geothermal Energy Research and Development Co. Ltd., Tokyo (Japan)

    1996-10-01

    For 3-D magnetotelluric (MT) modeling, spectral Lanczos decomposition method (SLDM) was applied as high-speed high- accuracy modeling algorithm. SLDM was developed by Druskin to reduce computational time considerably by obtaining responses in the whole frequency domain all at once. The computational time of 3-D modeling was reduced by introducing Maxwell`s equation and Lanczos matrix as transformation matrix. The computation was carried out on the 1km{times}2km{times}2km low resistivity model body of 5 ohm{center_dot}m supposed in the uniform ground of 100 ohm{center_dot}m using 43{times}43{times}31 nodes at 17 frequencies ranging from 0.01Hz to 100Hz. Apparent resistivity at lower frequency decreased with approach to the low resistivity body. The computational time amounted to 6 hours 14 minutes. The 3-D MT modeling using SLDM method was independent of frequency, and its algorithm was superior in computational speed, however, it was inferior in computational time as the number of measuring nodes increased. 2 refs., 3 figs.

  14. and ni(ii)

    African Journals Online (AJOL)

    userpc

    NI(II) COMPLEXES WITH SCHIFF BASE DERIVED FROM SULPHANILAMINE AND. SALICYLALDEHYDE. ⃰Siraj, I. T. and ... with nickel(II) and cobalt(II) chloride in 2:1 mole ratio yielded Ni(II) and Co(II) complexes respectively. The synthesized .... coordinated ligand (coordination number) was determined using the relation ...

  15. Design and model experiments on thruster assisted mooring system; Futaishiki kaiyo kozobutsu no thruster ni yoru choshuki doyo seigyo

    Energy Technology Data Exchange (ETDEWEB)

    Nakamura, M.; Koterayama, W. [Kyushu Univ., Fukuoka (Japan). Research Inst. for Applied Mechanics; Kajiwara, H. [Kyushu Institute of Technology, Kitakyushu (Japan). Faculty of Computer Science and System Engineering; Hyakudome, T. [Kyushu University, Fukuoka (Japan)

    1996-12-31

    Described herein are dynamics and model experiments of the system in which positioning of a floating marine structure by mooring is combined with thruster-controlled positioning. Coefficients of dynamic forces acting on a floating structure model are determined experimentally and by the three-dimensional singularity distribution method, and the controller is designed by the PID, LQI and H{infinity} control theories. A model having a scale ratio of 1/100 was used for the experiments, where 2 thrusters were arranged in a diagonal line, one on the X-axis. It is found that the LQI and H{infinity} controllers of the thruster can control long-cycle rolling of the floating structure. They allow thruster control which is insensitive to wave cycle motion, and efficiently reduce positioning energy. The H{infinity} control regulates frequency characteristics of a closed loop more finely than the LQI control, and exhibits better controllability. 25 refs., 25 figs.

  16. Decay of 57Ni

    International Nuclear Information System (INIS)

    Santos Scardino, A.M. dos.

    1987-01-01

    The decay of 57 Ni to 57 Co was studied by gamma ray spectroscopy using both singles and coincidence spectra. The sources were obtained with the 58 Ni (Y,n) 57 Ni reaction. Natural metallic nickel was irradiated in the bremsstrahluhng beam of the linear accelerator of the Instituto de Fisica da Universidade de Sao Paulo with 30 MeV electrons. The singles espectra were taken with 104 cc HPGe detector and the coincidences espectra with 27 and 53cc Ge(Li) and 104 cc. HPGe detectors. The energies of transitions that follow the 57 Ni decay were measured using 56 Co as standard (which was obtained by (Y,np) reaction in 58 Ni) and taking into account the cascade cross-over relations. (author) [pt

  17. Influence of slip system combination models on crystal plasticity finite element simulation of NiTi shape memory alloy undergoing uniaxial compression

    Directory of Open Access Journals (Sweden)

    Li Hu

    2017-10-01

    Full Text Available The influence of various slip system combination models on crystal plasticity finite element simulation of NiTi shape memory alloy subjected to uniaxial compression deformation is investigated according to three combinations of slip systems, including combination of {010}〈100〉 and {110}〈111〉 slip modes, combination of {110}〈100〉 and {110}〈111〉 slip modes and combination of {110}〈100〉, {010}〈100〉 and {110}〈111〉 slip modes, which consist of 18, 18 and 24 slip systems, respectively. By means of simulating mechanical response, strain distribution, stress distribution and Schmid factor, it can be found that in terms of simulation accuracy, combination of {110}〈100〉 and {110}〈111〉 slip modes is in good agreement with combination of {110}〈100〉, {010}〈100〉 and {110}〈111〉 slip modes. The contribution of {110}〈100〉 slip mode to plastic strain is primary in plastic deformation of NiTi shape memory alloy, whereas {010}〈100〉 slip mode, which makes small contribution to plastic deformation, can be regarded as the unfavorable slip mode. In the case of large plastic strain, the {010}〈100〉 slip mode contributes to the formation of (001 [01¯0] texture component, while {110}〈100〉 and {110}〈111〉 slip modes facilitate the formation of γ-fibre (〈111〉 texture. Keywords: Shape memory alloy, Plastic deformation, Crystal plasticity, Finite element method, Texture

  18. Density functional modelling of the interaction between the uranyl ion and TiO2 and NiFe2O4 surfaces

    International Nuclear Information System (INIS)

    Perron, H.

    2007-07-01

    This study, performed within the framework of a collaboration between the IPN in Orsay and EDF, takes place within the problematic of radioactivity control in geological depository or in nuclear power plants. The interaction mechanisms of ions at solid / liquid interfaces are often very complex and thus very hard to characterize. The use of atomic modelling, and more particularly of ab initio type calculations such as the density functional theory, allow to access to surface complexes structural and energetic properties. First, this theoretical approach has been validated on the experimentally uranyl / rutile TiO 2 well-known system. The systematic comparisons between experimental data and theoretical results have allowed to demonstrate the ability of this approach to properly describe this complex system. Then, a similar study has been performed as a predictive tool on the uranyl / NiFe 2 O 4 system which is not characterized experimentally. The goal of these studies was to determine if theoretical calculations are able to bring usable and reliable data when the experimental studies are too hard to set up. (author)

  19. Neutron-diffraction study and modeling of the lattice parameters of a NiAl-precipitate-strengthened Fe-based alloy

    International Nuclear Information System (INIS)

    Teng, Z.K.; Ghosh, G.; Miller, M.K.; Huang, S.; Clausen, B.; Brown, D.W.; Liaw, P.K.

    2012-01-01

    The lattice misfit between the body-centered cubic α-Fe matrix and the B2-ordered NiAl-type β′ precipitates is a parameter of significant importance in controlling the creep resistance of precipitate-strengthened ferritic steels. However, the measurement of the lattice misfit is complicated due to the fact that the fundamental reflections of α and β′ phases almost completely overlap. In this study, neutron diffraction is used to determine the lattice parameters of these two phases in a Fe–18.9 Al–9.8 Cr–13 Ni–1.8 Mo (atomic percent, at.%) alloy as a function of temperature. The accuracy of the measurement at room temperature is verified by high-energy synchrotron X-ray diffraction. The comparison between these two techniques is discussed in terms of the difference in superlattice intensity. Furthermore, using the phase compositions determined by atom probe tomography, models are proposed to predict the lattice parameters of both phases at room temperature as a function of their compositions. The results are in very good agreement with those obtained experimentally.

  20. Structure of even-odd spherical nuclei using the BCS approximations and the ACQPV model: application to isotones with N=82 and Ni, Zn and Cs'' isotopes

    International Nuclear Information System (INIS)

    Losano, L.

    1986-01-01

    Calculations of the (E,J Π ) spectra and the electromagnetic properties (fe,Q,BEZ,BM1) are made for Ni odd isotopes, and odd isotones with N=82, using the Shell Model (SM), the usual BCS approximation (one and three quasiparticles), blocking BCS (BBCS) and projected BCS (PBCS). The importance of the five quasiparticle correlations and of the correlation introduced in BCS are examined in detail. The collective degrees of freedom of the core are introduced through the quasiparticle-cluster-vibrator coupling (QPCVC), so that this formalism permits as well the inclusion of blocking as the projection in number of particles in the cluster of one and three quasiparticles. Comparative calculations are made between the version with blocking (BQPCV) and with projection (PQPCV) for spectra and electromagnetic properties of Zn old isotopes. The projected version is applied to the cesium isotopes in the description of the 5/2 + states generated by the anomalous coupling. In all examined cases, the comparison with the available experimental data is also shown. (L.C.) [pt

  1. Investigation of the wavelength dependence of laser stratigraphy on Cu and Ni coatings using LIBS compared to a pure thermal ablation model

    Science.gov (United States)

    Paulis, Evgeniya; Pacher, Ulrich; Weimerskirch, Morris J. J.; Nagy, Tristan O.; Kautek, Wolfgang

    2017-12-01

    In this study, galvanic coatings of Cu and Ni, typically applied in industrial standard routines, were investigated. Ablation experiments were carried out using the first two harmonic wavelengths of a pulsed Nd:YAG laser and the resulting plasma spectra were analysed using a linear Pearson correlation method. For both wavelengths the absorption/ablation behaviour as well as laser-induced breakdown spectroscopy (LIBS) depth profiles were studied varying laser fluences between 4.3-17.2 J/cm^2 at 532 nm and 2.9-11.7 J/cm^2 at 1064 nm. The LIBS-stratigrams were compared with energy-dispersive X-ray spectroscopy of cross-sections. The ablation rates were calculated and compared to theoretical values originating from a thermal ablation model. Generally, higher ablation rates were obtained with 532 nm light for both materials. The light-plasma interaction is suggested as possible cause of the lower ablation rates in the infrared regime. Neither clear evidence of the pure thermal ablation, nor correlation with optical properties of investigated materials was obtained.

  2. The nonlinear unloading behavior of a typical Ni-based superalloy during hot deformation: a new elasto-viscoplastic constitutive model

    Science.gov (United States)

    Chen, Ming-Song; Lin, Y. C.; Li, Kuo-Kuo; Chen, Jian

    2016-09-01

    The nonlinear unloading behavior of a typical Ni-based superalloy is investigated by hot compressive experiments with intermediate unloading-reloading cycles. The experimental results show that there are at least four types of unloading curves. However, it is found that there is no essential difference among four types of unloading curves. The variation curves of instantaneous Young's modulus with stress for all types of unloading curves include four segments, i.e., three linear elastic segments (segments I, II, and III) and one subsequent nonlinear elastic segment (segment IV). The instantaneous Young's modulus of segments I and III is approximately equal to that of reloading process, while smaller than that of segment II. In the nonlinear elastic segment, the instantaneous Young's modulus linearly decreases with the decrease in stress. In addition, the relationship between stress and strain rate can be accurately expressed by the hyperbolic sine function. This study includes two parts. In the present part, the characters of unloading curves are discussed in detail, and a new elasto-viscoplastic constitutive model is proposed to describe the nonlinear unloading behavior based on the experimental findings. While in the latter part (Chen et al. in Appl Phys A. doi: 10.1007/s00339-016-0385-0, 2016), the effects of deformation temperature, strain rate, and pre-strain on the parameters of this new constitutive model are analyzed, and a unified elasto-viscoplastic constitutive model is proposed to predict the unloading behavior at arbitrary deformation temperature, strain rate, and pre-strain.

  3. The nonlinear unloading behavior of a typical Ni-based superalloy during hot deformation. A new elasto-viscoplastic constitutive model

    International Nuclear Information System (INIS)

    Chen, Ming-Song; Li, Kuo-Kuo; Lin, Y.C.; Chen, Jian

    2016-01-01

    The nonlinear unloading behavior of a typical Ni-based superalloy is investigated by hot compressive experiments with intermediate unloading-reloading cycles. The experimental results show that there are at least four types of unloading curves. However, it is found that there is no essential difference among four types of unloading curves. The variation curves of instantaneous Young's modulus with stress for all types of unloading curves include four segments, i.e., three linear elastic segments (segments I, II, and III) and one subsequent nonlinear elastic segment (segment IV). The instantaneous Young's modulus of segments I and III is approximately equal to that of reloading process, while smaller than that of segment II. In the nonlinear elastic segment, the instantaneous Young's modulus linearly decreases with the decrease in stress. In addition, the relationship between stress and strain rate can be accurately expressed by the hyperbolic sine function. This study includes two parts. In the present part, the characters of unloading curves are discussed in detail, and a new elasto-viscoplastic constitutive model is proposed to describe the nonlinear unloading behavior based on the experimental findings. While in the latter part (Chen et al. in Appl Phys A. doi:10.1007/s00339-016-0385-0, 2016), the effects of deformation temperature, strain rate, and pre-strain on the parameters of this new constitutive model are analyzed, and a unified elasto-viscoplastic constitutive model is proposed to predict the unloading behavior at arbitrary deformation temperature, strain rate, and pre-strain. (orig.)

  4. Evolution of Ni3X Precipitation Kinetics, Morphology and Spatial Correlations in Binary Ni-X Alloys Aged Under Externally Applied Stress

    Energy Technology Data Exchange (ETDEWEB)

    Ardell, Alan J

    2006-02-07

    Coarsening of Ni3Al, Ni3Ga, Ni3Ge and Ni3Si precipitates in aged binary single-crystal Ni-Al, Ni-Ga, Ni-Ge and Ni-Si alloys under applied compressive stress was measured experimentally over the temperature range 600 to 700 °C. Experiments were also performed on binary Ni-Al single crystals deformed in tension at 640°C. The orientation of the crystals was [100] in all the experiments. Compared to the kinetics of coarsening in unstressed alloys, coarsening was slightly slower in specimens aged under compression and slightly faster in specimens aged in tension. The effect of applied stress on morphology and spatial correlation was also measured and found to be small. Ni3Al precipitates of a given size generally tended to become more non-equiaxed and their interfaces more planar, with increasing compressive stress. Ni3Ge precipitates behaved differently, becoming more spherical in specimens aged under compression. The effect of applied stress on kinetics is attributed to the influence of elastic deformation on diffusion. A model was developed that predicts slightly slower diffusion under compression and slightly faster diffusion in tension. The elastic constants of single crystals of Ni-Al, Ni-Si, Ni-Ga and Ni-Ge solid solutions were measured from room temperature to about 1100 K using resonant ultrasound spectroscopy.

  5. Mathematical model of a NiOOH/metal hydride cell. Final report, September 15, 1993--November 14, 1996

    Energy Technology Data Exchange (ETDEWEB)

    White, R.E.; Popov, B.N.

    1996-12-31

    One of the objectives of work on the nickel/metal hydride cell has been to develop a mathematical model of the performance of the cell. This is a summary of work to date and is meant to be a Final Report of the BES project. Mathematical model of the nickel/metal hydride cell depends on the kinetics, thermodynamics, and transport properties of the metal hydride electrode. Consequently, investigations were carried out to determine: (1) the exchange current density and the equilibrium potential as a function of hydrogen content in the electrode; (2) the hydrogen diffusion coefficient in the bulk of the alloy; (3) the hydrogen reaction rate order; (4) the symmetry factor for hydrogen evolution reaction and (5) to determine the reaction mechanisms of the hydrogen charge and discharge processes including overcharge and overdischarge mechanism.

  6. Grain boundaries in Ni3Al. 2

    International Nuclear Information System (INIS)

    Kung, H.; Sass, S.L.

    1992-01-01

    This paper discusses the dislocation structure of small angle tilt and twist boundaries in ordered Ni 3 Al, with and without boron, investigated using transmission electron microscopy. Dislocation with Burgers vectors that correspond to anti-phase boundary (APB)-coupled superpartials were found in small angle twist boundaries in both boron-free and boron-doped Ni 3 Al, and a small angle tilt boundary in boron-doped Ni 3 Al. The boundary structures are in agreement with theoretical models proposed by Marcinkowski and co-workers. The APB energy determined from the dissociation of the grain boundary dislocations was lower than values reported for isolated APBs in Ni 3 Al. For small angle twist boundaries the presence of boron reduced the APB energy at the interface until it approached zero. This is consistent with the structure of these boundaries containing small regions of increased compositional disorder in the first atomic plane next to the interface

  7. Use of the generalized spherical harmonic model for describing crystallographic texture in polycrystalline NiTi shape-memory alloy with time-of-flight neutron powder diffraction data

    CERN Document Server

    Sitepu, H; Dreele, R B V

    2002-01-01

    We present a feasibility study to extract quantitative texture and precise crystal structure information of polycrystalline monoclinic NiTi shape-memory alloys from a simultaneous refinement of 52 time-of-flight neutron-diffraction patterns taken in 13 orientations in the diffractometer. The multiple-data-set capabilities and the generalized spherical harmonic texture model of the GSAS program system were employed. (orig.)

  8. Submicron particles of Co, Ni and Co–Ni alloys

    Indian Academy of Sciences (India)

    Unknown

    meter (VSM). It may be noted that Co and Ni form a solid solution in the bulk, CoxNi1–x. For x 0⋅7, the alloy has a fcc structure, with a mixed regime in the intermediate compositions. The atomic moments in Co–Ni alloys increase linearly with Ni content (Tebble and Craik.

  9. Study of the central collisions in the reactions Ni + Al and Ni + Ni at 28 A.MeV; Etude des collisions centrales dans les reactions Ni + Al et Ni + Ni a 28 A.MeV

    Energy Technology Data Exchange (ETDEWEB)

    Lebreton, L.

    1995-12-01

    The work is in characterisation of mechanisms in the energy range of onset of multifragmentation (excitation energy of composed nucleus around 4 - 5 AMeV). This work focused on an experiment performed at the SARA facility, in Grenoble, using the AMPHORA multi detection array. I have been particularly interested in central collisions in the Ni + Al and Ni + Ni systems. The possibility to detect complete events for Ni + Al, and quasi-complete events for the Ni + Ni case, is the reason of this choice. Furthermore Ni + Ni presents the interest of a symmetrical system, for which the excitation energy per nucleon is maximum. The study of these reactions has been focused on the quasi-complete events (events for which at least 80 % of the total charge has been detected). Heavy ions produced in peripheral collisions are very likely emitted along the beam line or stopped in the plastic detectors, energy thresholds are too high for the quasi-target products detection, consequently by requiring complete or quasi-complete measurement of the total charge, we are able to detect mostly central events. The knowledge of informations like charge, energy or detection angles allows to isolate the source(s) and to reconstruct the size and the excitation energy of the source(s). Comparisons with simulations like sequential emission (GEMINI code), very deep inelastic collision or instantaneous emission (Berliner code) allows to characterise the first stage of the collision (binary collisions or central collisions) and the type of deexcitation of the source(s). Some calculations was also performed with the statistical model code MODGAN. Indeed azimuthal correlations seem to be a good tool in getting more information about involved reaction mechanisms. Comparisons with MODGAN provide information about angular momentum of the source and time delay between emissions of the two particles (separation between sequential or instantaneous process). (author). 69 refs.

  10. Bridging exchange bias effect in NiO and Ni(core)@NiO(shell) nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Rinaldi-Montes, Natalia, E-mail: nataliarin@gmail.com [Departamento de Física, Universidad de Oviedo, E-33007 Oviedo (Spain); Gorria, Pedro [Departamento de Física & IUTA, EPI, Universidad de Oviedo, E-33203 Gijón (Spain); Martínez-Blanco, David [Servicios Científico-Técnicos, Universidad de Oviedo, E-33006 Oviedo (Spain); Fuertes, Antonio B. [Instituto Nacional del Carbón, CSIC, E-33080 Oviedo (Spain); Fernández Barquín, Luis [CITIMAC, Facultad de Ciencias, Universidad de Cantabria, E-39005 Santander (Spain); Puente-Orench, Inés [Instituto de Ciencia de Materiales de Aragón, CSIC-Universidad de Zaragoza and Institut Laue-Langevin, BP 156, F-38042 Grenoble Cedex 9 (France); Blanco, Jesús A. [Departamento de Física, Universidad de Oviedo, E-33007 Oviedo (Spain)

    2016-02-15

    Among all bi-magnetic core(transition metal)@shell(transition metal oxide) nanoparticles (NPs), Ni@NiO ones show an onset temperature for the exchange bias (EB) effect far below the Néel temperature of bulk antiferromagnetic NiO. In this framework, the role played by the magnetism of NiO at the nanoscale is investigated by comparing the microstructure and magnetic properties of NiO and Ni@NiO NPs. With the aim of bridging the two systems, the diameter of the NiO NPs (~4 nm) is chosen to be comparable to the shell thickness of Ni@NiO ones (~2 nm). The EB effect in Ni@NiO NPs is attributed to the exchange coupling between the core and the shell, with an interfacial exchange energy of ΔE~0.06 erg cm{sup −2}, thus comparable to previous reports on Ni/NiO interfaces both in thin film and NP morphologies. In contrast, the EB detected in NiO NPs is explained in a picture where uncompensated spins located on a magnetically disordered surface shell are exchange coupled to the antiferromagnetic core. In all the studied NPs, the variation of the EB field as a function of temperature is described according to a negative exponential law with a similar decay constant, yielding a vanishing EB effect around T~40–50 K. In addition, the onset temperature for the EB effect in both NiO and Ni@NiO NPs seems to follow a universal dependence with the NiO crystallite size. - Highlights: • Comparison of the exchange bias effect in NiO and Ni(core)@NiO(shell) nanoparticles. • Universal temperature dependence of the exchange bias effect. • Suggested similar physical origin of the effect in both systems. • Size and crystallinity of the NiO shell hold the key for exchange bias properties.

  11. OpenNI cookbook

    CERN Document Server

    Falahati, Soroush

    2013-01-01

    This is a Cookbook with plenty of practical recipes enriched with explained code and relevant screenshots to ease your learning curve. If you are a beginner or a professional in NIUI and want to write serious applications or games, then this book is for you. Even OpenNI 1 and OpenNI 1.x programmers who want to move to new versions of OpenNI can use this book as a starting point. This book uses C++ as the primary language but there are some examples in C# and Java too, so you need to have about a basic working knowledge of C or C++ for most cases.

  12. Strain-induced γ{sup '}-coarsening during aging of Ni-based superalloys under uniaxial load. Modeling and analysis

    Energy Technology Data Exchange (ETDEWEB)

    Mushongera, Leslie T.

    2016-07-28

    Turbine blades which are used in the hot paths of aerospace or industrial gas turbines are usually manufactured as casted single crystalline parts. However, even though grain boundaries are excluded, the degradation behavior of respectively developed single crystal nickel-base superalloys, is still quite complex involving a number of very different microscopic effects. One of these is the diffusion-limited coarsening of the γ{sup '}-precipitates. Long-term aging or creep loading along the <100> crystallographic orientation results in the anisotropic coarsening of the γ{sup '}-precipitates. In the end, the microstructure contains quite large, irregularly shaped precipitates or plate-like precipitates aligned either parallel (P-type rafts) or perpendicular (N-type rafts) to the loading direction. This behavior is detrimental for the properties of these materials since their superior properties emanate from the size, morphology and distribution of the γ{sup '}-precipitates [R. Reed: Cambridge University Press, (2006)]. In order to efficiently design these materials, the phenomenon of coarsening should be known in detail to optimize the materials accurately. On this background, the general objective of this thesis is to develop an integrated computational approach for simulating morphological evolution in single crystal Ni-base superalloys. As a first step towards that aim, a multi-component phase field model coupled to inputs from CALPHAD-type and kinetic databases for the relevant driving forces was developed based on the grand-potential formalism similar to Plapp [Phys. Rev. E, 84: 031601 (2011)]. The thermodynamic formulation of the model was validated by comparisons to ThermoCalc equilibrium calculations and DICTRA sharp-interface simulations. Phase field approaches that allow for anisotropies of the interfacial energy sufficiently high so that the interface develops sharp corners due to missing crystallographic orientations were formulated. This

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

    Science.gov (United States)

    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

  14. Interfacial reaction of Ni{sub 3}Sn{sub 4} intermetallic compound in Ni/SnAg solder/Ni system under thermomigration

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Yi-Shan; Yang, Chia-Jung; Ouyang, Fan-Yi, E-mail: fyouyang@ess.nthu.edu.tw

    2016-07-25

    The growth of Ni{sub 3}Sn{sub 4} intermetallic compound (IMC) between liquid–solid interface in micro-scale Ni/SnAg/Ni system was investigated under a temperature gradient of 160 °C/cm at 260 °C on a hot plate. In contrast to a symmetrical growth of Ni{sub 3}Sn{sub 4} on both interfaces under isothermally annealed at 260 °C, the interfacial Ni{sub 3}Sn{sub 4} IMC exhibited asymmetric growth under a temperature gradient; the growth of Ni{sub 3}Sn{sub 4} at cold interface was faster than that at hot side because of temperature gradient induced mass migration of Ni atoms from the hot end toward the cold end. It was found that two-stage growth behavior of Ni{sub 3}Sn{sub 4} IMC under a temperature gradient. A growth model was established and growth kinetic analysis suggested that the chemical potential gradient controlled the growth of Ni{sub 3}Sn{sub 4} at stage I (0–120 min) whereas the dynamic equilibrium between chemical potential gradient and temperature gradient forces was attained at the hot end at stage II (120–210 min). When dynamic equilibrium was achieved at 260 °C, the critical length-temperature gradient product at the hot end was experimentally estimated to be 489.18 μm × °C/cm and the moving velocity of Ni{sub 3}Sn{sub 4} interface due to Ni consumption was calculated to be 0.134 μm/h. The molar heat of transport (Q*) of Ni atoms in molten SnAg solder was calculated to be +0.76 kJ/mol. - Highlights: • Interfacial reaction in Ni/SnAg solder/Ni system under thermal gradient. • Growth rate of Ni{sub 3}Sn{sub 4} at cold end is faster than that at hot end. • Critical length-temperature gradient product at hot end is 489.2 μm°C/cm at 260 °C. • Velocity of Ni{sub 3}Sn{sub 4} moving interface is 0.134 μm/h during dynamic equilibrium. • Molar heat of transport (Q*) of Ni in molten SnAg was +0.76 kJ/mol.

  15. Microstructural evolution under high flux irradiation of dilute Fe-CuNiMnSi alloys studied by an atomic kinetic Monte Carlo model accounting for both vacancies and self interstitials

    International Nuclear Information System (INIS)

    Vincent, E.; Becquart, C.S.; Domain, C.

    2008-01-01

    Under neutron irradiation, a large amount of point defects (vacancies and interstitials) are created. In the irradiated pressure vessel steels, weakly alloyed, these point defects are responsible for the diffusion of the solute atoms, leading to the formation of solute rich precipitates within the matrix. Ab initio calculations based on the density functional theory have been performed to determine the interactions of point defects with solute atoms in dilute FeX alloys (X = Cu, Mn, Ni or Si). For Mn, the results of these calculations lead to think that solute transport in α-Fe can very likely take place through an interstitial mechanism as well as via vacancies while the other solutes (Cu, Ni and Si) which establish strong bonds with vacancies diffuse more likely via vacancies only. The database thus created has been used to parameterize an atomic kinetic Monte Carlo model taking into account both vacancies and interstitials. Some results of irradiation damage in dilute Fe-CuNiMnSi alloys obtained with this model will be presented

  16. Microstructural evolution under high flux irradiation of dilute Fe CuNiMnSi alloys studied by an atomic kinetic Monte Carlo model accounting for both vacancies and self interstitials

    Science.gov (United States)

    Vincent, E.; Becquart, C. S.; Domain, C.

    2008-12-01

    Under neutron irradiation, a large amount of point defects (vacancies and interstitials) are created. In the irradiated pressure vessel steels, weakly alloyed, these point defects are responsible for the diffusion of the solute atoms, leading to the formation of solute rich precipitates within the matrix. Ab initio calculations based on the density functional theory have been performed to determine the interactions of point defects with solute atoms in dilute FeX alloys (X = Cu, Mn, Ni or Si). For Mn, the results of these calculations lead to think that solute transport in α-Fe can very likely take place through an interstitial mechanism as well as via vacancies while the other solutes (Cu, Ni and Si) which establish strong bonds with vacancies diffuse more likely via vacancies only. The database thus created has been used to parameterize an atomic kinetic Monte Carlo model taking into account both vacancies and interstitials. Some results of irradiation damage in dilute Fe-CuNiMnSi alloys obtained with this model will be presented.

  17. Impact of Interstitial Ni on the Thermoelectric Properties of the Half-Heusler TiNiSn

    Directory of Open Access Journals (Sweden)

    Sonia A. Barczak

    2018-03-01

    Full Text Available TiNiSn is an intensively studied half-Heusler alloy that shows great potential for waste heat recovery. Here, we report on the structures and thermoelectric properties of a series of metal-rich TiNi1+ySn compositions prepared via solid-state reactions and hot pressing. A general relation between the amount of interstitial Ni and lattice parameter is determined from neutron powder diffraction. High-resolution synchrotron X-ray powder diffraction reveals the occurrence of strain broadening upon hot pressing, which is attributed to the metastable arrangement of interstitial Ni. Hall measurements confirm that interstitial Ni causes weak n-type doping and a reduction in carrier mobility, which limits the power factor to 2.5–3 mW m−1 K−2 for these samples. The thermal conductivity was modelled within the Callaway approximation and is quantitively linked to the amount of interstitial Ni, resulting in a predicted value of 12.7 W m−1 K−1 at 323 K for stoichiometric TiNiSn. Interstitial Ni leads to a reduction of the thermal band gap and moves the peak ZT = 0.4 to lower temperatures, thus offering the possibility to engineer a broad ZT plateau. This work adds further insight into the impact of small amounts of interstitial Ni on the thermal and electrical transport of TiNiSn.

  18. Study of seismic data acquisition using physical modeling system; Butsuri model jikken sochi wo mochiita data shutoku gijutsu ni kansuru kento

    Energy Technology Data Exchange (ETDEWEB)

    Tsukui, R.; Tsuru, T. [Japan National Oil Corp., Tokyo (Japan). Technology Research Center; Matsuoka, T [Japan Petroleum Exploration Corp., Tokyo (Japan)

    1996-10-01

    For the physical modeling system of Technology Research Center, Japan National Oil Corporation, data acquisition on the ocean and ground can be simulated using models. This system can provide data for verification of the data processing and elastic wave simulation algorithm. This can also provide data for decision of experiment specifications by making a model simulating the underground structure of the given test field. The model used for the physical modeling system is a gradient multilayer model with six-layer structure. Depth migration before stacking was conducted using data obtained through two acquisition methods, i.e., up-dip acquisition and down-dip acquisition. The depth migration before stacking was performed for data obtained by up-dip acquisition in addition to the records obtained by down-dip acquisition. Consequently, a definite reflection surface was observed, which has not been observed from the processing results of down-dip acquisition data. 9 figs.

  19. Level density of radioactive doubly-magic nucleus 56Ni

    International Nuclear Information System (INIS)

    Santhosh Kumar, S.; Rengaiyan, R.; Victor Babu, A.; Preetha, P.

    2012-01-01

    In this work the single particle energies are obtained by diagonalising the Nilsson Hamiltonian in the cylindrical basis and are generated up to N =11 shells for the isotopes of Ni from A = 48-70, emphasizing the three magic nuclei viz, 48 Ni, 56 Ni and 68 Ni. The statistical quantities like excitation energy, level density parameter and nuclear level density which play the important roles in the nuclear structure and nuclear reactions can be calculated theoretically by means of the Statistical or Partition function method. Hence the statistical model approach is followed to probe the dynamical properties of the nucleus in the microscopic level

  20. Comparison between Einstein and Debye models for an amorphous Ni46Ti54 alloy produced by mechanical alloying investigated using extended x-ray absorption fine structure and cumulant expansion.

    Science.gov (United States)

    Machado, K D

    2011-02-14

    We investigated an amorphous Ni(46)Ti(54) alloy produced by mechanical alloying using extended x-ray absorption fine structure (EXAFS) technique and cumulant expansion considering Einstein and Debye models for the temperature dependence of the cumulants. Results obtained from both models were compared and very similar values were obtained. From them, we found information about the structure of the alloy besides thermal and structural disorder, anharmonicity, thermal expansion, and asymmetry of the partial distribution functions g(ij)(r). The cumulants C(1)(*), C(2)(*), and C(3)(*) also allowed us to reconstruct the g(ij)(r, T) functions from EXAFS.

  1. Interactions between Lattice Dislocations and Grain Boundaries in Ni3Al Investigated by Means of In Situ TEM and Computer Modelling Experiments

    NARCIS (Netherlands)

    Pestman, B.J.; Hosson, J.Th.M. De

    1992-01-01

    The interaction between lattice dislocations and grain boundaries in Ni3Al has been investigated by means of in situ TEM deformation experiments. The interaction between screw dislocations and a coherent twin boundary could be analyzed in detail. The interaction mechanism found experimentally was

  2. Fuzzy logic modeling of Pb (II) sorption onto mesoporous NiO/ZnCl2-Rosa Canina-L seeds activated carbon nanocomposite prepared by ultrasound-assisted co-precipitation technique.

    Science.gov (United States)

    Javadian, Hamedreza; Ghasemi, Maryam; Ruiz, Montserrat; Sastre, Ana Maria; Asl, Seyed Mostafa Hosseini; Masomi, Mojtaba

    2018-01-01

    In this study, NiO/Rosa Canina-L seeds activated carbon nanocomposite (NiO/ACNC) was prepared by adding dropwise NaOH solution (2mol/L) to raise the suspension pH to around 9 at room temperature under ultrasonic irradiation (200W) as an efficient method and characterized by FE-SEM, FTIR and N 2 adsorption-desorption isotherm. The effect of different parameters such as contact time (0-120min), initial metal ion concentration (25-200mg/L), temperature (298, 318 and 333K), amount of adsorbent (0.002-0.007g) and the solution's initial pH (1-7) on the adsorption of Pb (II) was investigated in batch-scale experiments. The equilibrium data were well fitted by Langmuir model type 1 (R 2 >0.99). The maximum monolayer adsorption capacity (q m ) of NiO/ACNC was 1428.57mg/L. Thermodynamic parameters (ΔG°, ΔH° and ΔS°) were also calculated. The results showed that the adsorption of Pb (II) onto NiO/ACNC was feasible, spontaneous and exothermic under studied conditions. In addition, a fuzzy-logic-based model including multiple inputs and one output was developed to predict the removal efficiency of Pb (II) from aqueous solution. Four input variables including pH, contact time (min), dosage (g) and initial concentration of Pb (II) were fuzzified using an artificial intelligence-based approach. The fuzzy subsets consisted of triangular membership functions with eight levels and a total of 26 rules in the IF-THEN approach which was implemented on a Mamdani-type of fuzzy inference system. Fuzzy data exhibited small deviation with satisfactory coefficient of determination (R 2 >0.98) that clearly proved very good performance of fuzzy-logic-based model in prediction of removal efficiency of Pb (II). It was confirmed that NiO/ACNC had a great potential as a novel adsorbent to remove Pb (II) from aqueous solution. Copyright © 2017 Elsevier B.V. All rights reserved.

  3. Generation and Decay Mechanisms of Ningaloo Niño/Niña

    Science.gov (United States)

    Kataoka, Takahito; Tozuka, Tomoki; Yamagata, Toshio

    2017-11-01

    Using an ocean model, generation and decay mechanisms of warm/cool sea surface temperature anomalies (SSTAs) off Western Australia, or Ningaloo Niño/Niña, are investigated through the calculation of a mixed-layer temperature (MLT) balance taking the mixed-layer depth (MLD) variation into account. Since Ningaloo Niño/Niña develops owing to local air-sea interaction and/or remote forcing, events are classified into two cases based on alongshore wind anomalies and analyzed separately. It is revealed that the anomalous meridional advection associated with the stronger Leeuwin Current and the enhanced warming by the climatological shortwave radiation because of the shallower MLD generate warm SSTAs in the coastal region for both cases of Ningaloo Niño. On the other hand, the latent heat flux damps SSTAs only in a case without northerly alongshore wind anomalies. In the decay, larger sensible heat loss is important. Because of the reduced meridional temperature gradient, the meridional advection eventually damps SSTAs. The sensitivity change to the climatological shortwave radiation owing to MLD anomalies explains offshore MLT tendency anomalies for both cases throughout the events. The mechanisms for Ningaloo Niña are close to a mirror image of Ningaloo Niño but differ in that the latent heat flux damps offshore SSTAs. The seasonal phase-locking nature of Ningaloo Niño/Niña is related to the seasonal variations of MLD and surface heat fluxes, which regulate the amplitude and sign of the sensitivity change to surface heat fluxes. It is also related to the seasonal variations of the Leeuwin Current and meridional temperature gradient through advection anomalies.

  4. Absence of Ni on the outer surface of Sr doped La 2 NiO 4 single crystals

    KAUST Repository

    Burriel, Mónica

    2014-01-01

    A combination of surface sensitive techniques was used to determine the surface structure and chemistry of La2-xSrxNiO 4+δ. These measurements unequivocally showed that Ni is not present in the outermost atomic layer, suggesting that the accepted model with the B-site cations exposed to the environment is incorrect. © 2014 The Royal Society of Chemistry.

  5. Fault detection by Turam TEM survey. Numerical model studies and a case history; TEM ho Turam sokutei haichi ni yoru danso kenshutsu no kokoromi. Model keisan to jisshirei

    Energy Technology Data Exchange (ETDEWEB)

    Wada, K.; Tsutsui, T. [Mitsui Mineral Development Engineering Co. Ltd., Tokyo (Japan); Ito, T. [Chiba Univ., Chiba (Japan). Faculty of Science; Takeuchi, A. [Toyama University, Toyama (Japan). Faculty of Science; He, P. [Power Reactor and Nuclear fuel Development Corp., Tokyo (Japan)

    1997-05-27

    With an objective to detect faults estimated to exist along the Shigesumi valley in the Kamioka mine, discussions were given by using electromagnetic survey, which uses the Turam measurement arrangement based on the TEM method, and three-dimensional model calculations. The Turam measurement arrangement, which installs transmission loop fixedly, is used to identify nature and distribution of electrically conductive objects upon noticing abnormal portions in magnetic fields in the measurement data. In the model calculation, the plate model calculation method and the FDTD method were used, and so was the calculation code TEM3DL. The result revealed that strong topographical influence is seen from steep V-shaped valley existing along the traverse line in the measurement data, but an abnormal resistivity band accompanying remarkable distortion in the curve was detected. According to the result of the model calculation, anomaly detection may be found difficult in locations where a low resistivity band has not grown enough locally. It was possible from these facts to assume a model in which the low resistivity band exists directly below the Shigesumi valley, suggesting existence of faults. 2 refs., 8 figs.

  6. Study of seismic data acquisition using physical modeling system; Butsuri model jikken sochi wo mochiita data shutoku gijutsu ni kansuru kento

    Energy Technology Data Exchange (ETDEWEB)

    Tsukui, R.; Tsuru, T. [Tech. Research Center, Japan National Oil Corp., Tokyo (Japan); Matsuoka, T. [Japan Petroleum Exploration Corp., Tokyo (Japan)

    1996-05-01

    The Physical Modeling System introduced into the Technology Research Center, Japan National Oil Corporation, and data collected by use of the system are presented. The Physical Modeling System is 10,000 times smaller than the real one, comprising a water tub section, measuring device section, and control section, etc. The water tub section comprises a tub for housing the model, transducers for transmitting and receiving vibration, controllers, etc. The water tub measures 1.8{times}1.2{times}0.9m. The model used in the experiment is an `inclined multilayer model` with each of its six layers pinching out toward the top, and is usable for the comparison of various migration methods. In one case in the records, reception was made at 184 reception points deployed at intervals of 3mm, when the minimum offset was 15mm and the maximum offset 564mm. Nothing very obvious was observed when the ordinary overlapping of DMO and CDP was applied to this record, which suggests that pre-overlapping migration treatment is required. 5 figs.

  7. Measurement of the nuclear magnetic moments of 57Ni and 59Fe

    International Nuclear Information System (INIS)

    Ohtsubo, T.; Cho, D.J.; Yanagihashi, Y.; Ohya, S.; Muto, S.

    1996-01-01

    The magnetic hyperfine splitting frequencies of (i) 57 Ni in Fe ( 57 NiFe), (ii) 57 Ni in Ni ( 57 NiNi), and (iii) 59 Fe in Fe ( 59 FeFe) were measured with the technique of nuclear magnetic resonance on oriented nuclei (NMR-ON) at low temperatures. The NMR-ON spectra were observed by detecting the β-ray asymmetries. The resonance frequencies at zero external magnetic field were deduced from the extrapolation of the external field dependence of the resonance frequencies: ν( 57 NiFe)=94.23(2) MHz, ν( 57 NiNi)=30.02(4) MHz, and ν( 59 FeFe)=57.719(11) MHz. With the known hyperfine fields of B HF (NiNi)=-7.406(8) T and B HF (FeFe)=-33.82(3) T, the magnetic moments of 57 Ni and 59 Fe were determined to be μ( 57 Ni)=-0.7975(14)μ N and μ( 59 Fe)=-0.3358(4)μ N . The precise value of the hyperfine field of B HF ( 57 NiFe) was also deduced as -23.25(5) T. The measured values of the magnetic moment are compared with those based on the shell model. copyright 1996 The American Physical Society

  8. Three dimensional transient electromagnetic model study for fracture prediction from tunnel face; Sanjigen model keisan ni yoru TEM ho no tunnel zenpo tansa eno tekiyosei no kento

    Energy Technology Data Exchange (ETDEWEB)

    Wada, K.; Tsutsui, T.; Saito, A. [Mitsui Mineral Development Engineering Co. Ltd., Tokyo (Japan); Hara, T. [Toda Corp., Tokyo, (Japan); Zhdanov, M. [University of Utah, UT (United States)

    1996-10-01

    In order to apply TEM model to fracture prediction at tunnel face, 3-D TEM model computation by FEM was conducted by installing a transmission loop on a tunnel face. MT field responses diffusing into the 3-D model were computed by time-domain difference calculus, and analytical precision was improved by introducing a staggered grid method. In the case where a low resistive zone exists before a tunnel face, time variance in diffused eddy current and induction current in the low resistive zone could be obtained. The difference in tunnel-axial transient curve (transient phenomenon curve in magnetic field) between uniform medium and low resistive zone models was based on the absorption process of diffused eddy current into the low resistive zone, and the expanding process of it toward the outside. Change in background condition could be predicted from the background and the ratio of transient curves every measurement. The detection limit of the low resistive zone was dependent on resistivity contrast, distance and geometry. Fluctuation in measurement due to noises and S/N ratio were also essential. 3 refs., 10 figs.

  9. Simulation model study of limitation on the locating distance of a ground penetrating radar; Chichu tansa radar no tansa kyori genkai ni kansuru simulation model no kochiku

    Energy Technology Data Exchange (ETDEWEB)

    Nakauchi, T.; Tsunasaki, M.; Kishi, M.; Hayakawa, H. [Osaka Gas Co. Ltd., Osaka (Japan)

    1996-10-01

    Various simulations were carried out under various laying conditions to obtain the limitation of locating distance for ground penetrating radar. Recently, ground penetrating radar has been remarked as location technology of obstacles such as the existing buried objects. To enhance the theoretical model (radar equation) of a maximum locating distance, the following factors were examined experimentally using pulse ground penetrating radar: ground surface conditions such as asphalt pavement, diameter of buried pipes, material of buried pipes, effect of soil, antenna gain. The experiment results well agreed with actual field experiment ones. By adopting the antenna gain and effect of the ground surface, the more practical simulation using underground models became possible. The maximum locating distance was more improved by large antenna than small one in actual field. It is assumed that large antenna components contributed to improvement of gain and reduction of attenuation during passing through soil. 5 refs., 12 figs.

  10. Neither Goodenough ionic model nor Zener polaron model for Bi 0.5Ca 0.5Mn 1- xNi xO 3- δ system

    Science.gov (United States)

    Toulemonde, O.; Skovsen, I.; Mesguich, F.; Gaudin, E.

    2008-04-01

    The magnetic susceptibilities of three Bi 0.5Ca 0.5MnO 3- δ compounds synthesised by three different methods were characterised and analysed. Large magnetic Mn x clusters ( x ≥ 4) were considered to explain the high value of the Curie-Weiss constant. Unlike previous studies on similar systems, Goodenough ionic model or Zener polaron model is not suitable. In all cases, cluster behaviour is observed at low field and at low temperature. The influence of the oxygen stoichiometry and the homogeneity of the cation distribution depending on the method of the synthesis used is discussed. Finally, the effects of nickel doping on the magnetic properties were studied and the cluster behaviour was confirmed. The distribution in size of the clusters depends on the amount of nickel and it induces a glassy magnetic behaviour.

  11. Three dimensional numerical modeling for ground penetrating radar using finite difference time domain (FDTD) method; Jikan ryoiki yugen sabunho ni yoru chika radar no sanjigen suchi modeling

    Energy Technology Data Exchange (ETDEWEB)

    Sanada, Y.; Ashida, Y.; Sassa, K. [Kyoto University, Kyoto (Japan)

    1996-10-01

    3-D numerical modeling by FDTD method was studied for ground penetrating radar. Radar radiates electromagnetic wave, and determines the existence and distance of objects by reflection wave. Ground penetrating radar uses the above functions for underground surveys, however, its resolution and velocity analysis accuracy are problems. In particular, propagation characteristics of electromagnetic wave in media such as heterogeneous and anisotropic soil and rock are essential. The behavior of electromagnetic wave in the ground could be precisely reproduced by 3-D numerical modeling using FDTD method. FDTD method makes precise analysis in time domain and electric and magnetic fields possible by sequentially calculating the difference equation of Maxwell`s equation. Because of the high calculation efficiency of FDTD method, more precise complicated analysis can be expected by using the latest advanced computers. The numerical model and calculation example are illustrated for surface type electromagnetic pulse ground penetrating radar assuming the survey of steel pipes of 1m deep. 4 refs., 3 figs., 1 tab.

  12. Ni cycling in mangrove sediments from New Caledonia

    Science.gov (United States)

    Noël, Vincent; Morin, Guillaume; Juillot, Farid; Marchand, Cyril; Brest, Jessica; Bargar, John R.; Muñoz, Manuel; Marakovic, Grégory; Ardo, Sandy; Brown, Gordon E.

    2015-11-01

    Covering more than 70% of tropical and subtropical coastlines, mangrove intertidal forests are well known to accumulate potentially toxic trace metals in their sediments, and thus are generally considered to play a protective role in marine and lagoon ecosystems. However, the chemical forms of these trace metals in mangrove sediments are still not well known, even though their molecular-level speciation controls their long-term behavior. Here we report the vertical and lateral changes in the chemical forms of nickel, which accumulates massively in mangrove sediments downstream from lateritized ultramafic deposits from New Caledonia, where one of nature's largest accumulations of nickel occurs. To accomplish this we used Ni K-edge Extended X-ray Absorption Fine Structure (EXAFS) spectroscopy data in combination with microscale chemical analyses using Scanning Electron Microscopy coupled with Energy-Dispersive X-ray Spectroscopy (SEM-EDXS). After Principal Component and Target Transform analyses (PCA-TT), the EXAFS data of the mangrove sediments were reliably least-squares fitted by linear combination of 3-components chosen from a large model compound spectral database including synthetic and natural Ni-bearing sulfides, clay minerals, oxyhydroxides, and organic complexes. Our results show that in the inland salt flat Ni is hosted in minerals inherited from the eroded lateritic materials, i.e. Ni-poor serpentine (44-58%), Ni-rich talc (20-31%), and Ni-goethite (18-24%). In contrast, in the hydromorphic sediments beneath the vegetated Avicennia and Rhizophora stands, a large fraction of Ni is partly redistributed into a neoformed smectite pool (20-69% of Ni-montmorillonite), and Ni speciation significantly changes with depth in the sediment. Indeed, Ni-rich talc (25-56%) and Ni-goethite (15-23%) disappear below ∼15 cm depth in the sediment and are replaced by Ni-sorbed pyrite (23-52%) in redox-active intermediate depth layers and by pyrite (34-55%) in the deepest

  13. Effect of Ni4Ti3 precipitation on martensitic transformation in Ti-Ni

    International Nuclear Information System (INIS)

    Zhou, N.; Shen, C.; Wagner, M.F.-X.; Eggeler, G.; Mills, M.J.; Wang, Y.

    2010-01-01

    Precipitation of Ni 4 Ti 3 plays a critical role in determining the martensitic transformation path and temperature in Ni-Ti shape memory alloys. In this study, the equilibrium shape of a coherent Ni 4 Ti 3 precipitate and the concentration and stress fields around it are determined quantitatively using the phase field method. Most recent experimental data on lattice parameters, elastic constants, precipitate-matrix orientation relationship and thermodynamic database are used as model inputs. The effects of the concentration and stress fields on subsequent martensitic transformations are analyzed through interaction energy between a nucleating martensitic particle and the existing microstructure. Results indicate that R-phase formation prior to B19' phase could be attributed to both direct elastic interaction and stress-induced spatial variation in concentration near Ni 4 Ti 3 precipitates. The preferred nucleation sites for the R-phase are close to the broad side of the lenticular-shaped Ni 4 Ti 3 precipitates, where tension normal to the habit plane is highest, and Ni concentration is lowest.

  14. Three dimensional numerical modeling for investigation of fracture zone filled with water by borehole radar; Borehole radar ni yoru gansui hasaitai kenshutsu no sanjigen suchi modeling

    Energy Technology Data Exchange (ETDEWEB)

    Sanada, Y.; Watanabe, T.; Ashida, Y. [Kyoto University, Kyoto (Japan); Hasegawa, K.; Yabuuchi, S. [Power Reactor and Nuclear Fuel Development Corp., Tokyo (Japan)

    1997-05-27

    Water bearing fracture zones existing in rock mass largely influence the underground water flow and dynamic property of rock mass. The detailed survey of the location and size of water bearing fracture zones is an important task in the fields such as civil engineering, environment and disaster prevention. Electromagnetic waves of high frequency zones can be grasped as a wave phenomenon, and the record obtained in the actual measurement is wave forms of time series. In the exploration using borehole radar, this water bearing fracture zone becomes the reflection surface, and also becomes a factor of damping in the transmitted wave. By examining changes which these give to the observed wave forms, therefore, water bearing fracture zones can be detected. This study made three dimensional numerical modeling using the time domain finite difference method, and obtained the same output as the observed wave form obtained using borehole radar. By using this program and changing each of the parameters such as frequency and resistivity in the homogeneous medium, changes of the wave forms were observed. Further, examples were shown of modeling of detection of water bearing fracture zones. 5 refs., 16 figs., 1 tab.

  15. Development of the electromagnetic tomography system. Sensitivity study of anomalous body by model studies; EM tomography system no kaihatsu. Model kaiseki ni yoru ijotai no kando chosa kekka

    Energy Technology Data Exchange (ETDEWEB)

    Kumekawa, Y.; Miura, Y.; Takasugi, S. [Geothermal Energy Research and Development Co. Ltd., Tokyo (Japan); Arai, E. [Metal Mining Agency of Japan, Tokyo (Japan)

    1996-05-01

    An examination was made by a model analysis on sensitivity and the like against a resistive anomalous body, in connection with an electromagnetic tomography system with surface earthquake sources and underground receiver arrangements. A resistivity model was of a three-dimensional structure, and built with a 5 ohm{center_dot}m low resistivity anomalous body assembled in a 100 ohm{center_dot}m homogeneous medium. As a result of the examination, it was shown that the size limitation of an analyzable anomalous body was 50{times}50{times}20m at a frequency of 8 to 10kHz and that a system with high precision in a high frequency range was necessary. The examination of effects under a shallow anomalous body revealed, for example, that the fluctuation of a low frequency response was large compared with a deep anomalous body and that, where a second anomalous body existed under it, the effect also appeared with a surface earthquake source positioned in the opposite side from the anomalous body. The examination of effects under the three dimensional structure revealed, for example, that a remarkable change appeared in the data with the change in the inclined angle of the transmission line against the strike of the anomalous body. 4 refs., 7 figs.

  16. Estimation of particle velocity in moving beds based on a flow model for bulk solids. Ryudo model ni motozuita idoso no ryushi sokudo no suisan

    Energy Technology Data Exchange (ETDEWEB)

    Takahashi, H. (Muroran Inst. of Tech., Hokkaido (Japan)); Honda, Y. (Snow Brand Milk Products Co. Ltd., Sapporo (Japan))

    1992-11-10

    Based on a particle flow model (stress-shear strain velocity relational expression) which takes account of the bulk volume expansion effect during shearing deformation of particles, a new estimation method for particle velocity distribution and stress distribution is proposed. The method is applied to a crossflow moving bed and to a moving bed for comparison with the experimental values to examine its validity. The method is further extended to predict the velocity profile and stress profile of moving beds in a vertical tube (countercurrent and concurrent) accompanying gas flow. It is indicated that the bulk volume expansion effect differs according to dimensions. The velocity distribution and the stress distribution of flows in a vertical tube are greatly influenced by the nature of the flow, i.e. whether it is a counterflow or a concurrent flow, and the frictional force of solids on a wall surface increases markedly in a concurrent flow, which induces considerable lag of particle velocity. The parameter which is contained in the model and indicates the bulk volume expansion effect is a function of the particle velocity, and it is almost unaffected by the flow rate of gas moving. 7 refs., 10 figs.

  17. Electroplating condition for Ni nanocrystalline on metal (Ni and Cu) plates

    Energy Technology Data Exchange (ETDEWEB)

    Park, Keun Yung; Uhm, Young Rang; Son, Kwang Jae; Shim, Young Ho; Choi, Sun Ju [KAERI, Daejeon (Korea, Republic of)

    2012-10-15

    . The proposed model can also be applied for radioactive Ni 63 electroplating.

  18. Electroplating condition for Ni nanocrystalline on metal (Ni and Cu) plates

    International Nuclear Information System (INIS)

    Park, Keun Yung; Uhm, Young Rang; Son, Kwang Jae; Shim, Young Ho; Choi, Sun Ju

    2012-01-01

    . The proposed model can also be applied for radioactive Ni 63 electroplating

  19. Preparation of one-step NiO/Ni-CGO composites using factorial design; Efeitos do processamento e do teor de formador de poros na microestrutura de cermets Ni-CGO

    Energy Technology Data Exchange (ETDEWEB)

    Araujo, A.J.M. de; Sousa, A R.O. de; Camposa, L.F.A.; Macedo, D.A. [Universidade Federal da Paraiba (UFPB), Joao Pessoa, PB (Brazil); Loureiro, F. J.A.; Fagg, D.P., E-mail: allanjp1993@hotmail.com [Universidade de Aveiro (Portugal)

    2016-07-01

    This work deals with the synthesis, processing and characterization of NiO/Ni- CGO composite materials as potential solid oxide fuel cell (SOFC) anodes. The particulate materials were obtained by a one-step synthesis method and characterized by thermal analysis (prior to calcination) and X-ray diffraction (calcined powder). The ceramic processing of samples containing from 30 to 70 wt.% NiO was carried out by factorial design. Besides the NiO content controlled during the chemical synthesis, the impacts of the pore-former content (citric acid, used in proportions of 0, 7.5 and 15 wt.%) and the sintering temperature (1300, 1350 and 1400 °C) were also investigated. The open porosity of NiO-CGO composites and reduced Ni-CGO cermets was modeled as a function of factors (NiO content, citric acid content and sintering temperature) and interaction of factors. (author)

  20. Synthesis and magnetic characterization of Sr-based Ni2X-type hexaferrite

    Directory of Open Access Journals (Sweden)

    K. Kamishima

    2015-10-01

    Full Text Available We have investigated the synthesis conditions, and the magnetic properties of the Sr2Ni2X-type hexagonal ferrite, Sr2Ni2Fe28O46. The Sr2Ni2X-type hexaferrite was synthesized at 1240∘C. The spontaneous magnetization at 5 K was 44.2 μB/f.u., suggesting that most of the Ni2+ ions are at the up-spin octahedral sites in the spinel-structure blocks within the model of a Néel-type collinear ferrimagnetic structure. The Curie temperature of the Sr2Ni2X-type hexaferrite was estimated to be TC[Sr2Ni2X] = 472∘C. This is consistent with the difference of the block stacking structures of SrM-type, Sr2Ni2X-type, SrNi2W-type, and nickel spinel ferrites.

  1. Neutron diffraction studies of atomic structures of amorphous Fe-Ge and Ni-Ge alloys

    International Nuclear Information System (INIS)

    Yamada, Kazuyoshi; Endoh, Yasuo; Ishikawa, Yoshikazu; Watanabe, Noboru.

    1980-01-01

    The structures of Ge rich amorphous Fe-Ge and Ni-Ge alloys were studied by pulsed neutron total scattering. The partial structure factors of S sub(GeGe)(Q), S sub(NiGe)(Q) and S sub(NiNi)(Q) were determined successfully by using Ni 60 isotope for the Ni-Ge alloys. The Ge atoms in the 10 at% Ni-Ge amorphous alloy were found to construct a similar atomic structure as that of the amorphous Ge, while the intermediate short range order configuration between the tetrahedral random network (TRN) and the dense random packing (DRP) structure was found for the 30 at% Ni-Ge alloy. The Ge-Ge pair correlation for this intermediate short range order could well be reproduced by the modified Ge II microcrystalline model. (author)

  2. Strengthening by ordered precipitates in a Ni--Ni4Mo system

    International Nuclear Information System (INIS)

    Goodrum, J.W.; LeFevre, B.G.

    1977-01-01

    The strength characteristics and microstructures of aged Ni-Mo alloys containing ordered (Ni 4 Mo) precipitates were studied as a function of aging time and temperature. It was found that 17 at. percent Mo alloy aged at 750 0 C produced a uniform dispersion of cuboidal β precipitates which coarsened with time producing a gradual increase in flow stress. The flow stress increment was found to vary in qualitative agreement with both order strengthening and coherency strain models. Both these models give over-estimates of the strengthening increment. A negative dependence of flow stress on temperature is attributed to coherency strain contributions

  3. Adsorption of Cs{sup +}, Ni{sup 2+} and lanthanides onto a kaolinite and Na-montmorillonite up to 150{sup 0}C: an experimental and modeling study; Adsorption de Cs{sup +}, Ni{sup 2+} et des lanthanides sur une kaolinite et une smectite jusqu'a 150{sup 0}C: etude experimentale et modelisation

    Energy Technology Data Exchange (ETDEWEB)

    Tertre, E

    2005-10-15

    The motivation for this study is to assess the temperature effect on the clay minerals sorption properties. Sorption and desorption of Cs{sup +}, Ni{sup 2+} et Ln{sup 3+} onto a montmorillonite and a kaolinite were performed by batch experiments between 25 and 150 C, and in different pH and ionic strengths conditions. Sorption enthalpies varying between 0 and 80 kJ/mol were then calculated. For europium, surface spectroscopic analyses confirmed that the mechanism involved is adsorption, including at 150 C. Moreover, this method allowed us to obtain qualitatively the different adsorption equilibrium occurring during the reaction. An acid/base study of the clay surfaces was performed in order to assess the temperature effect on the surface charge of these minerals. Then, a surface complexation model including edge sites and structural sites was proposed to interpret the acid/base data and the europium sorption data. (author)

  4. Application of Zr/Ti-Pic in the adsorption process of Cu(II), Co(II) and Ni(II) using adsorption physico-chemical models and thermodynamics of the process; Aplicacao de Zr/Ti-PILC no processo de adsorcao de Cu(II), Co(II) e Ni(II) utilizando modelos fisico-quimicos de adsorcao e termodinamica do processo

    Energy Technology Data Exchange (ETDEWEB)

    Guerra, Denis Lima; Airoldi, Claudio [Universidade Estadual de Campinas (UNICAMP), SP (Brazil). Inst. de Quimica. Dept. de Quimica Inorganica]. E-mail: dlguerra@iqm.unicamp.br; Lemos, Vanda Porpino; Angelica, Romulo Simoes [Universidade Federal do Para (UFPa), Belem (Brazil); Viana, Rubia Ribeiro [Universidade Federal do Mato Grosso (UFMT), Cuiaba (Brazil). Inst. de Ciencias Exatas e da Terra. Dept. de Recursos Minerais

    2008-07-01

    The aim of this investigation is to study how Zr/Ti-Pic adsorbs metals. The physico-chemical proprieties of Zr/Ti-Pic have been optimized with pillarization processes and Cu(II), Ni(II) and Co(II) adsorption from aqueous solution has been carried out, with maximum adsorption values of 8.85, 8.30 and 7.78 x-1 mmol g{sup -1}, respectively. The Langmuir, Freundlich and Temkin adsorption isotherm models have been applied to fit the experimental data with a linear regression process. The energetic effect caused by metal interaction was determined through calorimetric titration at the solid-liquid interface and gave a net thermal effect that enabled the calculation of the exothermic values and the equilibrium constant. (author)

  5. Diffraction model analysis of vector polarized 6Li elastic scattering on 12C, 16O, 28Si, and 58Ni nuclei

    International Nuclear Information System (INIS)

    Rabie, A.; El-Gazzar, M.A.; Abul-Magd, A.Y.

    1980-11-01

    Using an assumption concerning the spin-orbit potential, it was possible to reduce the five amplitudes of scattering of spin-1 projectiles to two amplitudes. The summations over the partial waves were evaluated by the Regge pole technique. The resulting simple expressions were used to analyze the data of the Heidelberg group for polarized 6 Li ions scattered on 12 C, 16 O, 28 Si and 58 Ni to give a reasonable fitting both for the differential cross-section and vector polarization. (author)

  6. Cr, Cu, Hg and Ni release from incineration bottom ash during utilization in land reclamation - based on lab-scale batch and column leaching experiments and a modeling study.

    Science.gov (United States)

    Yin, Ke; Chan, Wei Ping; Dou, Xiaomin; Ren, Fei; Wei-Chung Chang, Victor

    2018-04-01

    Incineration bottom ash (IBA) as potential material for land reclamation was investigated, based on leaching tests, sorption studies and simulation models. Based on batch and column leaching tests, Cr, Cu, Hg and Ni in the IBA leachates were measured as high as 510 μg/L, 20330 μg/L, 5.1 μg/L and 627 μg/L, respectively, presenting potential environmental risks. Sorption study was then performed with various concentrations of IBA leachates on sands and excavated materials. Partitioning coefficients of targeting metals were determined to be 6.5 (Cr), 18.4 (Cu), 16.6 (Hg), and 1.8 (Ni) for sands, while 17.4 (Cr), 13.6 (Cu), 67.1 (Hg), and 0.9 (Ni) for excavated materials, much lower than literature in favor of their transportation. Deterministic and Monte Carlo simulation was further performed under designated boundaries, combined with measured geotechnical parameters: density, porosity, permeability, partitioning coefficient, observed diffusivity, hydraulic gradient, etc., to quantitatively predict metals' fate during IBA land reclamation. Environmental risks were quantitatively unveiled in terms of predicted time of breakthrough for the targeting metals (comparing to US EPA criterion for maximum or continuous concentration). Sands were of little effects for all metals' breakthrough (1 month or less) under advection, while excavated materials sufficiently retained metals from thousands up to millions of years, under diffusion or advection. Permeability next to the IBA layer as the major risk-limiting factor, dominated transport of IBA leachates into the field. The current study provides discrimination of environmental risks associated with metals and a quantitative guidance of project design for IBA utilization in land reclamation. Copyright © 2018 Elsevier Ltd. All rights reserved.

  7. OAM system based on TMN for utility telecommunication network. Proposal of modeling method about managed objects; TMN ni motozuku denryoku tsushinmo no un`yo kanri system. Kanri object no sekkei shuho ni kansuru kento

    Energy Technology Data Exchange (ETDEWEB)

    Hirozawa, T.; Yusa, H.; Otani, T. [Central Research Institute of Electric Power Industry, Tokyo (Japan); Okamura, K. [Tokyo Electric Power Co. Inc., Tokyo (Japan)

    1996-03-01

    To construct an advanced operation and management system for utility telecommunications management network (TMN), this paper proposes a modeling method of managed objects (MOs) required for managing and managed systems, such as an asynchronous transmission mode (ATM) exchanger. Flexible line setting and path switching control are required for the advanced TMN, which must cope with the extension and modification of functions, flexibly. Assignment of roles of managing sides and managed sides was determined. Then, structures of objects such as facilities and logic data, and their interaction were modeled. Common management functions and objects of each function were classified. Based on the TMN standard and MOs of the existing design peculiar to utility, new MOs peculiar to utility were defined in response to the models. The existing MOs can be effectively utilized, and the optimum MOs to be incorporated can be expected. The MOs peculiar to utility are added to the common specification of electric power industry. Since they can be reused for the extension and modification of functions, the cost can be reduced. The MOs applicable to path switching control of utility were designed as a trial. 9 refs., 16 figs., 10 tabs.

  8. Fiscal 1993 investigational study of a model of international cooperation for an environmentally harmony type green technosystem; 1993 nendo Oshu ni okeru haikibutsu shori oyobi recycle no doko ni kansuru chosa kenkyu hokokusho

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1994-03-01

    For the natural environment preservation, effective utilization of resources, and maintenance of the ecosystem, an international cooperation model was proposed for the environmental harmony type green technosystem. A comprehensive evaluating analysis of a green forest resource, etc. as the global resource, and an intensive extraction of subjects and needs was made. The analysis was conducted of technical possibility and abstract business development effects toward the industrialization with high values added which is in harmony with the environment. As a case study, the Papua New Guinea area, Malaysia was selected and re-evaluated. For this typical tropical forest area, a new technical system was studied based on the natural environment, industry/economy, social/cultural assessment, etc., and a model for industrializing new international cooperation was proposed. For the model making for industrialization, various steps to be taken and conditions to be prepared were studied and arranged for the realization. Upon going ahead with the international technical cooperation, Japan, a large lumber consuming country, needs to always consider the fostering and effective use of lumber resource in particular. 27 refs., 28 figs., 30 tabs.

  9. Microstructure investigation of NiAl-Cr(Mo) interface in a directionally solidified NiAl-Cr(Mo) eutectic alloyed with refractory metal

    International Nuclear Information System (INIS)

    Chen, Y.X.; Cui, C.Y.; Guo, J.T.; Li, D.X.

    2004-01-01

    The microstructure of a directionally solidified NiAl-Cr(Mo) eutectic alloyed with refractory metal in as-processed and heat-treated states has been studied by means of scanning electron microscopy and high resolution electron microscopy (HREM). The microstructure of the NiAl-Cr(Mo) eutectic was characterized by lamellar Cr(Mo) phases embedded within NiAl matrix with common growth direction of . The interface between NiAl and lamellar Cr(Mo) did not have any transition layers. Misfit dislocations were observed at the NiAl-Cr(Mo) interface. In addition to lamellar Cr(Mo) phases, coherent Cr(Mo, Ni, Al) precipitates and NiAl precipitates were also observed in the NiAl matrix and lamellar Cr(Mo) phases, respectively. After hot isostatic pressing and heat treatment, the NiAl-Cr(Mo) interfaces became smooth and straight. Square array of misfit dislocations was directly observed at the (0 0 1) interface between NiAl and Cr(Mo, Ni, Al) precipitate. The configuration of misfit dislocation network showed a generally good agreement with prediction based on the geometric O-lattice model

  10. On the hydroelastic response of box-shaped floating structure with shallow draft. Tank test with large scale model; Senkitsusui hakogata futai no harochu dansei oto ni tsuite. Ogata mokei ni yoru suiso shiken

    Energy Technology Data Exchange (ETDEWEB)

    Yago, K.; Endo, H. [Ship Research Inst., Tokyo (Japan)

    1996-12-31

    The hydroelastic response test was carried out in waves using an approximately 10m long large model, and the numerical analysis was done by the direct method, for a commercial-size (300m long) box-shaped floating structure with shallow draft. The scale ratio of the model is 1/30.8, and the minimum wave cycle is around 0.7s from wave-making capacity of the tank, which corresponds to 4 to 14s with the commercial-size structure. Elastic displacement and bending strain were measured. The calculated results by the direct method are in good agreement with the observed results. The fluid dynamic mutual interference effects between elements are weak in added mass but strong in damping force, indicating that the range of mutual interference is strongly related to rolling cycle in the range of mutual interference. Wave pressure on the floating structure bottom is high at the upper side of the wave, greatly damping towards the downside of the wave. However, response amplitude of elastic displacement tends to increase at the ends, both in upside and downside of the wave. For the floating structure studied, the 0 to 4th mode components are predominant in longitudinal waves, and the 6th or higher mode components are negligibly low. 21 refs., 15 figs., 2 tabs.

  11. Modelling radiation-induced phase changes in binary FeCu and ternary FeCuNi alloys using an artificial intelligence-based atomistic kinetic Monte Carlo approach

    Science.gov (United States)

    Castin, N.; Malerba, L.; Bonny, G.; Pascuet, M. I.; Hou, M.

    2009-09-01

    We apply a novel atomistic kinetic Monte Carlo model, which includes local chemistry and relaxation effects when assessing the migration energy barriers of point defects, to the study of the microchemical evolution driven by vacancy diffusion in FeCu and FeCuNi alloys. These alloys are of importance for nuclear applications because Cu precipitation, enhanced by the presence of Ni, is one of the main causes of hardening and embrittlement in reactor pressure vessel steels used in existing nuclear power plants. Local chemistry and relaxation effects are introduced using artificial intelligence techniques, namely a conveniently trained artificial neural network, to calculate the migration energy barriers of vacancies as functions of the local atomic configuration. We prove, through a number of results, that the use of the neural network is fully equivalent to calculating the migration energy barriers on-the-fly, using computationally expensive methods such as nudged elastic bands with an interatomic potential. The use of the neural network makes the computational cost affordable, so that simulations of the same type as those hitherto carried out using heuristic formulas for the assessment of the energy barriers can now be performed, at the same computational cost, using more rigorously calculated barriers. This method opens the way to properly treating more complex problems, such as the case of self-interstitial cluster formation, in an atomistic kinetic Monte Carlo framework.

  12. Modelling radiation-induced phase changes in binary FeCu and ternary FeCuNi alloys using an artificial intelligence-based atomistic kinetic Monte Carlo approach

    International Nuclear Information System (INIS)

    Castin, N.; Malerba, L.; Bonny, G.; Pascuet, M.I.; Hou, M.

    2009-01-01

    We apply a novel atomistic kinetic Monte Carlo model, which includes local chemistry and relaxation effects when assessing the migration energy barriers of point defects, to the study of the microchemical evolution driven by vacancy diffusion in FeCu and FeCuNi alloys. These alloys are of importance for nuclear applications because Cu precipitation, enhanced by the presence of Ni, is one of the main causes of hardening and embrittlement in reactor pressure vessel steels used in existing nuclear power plants. Local chemistry and relaxation effects are introduced using artificial intelligence techniques, namely a conveniently trained artificial neural network, to calculate the migration energy barriers of vacancies as functions of the local atomic configuration. We prove, through a number of results, that the use of the neural network is fully equivalent to calculating the migration energy barriers on-the-fly, using computationally expensive methods such as nudged elastic bands with an interatomic potential. The use of the neural network makes the computational cost affordable, so that simulations of the same type as those hitherto carried out using heuristic formulas for the assessment of the energy barriers can now be performed, at the same computational cost, using more rigorously calculated barriers. This method opens the way to properly treating more complex problems, such as the case of self-interstitial cluster formation, in an atomistic kinetic Monte Carlo framework.

  13. Modelling radiation-induced phase changes in binary FeCu and ternary FeCuNi alloys using an artificial intelligence-based atomistic kinetic Monte Carlo approach

    Energy Technology Data Exchange (ETDEWEB)

    Castin, N. [Structural Materials Group, Nuclear Materials Science Institute, Kernenergie Centre d' Etude de l' Energie Nucleaire (SCK CEN), Studiecentrum voor, Boeretang 200, 2400 Mol (Belgium); Physique des Solides Irradies et des Nanostructures (PSIN), Universite Libre de Bruxelles (ULB), Boulevard du Triomphe CP234, 1050 Brussels (Belgium); Malerba, L. [Structural Materials Group, Nuclear Materials Science Institute, Kernenergie Centre d' Etude de l' Energie Nucleaire (SCK CEN), Studiecentrum voor, Boeretang 200, 2400 Mol (Belgium)], E-mail: lmalerba@sckcen.be; Bonny, G. [Structural Materials Group, Nuclear Materials Science Institute, Kernenergie Centre d' Etude de l' Energie Nucleaire (SCK CEN), Studiecentrum voor, Boeretang 200, 2400 Mol (Belgium); Laboratory of Theoretical Physics, Universiteit Gent, Proeftuinstraat 86, B-9000 Gent (Belgium); Pascuet, M.I. [Structural Materials Group, Nuclear Materials Science Institute, Kernenergie Centre d' Etude de l' Energie Nucleaire (SCK CEN), Studiecentrum voor, Boeretang 200, 2400 Mol (Belgium); CAC-CNEA, Departamento de Materiales, Avda. Gral. Paz 1499, 1650 San Martin, Pcia. Buenos Aires (Argentina); CONICET, Avda. Rivadavia 1917, 1033 Buenos Aires (Argentina); Hou, M. [Physique des Solides Irradies et des Nanostructures (PSIN), Universite Libre de Bruxelles (ULB), Boulevard du Triomphe CP234, 1050 Brussels (Belgium)

    2009-09-15

    We apply a novel atomistic kinetic Monte Carlo model, which includes local chemistry and relaxation effects when assessing the migration energy barriers of point defects, to the study of the microchemical evolution driven by vacancy diffusion in FeCu and FeCuNi alloys. These alloys are of importance for nuclear applications because Cu precipitation, enhanced by the presence of Ni, is one of the main causes of hardening and embrittlement in reactor pressure vessel steels used in existing nuclear power plants. Local chemistry and relaxation effects are introduced using artificial intelligence techniques, namely a conveniently trained artificial neural network, to calculate the migration energy barriers of vacancies as functions of the local atomic configuration. We prove, through a number of results, that the use of the neural network is fully equivalent to calculating the migration energy barriers on-the-fly, using computationally expensive methods such as nudged elastic bands with an interatomic potential. The use of the neural network makes the computational cost affordable, so that simulations of the same type as those hitherto carried out using heuristic formulas for the assessment of the energy barriers can now be performed, at the same computational cost, using more rigorously calculated barriers. This method opens the way to properly treating more complex problems, such as the case of self-interstitial cluster formation, in an atomistic kinetic Monte Carlo framework.

  14. Solubility Modeling of the Systems Ni(NO3)2–H2O and Fe(NO3)3–Ni(NO3)2–H2O with the Extended Universal Quasichemical (UNIQUAC) Model

    DEFF Research Database (Denmark)

    Arrad, Mouad; Kaddami, Mohammed; El Goundali, Bahija

    2017-01-01

    regressed simultaneously using the available databank but with additional experimental data recently published in the open literature. A revision for previously published parameters for the nickel ion, new parameters for the iron(III) nitrate system, and interaction parameters for the Ni2+–Fe3+ interaction...

  15. Theory of Valence Transition in BiNiO$_3$

    OpenAIRE

    Naka, Makoto; Seo, Hitoshi; Motome, Yukitoshi

    2015-01-01

    Motivated by the colossal negative thermal expansion recently found in BiNiO$_3$, the valence transition accompanied by the charge transfer between the Bi and Ni sites is theoretically studied. We introduce an effective model for Bi-$6s$ and Ni-$3d$ orbitals with taking into account the valence skipping of Bi cations, and investigate the ground-state and finite-temperature phase diagrams within the mean-field approximation. We find that the valence transition is caused by commensurate locking...

  16. Developing of complex for hot plastic deformation modeling of steel type 20-30CrNiMoV for heavy forging

    Directory of Open Access Journals (Sweden)

    Dub Vladimir

    2017-01-01

    Full Text Available Production of heavy forging of bars weighing more then 235 tons for such products as rotors made of steel type 20-30CrNiMoV is a critical independent work, failure to perform which entails high costs related to repeated production (in case of defective product and untimely launch of production plants. One of the frequent causes of a defective product is the impossibility of ultrasonic testing in the barrel-gate zones on the rotor workpiece, which is due to the microstructure of the metal, namely the grain size. Determing the stages of deformation process wich causes such defects in structure is the main goal of this work.

  17. Breakdown of antiferromagnet order in polycrystalline NiFe/NiO bilayers probed with acoustic emission

    Science.gov (United States)

    Lebyodkin, M. A.; Lebedkina, T. A.; Shashkov, I. V.; Gornakov, V. S.

    2017-07-01

    Magnetization reversal of polycrystalline NiFe/NiO bilayers was investigated using magneto-optical indicator film imaging and acoustic emission techniques. Sporadic acoustic signals were detected in a constant magnetic field after the magnetization reversal. It is suggested that they are related to elastic waves excited by sharp shocks in the NiO layer with strong magnetostriction. Their probability depends on the history and number of repetitions of the field cycling, thus testifying the thermal-activation nature of the long-time relaxation of an antiferromagnetic order. These results provide evidence of spontaneous thermally activated switching of the antiferromagnetic order in NiO grains during magnetization reversal in ferromagnet/antiferromagnet (FM/AFM) heterostructures. The respective deformation modes are discussed in terms of the thermal fluctuation aftereffect in the Fulcomer and Charap model which predicts that irreversible breakdown of the original spin orientation can take place in some antiferromagnetic grains with disordered anisotropy axes during magnetization reversal of exchange-coupled FM/AFM structures. The spin reorientation in the saturated state may induce abrupt distortion of isolated metastable grains because of the NiO magnetostriction, leading to excitation of shock waves and formation of plate (or Lamb) waves.

  18. High resolution TEM study of Ni4Ti3 precipitates in austenitic Ni51Ti49

    International Nuclear Information System (INIS)

    Tirry, Wim; Schryvers, Dominique

    2003-01-01

    Binary NiTi with a composition of 51 at.% Ni was heat treated to form lens-shaped Ni 4 Ti 3 precipitates that are coherent or semi-coherent with the B2 matrix. High resolution transmission electron microscopy (HRTEM) was used to study the internal structure of the precipitates, precipitate-precipitate and matrix-precipitate interfaces and the deformation of the B2 matrix near a precipitate. Observations were made in the B2 and B2 zones and compared with computer simulated high resolution images. The B2 observations made it possible to study the [0 0 1] H zone orientation of Ni 4 Ti 3 (direction defined according to the hexagonal unit cell of Ni 4 Ti 3 ) which corresponds to the normal of the central plane of the discs. In these images the superperiodicity of the 4:3 ordering is clearly visible confirming the known atomic structure. Close to the precipitate the B2 matrix is deformed, as determined by measuring the interplanar spacing from the HRTEM images. The observed deformations are compared with theoretical models for the stress field

  19. Linear thermal expansion coefficient of cast Fe-Ni invar and Fe-Ni-Co superinvar alloys

    International Nuclear Information System (INIS)

    Ogorodnikova, O.M.; Chermenskaya, E.V.; Rabinovich, S.V.; Grachev, S.V.

    1999-01-01

    Cast invar alloys Fe-Ni (28-35 wt. % Ni) are investigated using metallography, dilatometry and X-ray methods as soon as the crystallization is completed and again after low-temperature treatment resulting in martensitic transformation in low nickel alloys. Nickel distribution in a cast superinvar Fe-32% Ni-4% Co is studied by means of X-ray spectrum microanalysis. The results obtained permit the correction of model concepts about cast invars and the estimate of a coefficient of linear expansion depending on phase composition and nickel microsegregation [ru

  20. Reduction mechanism of Ni2+ into Ni nanoparticles prepared from ...

    Indian Academy of Sciences (India)

    journal of. March 2009 physics pp. 577–586. Reduction mechanism of Ni2+ into Ni nanoparticles prepared from different precursors: Magnetic studies ... 2Department of Chemistry, Indian Institute of Technology, Kanpur 208 016, India ..... this work and Avanti, Analytical Chemistry Division, BARC for her help in cyclic.

  1. Reactions at the Ni-ZrO2 interface

    International Nuclear Information System (INIS)

    Shinde, S.L.; Reimanis, I.E.; DeJonghe, L.C.

    1985-01-01

    The degradation of metal-ceramic interface at elevated temperatures in protective ceramic coatings limits their life-time. A model system of nickel particles dispersed in a zirconia matrix is used to resolve these changes. Oxidation at elevated temperatures (900 0 C) leads to NiO growth at the interface. The matrix is destabilized when the stabilizer is soluble in NiO, resulting in transformation to deleterious monoclinic phase which is found to be one important reason for interface degradation

  2. Acute Toxicity of Ternary Cd-Cu-Ni and Cd-Ni-Zn Mixtures to Daphnia magna: Dominant Metal Pairs Change along a Concentration Gradient.

    Science.gov (United States)

    Traudt, Elizabeth M; Ranville, James F; Meyer, Joseph S

    2017-04-18

    Multiple metals are usually present in surface waters, sometimes leading to toxicity that currently is difficult to predict due to potentially non-additive mixture toxicity. Previous toxicity tests with Daphnia magna exposed to binary mixtures of Ni combined with Cd, Cu, or Zn demonstrated that Ni and Zn strongly protect against Cd toxicity, but Cu-Ni toxicity is more than additive, and Ni-Zn toxicity is slightly less than additive. To consider multiple metal-metal interactions, we exposed D. magna neonates to Cd, Cu, Ni, or Zn alone and in ternary Cd-Cu-Ni and Cd-Ni-Zn combinations in standard 48 h lethality tests. In these ternary mixtures, two metals were held constant, while the third metal was varied through a series that ranged from nonlethal to lethal concentrations. In Cd-Cu-Ni mixtures, the toxicity was less than additive, additive, or more than additive, depending on the concentration (or ion activity) of the varied metal and the additivity model (concentration-addition or independent-action) used to predict toxicity. In Cd-Ni-Zn mixtures, the toxicity was less than additive or approximately additive, depending on the concentration (or ion activity) of the varied metal but independent of the additivity model. These results demonstrate that complex interactions of potentially competing toxicity-controlling mechanisms can occur in ternary-metal mixtures but might be predicted by mechanistic bioavailability-based toxicity models.

  3. Reactive Ni/Ti nanolaminates

    International Nuclear Information System (INIS)

    Adams, D. P.; Bai, M. M.; Rodriguez, M. A.; McDonald, J. P.; Jones, E. Jr.; Brewer, L.; Moore, J. J.

    2009-01-01

    Nickel/titanium nanolaminates fabricated by sputter deposition exhibited rapid, high-temperature synthesis. When heated locally, self-sustained reactions were produced in freestanding Ni/Ti multilayer foils characterized by average propagation speeds between ∼0.1 and 1.4 m/s. The speed of a propagating reaction front was affected by total foil thickness and bilayer thickness (layer periodicity). In contrast to previous work with compacted Ni-Ti powders, no preheating of Ni/Ti foils was required to maintain self-propagating reactions. High-temperature synthesis was also stimulated by rapid global heating demonstrating low ignition temperatures (T ig )∼300-400 deg. C for nanolaminates. Ignition temperature was influenced by bilayer thickness with more coarse laminate designs exhibiting increased T ig . Foils reacted in a vacuum apparatus developed either as single-phase B2 cubic NiTi (austenite) or as a mixed-phase structure that was composed of monoclinic B19 ' NiTi (martensite), hexagonal NiTi 2 , and B2 NiTi. Single-phase, cubic B2 NiTi generally formed when the initial bilayer thickness was made small.

  4. Plasticity and microstructure of epitaxial Ag/Ni multilayers; Mechanische Eigenschaften und Mikrostruktur epitaktischer Ag/Ni-Multilagenschichten

    Energy Technology Data Exchange (ETDEWEB)

    Schmidt, Tobias K.

    2007-10-15

    To meet the still increasing technical demands of new materials, it is required to improve basic knowledge of thin films and multilayers. This thesis describes the microstructure and mechanical behaviour of thin epitaxial Ag/Ni-multilayers. Former investigations were only done on polycrystalline multilayers or epitaxial single layers. The manufacture of epitaxial Ag/Ni-multilayers on (111) orientated Si-substrates was performed by a magnetron sputtering technique under ultra high vacuum (UHV). The thickness of the alternating Ag- and Ni-layers varies between 100 and 400 nm, the thickness of the whole film varies between 200 and 800 nm. Hardness and flow stress of Ag/Ni-multilayers were measured with a nanoindentation technique, a substrate curvature method and by X-ray diffraction. The hardness of these multilayers varies between 1.5 and 2.0 GPa. The Ag single film hardness is 0.5 GPa and Ni film 1.8 GPa. The flow stress of the Ag/Ni-multilayers varies between 350 and 800 MPa. The Ag single layer shows a flow stress of 100 MPa and Ni of 450 MPa. Both hardness and flow stress increase with decreasing layer thickness. In situ TEM and HRTEM experiments showed a semicoherent Ag/Ni-interface. It was observed that these interfaces act as sources and sinks. Dislocation loops formed at the interface expand and shrink according to the stress state. They combine with loops from the opposite interface or with the interface itself and form threading dislocations. Dislocation loops penetrating an interface were not observed. Results were compared with various models which simulate flow stress in thin films and multilayers. The most important models are calculated by Nix-Freund, the Source-model after von Blanckenhagen and the Hall-Petch-model. (orig.)

  5. Modeling the amorphous structure of mechanically alloyed Ti{sub 50}Ni{sub 25}Cu{sub 25} using anomalous wide-angle x-ray scattering and reverse Monte Carlo simulation

    Energy Technology Data Exchange (ETDEWEB)

    Lima, J.C. de, E-mail: fsc1jcd@fisica.ufsc.br [Departamento de Física, Universidade Federal de Santa Catarina, Campus Universitário Trindade, S/N, C.P. 476, 88040-900 Florianópolis, Santa Catarina (Brazil); Poffo, C.M. [Departamento de Engenharia Mecânica, Universidade Federal de Santa Catarina, Campus Universitário Trindade, S/N, C.P. 476, 88040-900 Florianópolis, Santa Catarina (Brazil); Departamento de Física, Universidade Federal do Amazonas, 3000 Japiim, 69077-000 Manaus, Amazonas (Brazil); Souza, S.M. [Departamento de Física, Universidade Federal do Amazonas, 3000 Japiim, 69077-000 Manaus, Amazonas (Brazil); Machado, K.D. [Departamento de Física, Centro Politécnico, Universidade Federal do Paraná, 81531-990 Curitiba, Paraná (Brazil); Trichês, D.M. [Departamento de Física, Universidade Federal do Amazonas, 3000 Japiim, 69077-000 Manaus, Amazonas (Brazil); Grandi, T.A. [Departamento de Física, Universidade Federal de Santa Catarina, Campus Universitário Trindade, S/N, C.P. 476, 88040-900 Florianópolis, Santa Catarina (Brazil); Biasi, R.S. de [Seção de Engenharia Mecânica e de Materiais, Instituto Militar de Engenharia, 22290-270 Rio de Janeiro, RJ (Brazil)

    2013-09-01

    An amorphous Ti{sub 50}Ni{sub 25}Cu{sub 25} alloy was produced by 19 h of mechanical alloying. Anomalous wide angle x-ray scattering data were collected at six energies and six total scattering factors were obtained. By considering the data collected at two energies close to the Ni and Cu K edges, two differential anomalous scattering factors about the Ni and Cu atoms were obtained, showing that the chemical environments around these atoms are different. Eight factors were used as input data to the reverse Monte Carlo method used to compute the partial structure factors S{sub Ti3Ti}(K), S{sub Ti–Cu}(K), S{sub Ti–Ni}(K), S{sub Cu3Cu}(K), S{sub Cu–Ni}(K) and S{sub Ni–Ni}(K) and the partial pair distribution functions G{sub Ti3Ti}(r), G{sub Ti–Cu}(r), G{sub Ti–Ni}(r), G{sub Cu3Cu}(r), G{sub Cu–Ni}(r) and G{sub Ni–Ni}(r). From the RMC final atomic configuration and G{sub ij}(r) functions, the coordination numbers and interatomic atomic distances for the first neighbors were determined.

  6. A dynamical atomic simulation for the Ni-Al Wulff nanoparticle

    International Nuclear Information System (INIS)

    Tang, Jianfeng; Yang, Jianyu

    2013-01-01

    Ni-Al bimetallic nanoparticle structures are studied from a kinetic point of view. The diffusion and growth of Ni (or Al) atoms on Al (or Ni) cores with the Wulff structure are simulated by molecular dynamics and nudged elastic band methods. An analytic embedded atom model is applied to the two metals. The energy barriers of several typical diffusion processes of the adatoms on the nanoparticle surface are calculated. Results show that the incorporation of the Ni atoms into the Al core easily occurs, and the reverse process does not readily proceed. The growth simulations reveal that a better core-shell nanoparticle is obtained when the Al atoms are deposited on the Ni core at lower temperatures, and the deposition of the Ni atoms on the Al core leads to an amorphous surface. - Highlights: • The diffusion barrier of Ni (or Al) on Al (or Ni) Wulff nanoparticle is studied. • Ni atom can diffuse easily into Al core, and Al atom generally segregate on surface. • A core-shell nanoparticle is obtained for the deposition of Al atoms on Ni core. • Amorphous nanoparticle surface is obtained by depositing Ni atoms on Al core

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

    Science.gov (United States)

    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.

  8. Atomic model of the F420-reducing [NiFe] hydrogenase by electron cryo-microscopy using a direct electron detector.

    Science.gov (United States)

    Allegretti, Matteo; Mills, Deryck J; McMullan, Greg; Kühlbrandt, Werner; Vonck, Janet

    2014-02-25

    The introduction of direct electron detectors with higher detective quantum efficiency and fast read-out marks the beginning of a new era in electron cryo-microscopy. Using the FEI Falcon II direct electron detector in video mode, we have reconstructed a map at 3.36 Å resolution of the 1.2 MDa F420-reducing hydrogenase (Frh) from methanogenic archaea from only 320,000 asymmetric units. Videos frames were aligned by a combination of image and particle alignment procedures to overcome the effects of beam-induced motion. The reconstructed density map shows all secondary structure as well as clear side chain densities for most residues. The full coordination of all cofactors in the electron transfer chain (a [NiFe] center, four [4Fe4S] clusters and an FAD) is clearly visible along with a well-defined substrate access channel. From the rigidity of the complex we conclude that catalysis is diffusion-limited and does not depend on protein flexibility or conformational changes. DOI: http://dx.doi.org/10.7554/eLife.01963.001.

  9. Modelo conceptual para identificar factores relevantes en la seguridad de los niños en los autobuses escolares Conceptual model for identifying factors relevant to the safety of children in school buses

    Directory of Open Access Journals (Sweden)

    Martha Lucía Bernal

    2010-06-01

    Full Text Available OBJETIVO: Elaborar un modelo conceptual que permita comprender las relaciones entre las variables que llevan a los niños a adoptar posturas en los vehículos de transporte escolar que incrementan los efectos lesivos en caso de accidentes de tránsito. MÉTODOS: Para la identificación de las variables se recolectó información directa de la actividad del transporte escolar por medio de grupos de enfoque, con asistentes de ruta y conductores de estos vehículos, la filmación interior de autobuses durante el transporte de los niños, y el registro de dimensiones de componentes en diferentes tipos de autobuses escolares. El análisis de la información recolectada se hizo mediante el software Atlas ti v6 y, la construcción del modelo, por medio de un proceso deductivo. RESULTADOS: Se encontraron relaciones importantes entre la adopción de posturas potencialmente riesgosas por parte de los niños durante el transporte escolar y las características dimensionales de los asientos y cinturones de seguridad, las características del servicio de transporte y el rol del asistente de ruta. CONCLUSIONES: Para llevar a cabo intervenciones coherentes y específicas en el ámbito de la seguridad en el transporte escolar, se deben considerar no solo aspectos técnicos concernientes al vehículo o condiciones posturales controladas en pruebas de choque en laboratorio, sino también las variables específicas de la actividad que llevan a los niños a adoptar posturas que incrementan el riesgo de lesiones.OBJECTIVE: Prepare a conceptual model that facilitates understanding of the relationships between the variables that lead children to adopt postures in school transportation vehicles that increase injuries in traffic accidents. METHODS: For identification of the variables, direct information on school transportation was collected through focus groups, with bus aides and bus drivers, on-board filming during the transport of children, and recording of the

  10. Effect of interface intermixing on giant magnetoresistance in NiFe/Cu and Co/NiFe/Co/Cu multilayers

    International Nuclear Information System (INIS)

    Nagamine, L.C.C.M.; Biondo, A.; Pereira, L.G.; Mello, A.; Schmidt, J.E.; Chimendes, T.W.; Cunha, J.B.M.; Saitovitch, E.B.

    2003-01-01

    This article reports on the important influence of the spontaneously built-in paramagnetic interfacial layers on the magnetic and magnetoresistive properties of NiFe/Cu and Co/NiFe/Co/Cu multilayers grown by magnetron sputtering. A computational simulation, based on a semiclassical model, has been used to reproduce the variations of the resistivity and of the magnetoresistance (MR) amplitude with the thickness of the NiFe, Cu, and Co layers. We showed that the compositionally intermixed layers at NiFe/Cu interfaces, which are paramagnetic, reduce the flow of polarized electrons and produce a masking on the estimated mean-free path of both types of electrons due to the reduction of their effective values, mainly for small NiFe thickness. Moreover, the transmission coefficients for the electrons decrease when Fe buffer layers are replaced by NiFe ones. This result is interpreted in terms of the variations of the interfacial intermixing and roughness at the interfaces, leading to an increase of the paramagnetic interfacial layer thickness. The effect provoked by Co deposition at the NiFe 16 A/Cu interfaces has also been investigated. The maximum of the MR amplitudes was found at 5 A of Co, resulting in the quadruplication of the MR amplitude. This result is partially attributed to the interfacial spin-dependent scattering due to the increase of the magnetic order at interfaces. Another effect observed here was the increase of the spin-dependent scattering events in the bulk NiFe due to a larger effective NiFe thickness, since the paramagnetic interfacial layer thickness is decreased

  11. Bisamidate and mixed amine/amidate NiN2S2 complexes as models for nickel-containing acetyl coenzyme A synthase and superoxide dismutase: an experimental and computational study.

    Science.gov (United States)

    Mathrubootham, Vaidyanathan; Thomas, Jason; Staples, Richard; McCraken, John; Shearer, Jason; Hegg, Eric L

    2010-06-21

    The distal nickel site of acetyl-CoA synthase (Ni(d)-ACS) and reduced nickel superoxide dismutase (Ni-SOD) display similar square-planar Ni(II)N(2)S(2) coordination environments. One difference between these two sites, however, is that the nickel ion in Ni-SOD contains a mixed amine/amidate coordination motif while the Ni(d) site in Ni-ACS contains a bisamidate coordination motif. To provide insight into the consequences of the different coordination environments on the properties of the Ni ions, we systematically examined two square-planar Ni(II)N(2)S(2) complexes, one with bisthiolate-bisamidate ligation (Et(4)N)(2)(Ni(L1)).2H(2)O (2) [H(4)L1 = N-(2-mercaptoacetyl)-N'-(2-mercaptoethyl)glycinamide] and another with bisthiolate-amine/amidate ligation K(Ni(HL2)) (3) [H(4)L2 = N-(2''-mercaptoethyl)-2-((2'-mercaptoethyl)amino)acetamide]. Although these two complexes differ only by a single amine versus amidate ligand, their chemical properties are quite different. The stronger in-plane ligand field in the bisamidate complex (Ni(II)(L1))(2-) (2) results in an increase in the energies of the d --> d transitions and a considerably more negative oxidation potential. Furthermore, while the bisamidate complex (Ni(II)(L1))(2-) (2) readily forms a trinuclear species (Et(4)N)(2)({Ni(L1)}(2)Ni).H(2)O (1) and reacts rapidly with O(2), presumably via sulfoxidation, the mixed amine/amidate complex (Ni(II)(HL2))(-) (3) remains monomeric and is stable for days in air. Interestingly, the Ni(III) species of the bisamidate complex formed by chemical oxidation with I(2) can be detected by electron paramagnetic resonance (EPR) spectroscopy while the mixed amine/amidate complex immediately decomposes upon oxidation. To explain these experimentally observed properties, we performed S K-edge X-ray absorption spectroscopy and low-temperature (77 K) electronic absorption measurements as well as both hybrid density functional theory (hybrid-DFT) and spectroscopy oriented configuration

  12. Signals of El Niño Modoki in the tropical tropopause layer and stratosphere

    Directory of Open Access Journals (Sweden)

    F. Xie

    2012-06-01

    Full Text Available The effects of El Niño Modoki events on the tropical tropopause layer (TTL and on the stratosphere were investigated using European Center for Medium Range Weather Forecasting (ECMWF reanalysis data, oceanic El Niño indices, and general climate model outputs. El Niño Modoki events tend to depress convective activities in the western and eastern Pacific but enhance convective activities in the central and northern Pacific. Consequently, during El Niño Modoki events, negative water vapor anomalies occur in the western and eastern Pacific upper troposphere, whereas there are positive anomalies in the central and northern Pacific upper troposphere. The spatial patterns of the outgoing longwave radiation (OLR and upper tropospheric water vapor anomalies exhibit a tripolar form. The empirical orthogonal function (EOF analysis of the OLR and upper tropospheric water vapor anomalies reveals that canonical El Niño events are associated with the leading mode of the EOF, while El Niño Modoki events correspond to the second mode. The composite analysis based on ERA-interim data indicate that El Niño Modoki events have a reverse effect on middle-high latitudes stratosphere, as compared with the effect of typical El Niño events, i.e., the northern polar vortex is stronger and colder but the southern polar vortex is weaker and warmer during El Niño Modoki events. According to the simulation' results, we found that the reverse effect on the middle-high latitudes stratosphere is resulted from a complicated interaction between quasi-biennial oscillation (QBO signal of east phase and El Niño Modoki signal. This interaction is not a simply linear overlay of QBO signal and El Niño Modoki signal in the stratosphere, it is El Niño Modoki that leads to different tropospheric zonal wind anomalies with QBO forcing from that caused by typical El Niño, thus, the planetary wave propagation from troposphere to the stratosphere during El Niño Modoki events is

  13. An Update on NiCE Support for BISON

    Energy Technology Data Exchange (ETDEWEB)

    McCaskey, Alex [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Billings, Jay Jay [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Deyton, Jordan H. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Wojtowicz, Anna [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

    2015-09-01

    The Nuclear Energy Advanced Modeling and Simulation program (NEAMS) from the Department of Energy s Office of Nuclear Energy has funded the development of a modeling and simulation workflow environment to support the various codes in its nuclear energy scientific computing toolkit. This NEAMS Integrated Computational Environment (NiCE) provides extensible tools and services that enable efficient code execution, input generation, pre-processing visualizations, and post-simulation data analysis and visualization for a large portion of the NEAMS Toolkit. A strong focus for the NiCE development team throughout FY 2015 has been support for the Multiphysics Object Oriented Simulation Environment (MOOSE) and the NEAMS nuclear fuel performance modeling application built on that environment, BISON. There is a strong desire in the program to enable and facilitate the use of BISON throughout nuclear energy research and industry. A primary result of this desire is the need for strong support for BISON in NiCE. This report will detail improvements to NiCE support for BISON. We will present a new and improved interface for interacting with BISON simulations in a variety of ways: (1) improved input model generation, (2) embedded mesh and solution data visualizations, and (3) local and remote BISON simulation launch. We will also show how NiCE has been extended to provide support for BISON code development.

  14. Effect of temperature and dissolved hydrogen on oxide films formed on Ni and Alloy 182 in simulated PWR water

    International Nuclear Information System (INIS)

    Mendonça, R.; Bosch, R.-W.; Van Renterghem, W.; Vankeerberghen, M.; Araújo Figueiredo, C. de

    2016-01-01

    Alloy 182 is a nickel-based weld metal, which is susceptible to stress corrosion cracking in PWR primary water. It shows a peak in SCC susceptibility at a certain temperature and hydrogen concentration. This peak is related to the electrochemical condition where the Ni to NiO transition takes place. One hypothesis is that the oxide layer at this condition is not properly developed and so the material is not optimally protected against SCC. Therefore the oxide layer formed on Alloy 182 is investigated as a function of the dissolved hydrogen concentration and temperature around this Ni/NiO transition. Exposure tests were performed with Alloy 182 and Ni coupons in a PWR environment at temperatures between 300 °C and 345 °C and dissolved hydrogen concentration between 5 and 35 cc (STP)H 2 /kg. Post-test analysis of the formed oxide layers were carried out by SEM, EDS and XPS. The exposure tests with Ni coupons showed that the Ni/NiO transition curve is at a higher temperature than the curve based on thermodynamic calculations. The exposure tests with Alloy 182 showed that oxide layers were present at all temperatures, but that the morphology changed from spinel crystals to needle like oxides when the Ni/NiO transition curve was approached. Oxide layers were present below the Ni/NiO transition curve i.e. when the Ni coupon was still free of oxides. In addition an evolved slip dissolution model was proposed that could explain the observed experimental results and the peak in SCC susceptibility for Ni-based alloys around the Ni/NiO transition. - Highlights: • Exposure tests with Ni-coupons showed that the Ni/NiO transition curve shifted to more oxidizing conditions. • The Ni specimens tested in PWR water were free of oxides at all temperatures. • The exposure tests with Alloy 182 showed that oxide layers were present at all temperatures. • The Alloy 182 surface morphology changed from spinel crystals to needle like oxides when the Ni/NiO curve was approached

  15. Effect of temperature and dissolved hydrogen on oxide films formed on Ni and Alloy 182 in simulated PWR water

    Energy Technology Data Exchange (ETDEWEB)

    Mendonça, R. [CAPES Foundation, Ministry of Education, Brasilia (Brazil); Bosch, R.-W., E-mail: rbosch@sckcen.be [SCK-CEN, Boeretang 200, 2400 Mol (Belgium); Van Renterghem, W.; Vankeerberghen, M. [SCK-CEN, Boeretang 200, 2400 Mol (Belgium); Araújo Figueiredo, C. de [CDTN/CNEN, Av. Antônio Carlos 6627, 31270-901 Belo Horizonte, MG (Brazil)

    2016-08-15

    Alloy 182 is a nickel-based weld metal, which is susceptible to stress corrosion cracking in PWR primary water. It shows a peak in SCC susceptibility at a certain temperature and hydrogen concentration. This peak is related to the electrochemical condition where the Ni to NiO transition takes place. One hypothesis is that the oxide layer at this condition is not properly developed and so the material is not optimally protected against SCC. Therefore the oxide layer formed on Alloy 182 is investigated as a function of the dissolved hydrogen concentration and temperature around this Ni/NiO transition. Exposure tests were performed with Alloy 182 and Ni coupons in a PWR environment at temperatures between 300 °C and 345 °C and dissolved hydrogen concentration between 5 and 35 cc (STP)H{sub 2}/kg. Post-test analysis of the formed oxide layers were carried out by SEM, EDS and XPS. The exposure tests with Ni coupons showed that the Ni/NiO transition curve is at a higher temperature than the curve based on thermodynamic calculations. The exposure tests with Alloy 182 showed that oxide layers were present at all temperatures, but that the morphology changed from spinel crystals to needle like oxides when the Ni/NiO transition curve was approached. Oxide layers were present below the Ni/NiO transition curve i.e. when the Ni coupon was still free of oxides. In addition an evolved slip dissolution model was proposed that could explain the observed experimental results and the peak in SCC susceptibility for Ni-based alloys around the Ni/NiO transition. - Highlights: • Exposure tests with Ni-coupons showed that the Ni/NiO transition curve shifted to more oxidizing conditions. • The Ni specimens tested in PWR water were free of oxides at all temperatures. • The exposure tests with Alloy 182 showed that oxide layers were present at all temperatures. • The Alloy 182 surface morphology changed from spinel crystals to needle like oxides when the Ni/NiO curve was

  16. Seed-mediated synthesis of cross-linked Pt-NiO nanochains for methanol oxidation

    Energy Technology Data Exchange (ETDEWEB)

    Gu, Zhulan; Bin, Duan; Feng, Yue; Zhang, Ke; Wang, Jin; Yan, Bo; Li, Shumin; Xiong, Zhiping; Wang, Caiqin; Shiraishi, Yukihide; Du, Yukou, E-mail: duyk@suda.edu.cn

    2017-07-31

    Highlights: • Cross-linked Pt-NiO nanochains using seed-mediated growth method are synthesized. • The as-prepared catalysts exhibit higher electrocatalytic activity than Pt/C for MOR. • The Pt-NiO(1:1 by molar) catalyst shows the best electrocatalytic property towards MOR. - Abstract: A simple method was reported for employing NiO nanoparticles act as seeds and then different amounts of Pt{sup 2+} were reduced on the NiO nanoparticles, forming a cross-linked Pt-NiO nanocatalysts. These as-prepared catalysts were characterized using different physical-chemical techniques, including X-ray diffraction (XRD), transmission electron microscopy (TEM) and X-ray photoelectron spectroscopy (XPS). The results indicate that the morphology of the cross-linked Pt-NiO nanochain was successfully produced regardless of the molar ratio of Pt{sup 2+} to NiO precursors. The electrochemical characteristics of Pt-NiO nanochain catalysts were evaluated for the oxidation of methanol as a model reaction, which verify that the Pt-NiO catalysts show enhanced activity and high stability in comparison with the commercial Pt/C catalyst. The optimized ratio of Pt to NiO is 1:1, then tuned by simple adjusting the feed ratio of the precursors as well. The synthesized nanocatalysts will be found the great potential applications as electrocatalysts for fuel cells owe to their enhanced catalytic performance and long-term stability.

  17. Strong influence of westerly wind bursts on El Niño diversity

    Science.gov (United States)

    Chen, Dake; Lian, Tao; Fu, Congbin; Cane, Mark A.; Tang, Youmin; Murtugudde, Raghu; Song, Xunshu; Wu, Qiaoyan; Zhou, Lei

    2015-05-01

    Despite the tremendous progress in the theory, observation and prediction of El Niño over the past three decades, the classification of El Niño diversity and the genesis of such diversity are still debated. This uncertainty renders El Niño prediction a continuously challenging task, as manifested by the absence of the large warm event in 2014 that was expected by many. We propose a unified perspective on El Niño diversity as well as its causes, and support our view with a fuzzy clustering analysis and model experiments. Specifically, the interannual variability of sea surface temperatures in the tropical Pacific Ocean can generally be classified into three warm patterns and one cold pattern, which together constitute a canonical cycle of El Niño/La Niña and its different flavours. Although the genesis of the canonical cycle can be readily explained by classic theories, we suggest that the asymmetry, irregularity and extremes of El Niño result from westerly wind bursts, a type of state-dependent atmospheric perturbation in the equatorial Pacific. Westerly wind bursts strongly affect El Niño but not La Niña because of their unidirectional nature. We conclude that properly accounting for the interplay between the canonical cycle and westerly wind bursts may improve El Niño prediction.

  18. Seed-mediated synthesis of cross-linked Pt-NiO nanochains for methanol oxidation

    International Nuclear Information System (INIS)

    Gu, Zhulan; Bin, Duan; Feng, Yue; Zhang, Ke; Wang, Jin; Yan, Bo; Li, Shumin; Xiong, Zhiping; Wang, Caiqin; Shiraishi, Yukihide; Du, Yukou

    2017-01-01

    Highlights: • Cross-linked Pt-NiO nanochains using seed-mediated growth method are synthesized. • The as-prepared catalysts exhibit higher electrocatalytic activity than Pt/C for MOR. • The Pt-NiO(1:1 by molar) catalyst shows the best electrocatalytic property towards MOR. - Abstract: A simple method was reported for employing NiO nanoparticles act as seeds and then different amounts of Pt 2+ were reduced on the NiO nanoparticles, forming a cross-linked Pt-NiO nanocatalysts. These as-prepared catalysts were characterized using different physical-chemical techniques, including X-ray diffraction (XRD), transmission electron microscopy (TEM) and X-ray photoelectron spectroscopy (XPS). The results indicate that the morphology of the cross-linked Pt-NiO nanochain was successfully produced regardless of the molar ratio of Pt 2+ to NiO precursors. The electrochemical characteristics of Pt-NiO nanochain catalysts were evaluated for the oxidation of methanol as a model reaction, which verify that the Pt-NiO catalysts show enhanced activity and high stability in comparison with the commercial Pt/C catalyst. The optimized ratio of Pt to NiO is 1:1, then tuned by simple adjusting the feed ratio of the precursors as well. The synthesized nanocatalysts will be found the great potential applications as electrocatalysts for fuel cells owe to their enhanced catalytic performance and long-term stability.

  19. The stability of precepitates and the role of lattice defects in Fe-1at%Cu-1at%Ni-1at%Mn alloy: A phase-field model study

    International Nuclear Information System (INIS)

    Biner, S.B.; Rao, Weifeng; Zhang, Yongfeng

    2016-01-01

    In the first part of this study, the stability of Cu precipitates, up to 2 nm in diameter, in Fe-1at%Cu-1at%Ni-1at%Mn system was evaluated within the framework of phase-field modeling by utilizing a thermodynamic database. The implanted precipitates either in isolated or in clustered arrangements, were unstable and dissolved into the matrix. The dissolution rate decreases with increasing precipitate size; however, it is strongly influenced by the spatial arrangements of the implants and the overall alloy content. In the second part, the precipitation/segregation behavior at a circular dislocation, and square prismatic loops was parametrically studied. While precipitates formed at the dislocation loop, a significant segregation of Cu was observed at prismatic loops with either vacancy or interstitial character. Although, the both types of prismatic loops provide the spatial evolution of the stress-fields with the same absolute magnitude, the vacancy loops appears to be stronger sinks and their sink strength increases with decreasing loop size. The results clearly show the necessity of inclusion of the underlying lattice defects in the microstructure modeling of materials under the irradiation environments.

  20. The stability of precepitates and the role of lattice defects in Fe-1at%Cu-1at%Ni-1at%Mn alloy: A phase-field model study

    Science.gov (United States)

    Biner, S. B.; Rao, Weifeng; Zhang, Yongfeng

    2016-01-01

    In the first part of this study, the stability of Cu precipitates, up to 2 nm in diameter, in Fe-1at%Cu-1at%Ni-1at%Mn system was evaluated within the framework of phase-field modeling by utilizing a thermodynamic database. The implanted precipitates either in isolated or in clustered arrangements, were unstable and dissolved into the matrix. The dissolution rate decreases with increasing precipitate size; however, it is strongly influenced by the spatial arrangements of the implants and the overall alloy content. In the second part, the precipitation/segregation behavior at a circular dislocation, and square prismatic loops was parametrically studied. While precipitates formed at the dislocation loop, a significant segregation of Cu was observed at prismatic loops with either vacancy or interstitial character. Although, the both types of prismatic loops provide the spatial evolution of the stress-fields with the same absolute magnitude, the vacancy loops appears to be stronger sinks and their sink strength increases with decreasing loop size. The results clearly show the necessity of inclusion of the underlying lattice defects in the microstructure modeling of materials under the irradiation environments.

  1. First principles, thermal stability and thermodynamic assessment of the binary Ni-W system

    Energy Technology Data Exchange (ETDEWEB)

    Isomaeki, Iikka; Haemaelaeinen, Marko; Gasik, Michael [Aalto Univ., Espoo (Finland). School of Chemical Engineering; Braga, Maria H. [Porto Univ. (Portugal). CEMUC, Physics Engineering Dept.

    2017-12-15

    The Ni-W binary system was assessed using critically evaluated experimental data with assistance from first principles analysis and the CALPHAD method. The solution phases (liquid, fcc-A1 and bcc-A2) were modeled using the substitutional regular solution model. The recently discovered Ni{sub 8}W metastable phase was evaluated as Fe{sub 16}C{sub 2}- like martensite with three sublattices, and shown to be possibly stable according to first principles calculations. Ni{sub 8}W was also modeled as an interstitial compound, but the model is not good because the solubility of tungsten in nickel is very low, especially at low temperatures. There is no experimental evidence for such low solubility. The other binary compounds Ni{sub 4}W and Ni{sub 3}W were assessed as stoichiometric ones. Compared independent experimental and first principles data agree well with the calculated phase diagram using updated thermodynamic parameters.

  2. A thermodynamic model for solid solutions and its application to the C-Fe-Co, C-Fe-Ni and Mn-Cr-Pt solid dilutions

    International Nuclear Information System (INIS)

    Tao, D.P.

    2004-01-01

    Based on the free volume theory and the lattice model, the partition functions of pure solids and their mixtures were expressed. This resulted in the establishment of a thermodynamic model for solid solutions. The model naturally combines the excess entropy and excess enthalpy of a solution by means of new expressions of the configurational partition functions of solids and their mixtures derived from statistical thermodynamics, which is approximate to real solid solutions, that is S E ≠0 (V E ≠0) and H E ≠0. It can describe the thermodynamic properties of partially miscible systems and predict the thermodynamic properties in a multicomponent solid solution system using only the related binary infinite dilute activity coefficients. The predicted activity coefficients from the model are in good agreement with the experimental data of the ternary solid dilutions. This shows that the prediction effect of the proposed model is of better stability and reliability because it has a good physical basis

  3. Electronic structure of Ni/sub 3/Al and Ni/sub 3/Ga alloys

    CERN Document Server

    Pong, W F; Chang, Y K; Tsai, M H; Hsieh, H H; Pieh, J Y; Tseng, P K; Lee, J F; Hsu, L S

    1999-01-01

    This work investigates the charge transfer and Al(Ga) p-Ni d hybridization effects in the intermetallic Ni/sub 3/Al(Ni/sub 3/Ga) alloy using the NiL/sub 3.2/- and K-edge and Al(Ga)K X-ray absorption near edge structure (XANES) measurements. We find that the intensity of white-line features at the NiL/sub 3.2/-edge in the Ni/sub 3/Al(Ni /sub 3/Ga) alloy decreased in comparison with that of pure Ni, which can be attributed to the enhancement of Ni3d states filling and the depletion of the density of Ni 3d unoccupied states in the Ni/sub 3 /Al(Ni/sub 3/Ga) alloy. Two clear features are also observed in the Ni/sub 3/Al(Ni/sub 3/Ga) XANES spectrum at the Al(Ga) K-edge, which can be assigned to the Al(Ga) unoccupied 3p (4p) states and their hybridized states with the Ni 3d/4sp states above the Fermi level in Ni/sub 3/Al(Ni/sub 3/Ga). The threshold at Al K-edge XANES for Ni/sub 3/Al clearly shifts towards higher photon energies relative to that of pure Al, indicating that Al loses charges upon forming Ni/sub 3 /Al. ...

  4. 111Cd PAC Study of Gd-Ni Intermetallic Compounds

    International Nuclear Information System (INIS)

    Presa, P. de la; Forker, M.

    2004-01-01

    This paper presents a perturbed angular correlation study of the magnetic and electric hyperfine interactions of 111 Cd on Gd sites of the Gd-Ni intermetallic compounds GdNi, GdNi 2 , GdNi 3 , Gd 2 Ni 7 , GdNi 5 and Gd 2 Ni 17 .

  5. Measurement of 59Ni and 63Ni by accelerator mass spectrometry at CIAE

    Science.gov (United States)

    Wang, Xiaoming; He, Ming; Ruan, Xiangdong; Xu, Yongning; Shen, Hongtao; Du, Liang; Xiao, Caijin; Dong, Kejun; Jiang, Shan; Yang, Xuran; Lan, Xiaoxi; Wu, Shaoyong; Zhao, Qingzhang; Cai, Li; Pang, Fangfang

    2015-10-01

    The long lived isotopes 59Ni and 63Ni can be used in many areas such as radioactive waste management, neutron dosimetry, cosmic radiation study, and so on. Based on the large accelerator and a big Q3D magnetic spectrometer, the measurement method for 59Ni and 63Ni is under development at the AMS facility at China Institute of Atomic Energy (CIAE). By using the ΔE-Q3D technique with the Q3D magnetic spectrometer, the isobaric interferences were greatly reduced in the measurements of 59Ni and 63Ni. A four anode gas ionization chamber was then used to further identify isobars. With these techniques, the abundance sensitivities of 59Ni and 63Ni measurements are determined as 59Ni/Ni = 1 × 10-13 and 63Ni/Ni = 2 × 10-12, respectively.

  6. Measurement of {sup 59}Ni and {sup 63}Ni by accelerator mass spectrometry at CIAE

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Xiaoming [China Institute of Atomic Energy, P.O. Box 275(50), Beijing 102413 (China); He, Ming, E-mail: minghe@ciae.ac.cn [China Institute of Atomic Energy, P.O. Box 275(50), Beijing 102413 (China); Ruan, Xiangdong [College of Physics and Technology, Guangxi University, Nanning 530004 (China); Xu, Yongning [China Institute of Atomic Energy, P.O. Box 275(50), Beijing 102413 (China); Shen, Hongtao [College of Physics and Technology, Guangxi Normal University, Guilin 541004 (China); Du, Liang; Xiao, Caijin; Dong, Kejun; Jiang, Shan; Yang, Xuran [China Institute of Atomic Energy, P.O. Box 275(50), Beijing 102413 (China); Lan, Xiaoxi [College of Physics and Technology, Guangxi University, Nanning 530004 (China); Wu, Shaoyong; Zhao, Qingzhang [China Institute of Atomic Energy, P.O. Box 275(50), Beijing 102413 (China); Cai, Li [College of Physics and Technology, Guangxi University, Nanning 530004 (China); Pang, Fangfang [College of Physics and Technology, Guangxi Normal University, Guilin 541004 (China)

    2015-10-15

    The long lived isotopes {sup 59}Ni and {sup 63}Ni can be used in many areas such as radioactive waste management, neutron dosimetry, cosmic radiation study, and so on. Based on the large accelerator and a big Q3D magnetic spectrometer, the measurement method for {sup 59}Ni and {sup 63}Ni is under development at the AMS facility at China Institute of Atomic Energy (CIAE). By using the ΔE-Q3D technique with the Q3D magnetic spectrometer, the isobaric interferences were greatly reduced in the measurements of {sup 59}Ni and {sup 63}Ni. A four anode gas ionization chamber was then used to further identify isobars. With these techniques, the abundance sensitivities of {sup 59}Ni and {sup 63}Ni measurements are determined as {sup 59}Ni/Ni = 1 × 10{sup −13} and {sup 63}Ni/Ni = 2 × 10{sup −12}, respectively.

  7. Experimental investigation and thermodynamic re-assessment of the Al–Mo–Ni system

    Energy Technology Data Exchange (ETDEWEB)

    Peng, Jian, E-mail: jian.peng@kit.edu [Institute for Applied Materials – Applied Materials Physics, Karlsruhe Institute of Technology, Hermann-von-Helmholtz Platz 1, 76344 Eggenstein-Leopoldshafen (Germany); Franke, Peter [Institute for Applied Materials – Applied Materials Physics, Karlsruhe Institute of Technology, Hermann-von-Helmholtz Platz 1, 76344 Eggenstein-Leopoldshafen (Germany); Manara, Dario; Watkins, Tyson; Konings, Rudy J.M. [European Commission, Joint Research Centre, Institute for Transuranium Elements, P.O. Box 2340, 76125 Karlsruhe (Germany); Seifert, Hans J. [Institute for Applied Materials – Applied Materials Physics, Karlsruhe Institute of Technology, Hermann-von-Helmholtz Platz 1, 76344 Eggenstein-Leopoldshafen (Germany)

    2016-07-25

    NiAl-based alloys have been investigated, because they are promising alternative materials for high temperature structural applications. Recent advancements in directional solidification offer the opportunity to manufacture metal-matrix composites of NiAl strengthened by embedded fibers of refractory metals such as Mo. The mechanical properties of these composites can be considerably improved, compared to NiAl, at least in fiber direction. The Al–Mo–Ni system has been thermodynamically assessed by several authors. However, none of them can reproduce a satisfactory description along the section NiAl–Mo. In the present work, liquidus and solidus temperatures of the NiAl–Mo system were measured by a laser heating-fast pyrometry apparatus. The results agree well with literature data. The thermodynamic descriptions of the Al–Ni and Al–Mo systems from the literature were refined and a new thermodynamic dataset of the Al–Mo–Ni system was established. The ordered B2 phase and its disordered A2 (bcc) parent phase were described by a single Gibbs energy function. Very good agreement between the calculated phase diagram and the experimental data is obtained. The description of the section NiAl–Mo is considerably improved and we conclude that this section does not represent a quasi-binary phase diagram. - Highlights: • The liquidus and solidus temperatures of the NiAl–Mo system were measured. • The Gibbs energy of vacancies in the bcc phase was considered in the modeling. • The thermodynamic descriptions of the Al–Ni and Al–Mo systems were refined. • A new thermodynamic database of the Al–Mo–Ni system was established. • The thermodynamic description of the NiAl–Mo system was considerably improved.

  8. g-factor of the 9/2+ isomeric state in 65Ni from transfer reaction

    International Nuclear Information System (INIS)

    Georgiev, G.; Matea, I.; Balabanski, D.L.; Daugas, J.M.; Meot, V.; Morel, P.; Oliveira Santos, F. de; Lewitowicz, M.; Franchoo, S.; Ibrahim, F.; Le Blanc, F.; Sorlin, O.; Stanoiu, M.; Verney, D.; Lo Bianco, G.; Saltarelli, A.; Lukyanov, S.; Penionzhkevich, Yu.E.; Neyens, G.; Vermeulen, N.; Yordanov, D.; Tarisien, M.

    2006-01-01

    We report a measurement of the g-factor of the I π =9/2 + , t 1/2 =22 ns isomer in 65 Ni. The state of interest was populated and spin-oriented using a single-neutron transfer on an enriched 64 Ni target. The value, which was obtained, g(9/2 + , 65m Ni)=-0.296(3) is well in agreement with the g-factors of the other 9/2 + states in the region and with large-basis shell model calculations. The known g-factor of the 9/2 + isomer in 63 Ni was used in order to verify the strength of the hyperfine field of Ni(Ni) at room temperature. (orig.)

  9. Ternary Bi-Cu-Ni alloys – thermodynamics, characterization, mechanical and electrical properties

    Directory of Open Access Journals (Sweden)

    Branislav Radomir Marković

    2017-09-01

    Full Text Available The Bi–Cu–Ni ternary system belongs to the group of potential Cu-Ni-based advanced lead-free solder materials for high temperature application. The paper shows results of the thermodynamic calculations using general solution model along the line with the molar ratio of Cu: Ni = 1:1. The experimental part shows thermal, structural, electrical and mechanical properties based on differential scanning calorimetry (DSC, scanning electron microscopy with energy dispersive spectrometry (SEM-EDS, electroconductivity and hardness measurements of the alloys selected in the section from bismuth corner with molar ratio Cu: Ni = 1:1, Cu: Ni = 3:1, and Cu: Ni = 1:3.

  10. Ni4Ti3 precipitate structures in Ni-rich NiTi shape memory alloys

    Czech Academy of Sciences Publication Activity Database

    Holec, David; Bojda, Ondřej; Dlouhý, Antonín

    2008-01-01

    Roč. 481, Sp. Iss. (2008), s. 462-465 ISSN 0921-5093. [ESOMAT 2006. Bochum, 10.09.2006-15.09.2006] R&D Projects: GA ČR(CZ) GA106/05/0918 Institutional research plan: CEZ:AV0Z20410507 Keywords : NiTi shape memory alloys * Ni4Ti3 precipitates * Multi-step martensitic transformations Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.806, year: 2008

  11. On the atomic structure of liquid Ni-Si alloys: a neutron diffraction study

    Science.gov (United States)

    Gruner, S.; Marczinke, J.; Hennet, L.; Hoyer, W.; Cuello, G. J.

    2009-09-01

    The atomic structure of the liquid NiSi and NiSi2 alloys is investigated by means of neutron diffraction experiments with isotopic substitution. From experimental data-sets obtained using four Ni isotopes, partial structure factors and pair correlation functions are obtained by applying a reverse Monte Carlo modelling approach. Both alloys were found to exhibit a strong tendency to hetero-coordination within the first coordination shell. In particular, covalent Si-Si bonds with somewhat greater distances seem to influence the structure of the liquid NiSi alloy.

  12. Alpha-particle scattering from Ni isotopes at 25 MeV

    International Nuclear Information System (INIS)

    Ballester, F.; Casal, E.; Diaz, J.; Moriano, F.; England, J.B.A.

    1987-01-01

    Differential cross sections have been measured for both elastic and inelastic scattering of 25 MeV α particles from sup(58,60,62,64)Ni nuclei. An increasing neutron skin thickness in the isotopic sequence from 58 Ni to 64 Ni has been found. The angular distributions of excited states have been analysed by the coupled-channel (CC) approximation, in the context of the vibrational model. The analysis reveals enhanced hexadecapole (0 + → 4 + ) transitions in sup(58,60,64)Ni. Deformation parameters for the excited states have been deduced. Isoscalar transition rates have been extracted and compared with electromagnetic transition rates. (author)

  13. Modeling Plasticity of Ni3Al-Based L12 Intermetallic Single Crystals-I. Anomalous Temperature Dependence of the Flow Behavior (Preprint)

    National Research Council Canada - National Science Library

    Choi, Yoon-Suk; Dimiduk, Dennis M; Uchic, Michael D; Parthasarathy, Triplicane A

    2006-01-01

    .... The model framework was based on two major contributions to plastic flow, namely the repeated cross-slip exhaustion and athermal defeat of screw-character dislocations, and the motion of the macro-kinks (MKs...

  14. A comparison of different strategies in multivariate regression models for the direct determination of Mn, Cr, and Ni in steel samples using laser-induced breakdown spectroscopy

    Science.gov (United States)

    Luna, Aderval S.; Gonzaga, Fabiano B.; da Rocha, Werickson F. C.; Lima, Igor C. A.

    2018-01-01

    Laser-induced breakdown spectroscopy (LIBS) analysis was carried out on eleven steel samples to quantify the concentrations of chromium, nickel, and manganese. LIBS spectral data were correlated to known concentrations of the samples using different strategies in partial least squares (PLS) regression models. For the PLS analysis, one predictive model was separately generated for each element, while different approaches were used for the selection of variables (VIP: variable importance in projection and iPLS: interval partial least squares) in the PLS model to quantify the contents of the elements. The comparison of the performance of the models showed that there was no significant statistical difference using the Wilcoxon signed rank test. The elliptical joint confidence region (EJCR) did not detect systematic errors in these proposed methodologies for each metal.

  15. Computational study on full-wave inversion based on the acoustic wave-equation; Onkyoha hado hoteishiki full wave inversion no model keisan ni yoru kento

    Energy Technology Data Exchange (ETDEWEB)

    Watanabe, T.; Sassa, K. [Kyoto University, Kyoto (Japan); Uesaka, S. [Kyoto University, Kyoto (Japan). Faculty of Engineering

    1996-10-01

    The effect of initial models on full-wave inversion (FWI) analysis based on acoustic wave-equation was studied for elastic wave tomography of underground structures. At present, travel time inversion using initial motion travel time is generally used, and inverse analysis is conducted using the concept `ray,` assuming very high wave frequency. Although this method can derive stable solutions relatively unaffected by initial model, it uses only the data of initial motion travel time. FWI calculates theoretical waveform at each receiver using all of observed waveforms as data by wave equation modeling where 2-D underground structure is calculated by difference calculus under the assumption that wave propagation is described by wave equation of P wave. Although it is a weak point that FWI is easily affected by noises in an initial model and data, it is featured by high resolution of solutions. This method offers very excellent convergence as a proper initial model is used, resulting in sufficient performance, however, it is strongly affected by initial model. 2 refs., 7 figs., 1 tab.

  16. Relation between shape of Ni-particles and Ni migration in Ni-YSZ electrodes – a hypothesis

    DEFF Research Database (Denmark)

    Mogensen, Mogens Bjerg; Hauch, Anne; Sun, Xiufu

    2016-01-01

    pressure (pH2O) gradient as previously observed [1], but in the present cases Ni seems to migrate up the pH2O gradient. However, it is also observed that there is a preceding phase in this Ni-YSZ electrode degradation, namely that the Ni-particles closest to the YSZ electrolyte loose contact to each other......This is an attempt to explain a phenomenon of total depletion of Ni next to the electrolyte in Ni-YSZ cermet electrodes in solid oxide electrolysis cells during electrolysis at high current density/overpotential. Intuitively, we would think that Ni would always migrate down the steam partial...

  17. Hexanuclear [Ni6L12] metallacrown framework consisting of NiS4 square-planar and NiS5 square-pyramidal building blocks

    NARCIS (Netherlands)

    Angamuthu, R.; Kooijman, H.; Lutz, M.; Spek, A.L.; Bouwman, E.

    2007-01-01

    The hexanuclear [Ni6L12] (2) wheel-type cluster adopts an unusual structural motif whereby four NiS4 square-planar and two NiS5 square-pyramidal units are conjoined by edge sharing; the NiS5 units resemble the Ni centre of the inactive state in the [NiFe] hydrogenase.

  18. Hydrothermal Ni Prospectivity Analysis of Tasmania, Australia

    Science.gov (United States)

    Gonzalez-Alvarez, I.; Porwal, A.; McCuaig, T. C.; Maier, W.

    2009-04-01

    deposits was carried out on a regional scale for the entire state of Tasmania to explore the prospectivity of for hydrothermal Ni deposits of this part of the Ferrar LIP for. A conceptual model of hydrothermal nickel mineral systems was used to identify the following as the most important exploration criteria for hydrothermal nickel deposits: (i) presence of potential nickel sources, (ii) heat and fluid sources, (iii) permeable transportation channels for circulating hydrothermal fluids, and (iv) prospective lithological and structural traps conducive for sulphur saturation and deposition of nickel sulphides. Available public domain exploration datasets were processed using GIS functionalities to derive a series of derivative GIS layers that could be used as proxies for each of the above exploration criteria. These included mafic-ultramafic rocks formed from magma with >7% MgO, large igneous province; major faults, and mineral alteration assemblages that could indicate redox gradients and/or reduced fluids highly concentrated in chloride etc. A two-pronged approach involving GIS-assisted manual prospectivity analysis and GIS-based (automated) prospectivity analysis was used for identifying the most prospective ground for hydrothermal nickel deposits in Tasmania. The manual analysis involved a conceptual review of all geological regions of the state, while the GIS-based automated approach used a spatial fuzzy model. The results of the two analyses were subsequently integrated and, after a detailed geological follow-up study, were used to generate a hydrothermal nickel prospectivity map of the state. The methodology developed in this study could be potentially applied to frontier exploration grounds with similar geological setting, such as Papua New Guinea.

  19. Magnetic phase diagram of the Fe-Ni system

    Energy Technology Data Exchange (ETDEWEB)

    Xiong, W., E-mail: wxiong@yahoo.com [Division of Computational Thermodynamics, Department of Materials Science and Engineering, KTH (Royal Institute of Technology), Brinellvaegen 23, SE-100 44 Stockholm (Sweden); State Key Lab of Powder Metallurgy, Central South University, Changsha 410083 (China); Zhang, H.; Vitos, L. [Division of Applied Physics, Department of Materials Science and Engineering, KTH (Royal Institute of Technology), Brinellvaegen 23, SE-100 44 Stockholm (Sweden); Selleby, M. [Division of Computational Thermodynamics, Department of Materials Science and Engineering, KTH (Royal Institute of Technology), Brinellvaegen 23, SE-100 44 Stockholm (Sweden)

    2011-01-15

    Magnetic phase diagrams of body-centered cubic and face-centered cubic Fe-Ni alloys were constructed using available experimental data and ab initio calculations. The results show that significant improvements in the 'standard' diagrams (handbooks and CALPHAD databases) are required. The present work demonstrates that the CALPHAD magnetic model is not sophisticated enough to describe the Fe-Ni system. In addition, a new thermodynamic description of the lattice stability for pure Ni is urgently needed, since the recommended magnetic properties for CALPHAD modeling are distinct from the experimental and ab initio results. This work indicates that the construction of magnetic phase diagrams is indispensable during the phase transformation study of magnetic systems.

  20. Anomalous Hall effect in polycrystalline Ni films

    KAUST Repository

    Guo, Zaibing

    2012-02-01

    We systematically studied the anomalous Hall effect in a series of polycrystalline Ni films with thickness ranging from 4 to 200 nm. It is found that both the longitudinal and anomalous Hall resistivity increased greatly as film thickness decreased. This enhancement should be related to the surface scattering. In the ultrathin films (46 nm thick), weak localization corrections to anomalous Hall conductivity were studied. The granular model, taking into account the dominated intergranular tunneling, has been employed to explain this phenomenon, which can explain the weak dependence of anomalous Hall resistivity on longitudinal resistivity as well. © 2011 Elsevier Ltd. All rights reserved.

  1. Stochastic reservoir optimization using El Niño information: case study of Daule Peripa, Ecuador

    DEFF Research Database (Denmark)

    Gelati, Emiliano; Madsen, Henrik; Rosbjerg, Dan

    2011-01-01

    , each corresponding to a hidden climate state. Climatic information is used as exogenous input and to condition state transitions. We apply the model to the inflow of the Daule Peripa reservoir in western Ecuador, where El Niño events cause anomalously heavy rainfall. El Niño–Southern Oscillation (ENSO...

  2. Pine bark as bio-adsorbent for Cd, Cu, Ni, Pb and Zn

    DEFF Research Database (Denmark)

    Cutillas-Barreiro, L.; Ansias-Manso, L.; Fernandez Calviño, David

    2014-01-01

    % for Pb2+, 83-84% for Cu2+, 78-84% for Cd2+, 77-83% for Zn2+, and 70-75% for Ni2+, and it was faster for low concentrations, with Pb suffering the highest retention, followed by Cu, Cd, Ni and Zn. The fitting to the Freundlich and Langmuir models was satisfactory. Desorption increased in parallel...

  3. Tropical explosive volcanic eruptions can trigger El Niño by cooling tropical Africa.

    Science.gov (United States)

    Khodri, Myriam; Izumo, Takeshi; Vialard, Jérôme; Janicot, Serge; Cassou, Christophe; Lengaigne, Matthieu; Mignot, Juliette; Gastineau, Guillaume; Guilyardi, Eric; Lebas, Nicolas; Robock, Alan; McPhaden, Michael J

    2017-10-03

    Stratospheric aerosols from large tropical explosive volcanic eruptions backscatter shortwave radiation and reduce the global mean surface temperature. Observations suggest that they also favour an El Niño within 2 years following the eruption. Modelling studies have, however, so far reached no consensus on either the sign or physical mechanism of El Niño response to volcanism. Here we show that an El Niño tends to peak during the year following large eruptions in simulations of the Fifth Coupled Model Intercomparison Project (CMIP5). Targeted climate model simulations further emphasize that Pinatubo-like eruptions tend to shorten La Niñas, lengthen El Niños and induce anomalous warming when occurring during neutral states. Volcanically induced cooling in tropical Africa weakens the West African monsoon, and the resulting atmospheric Kelvin wave drives equatorial westerly wind anomalies over the western Pacific. This wind anomaly is further amplified by air-sea interactions in the Pacific, favouring an El Niño-like response.El Niño tends to follow 2 years after volcanic eruptions, but the physical mechanism behind this phenomenon is unclear. Here the authors use model simulations to show that a Pinatubo-like eruption cools tropical Africa and drives westerly wind anomalies in the Pacific favouring an El Niño response.

  4. Experimental investigation and thermodynamic analysis of the Sc–Ni system supplemented with first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Cao, Zhaoping [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China); Liu, Shuhong, E-mail: shhliu@csu.edu.cn [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China); Sino-German cooperation group “Microstructure in Al alloys”, Central South University, Changsha, Hunan 410083 (China); Fang, Xu; Cheng, Kaiming; Gao, Qiannan [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China); Du, Yong; Wang, Jiong [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China); Sino-German cooperation group “Microstructure in Al alloys”, Central South University, Changsha, Hunan 410083 (China); Zhang, Jun; Huang, Weidong [State Key Laboratory of Solidification Processing, Northwestern Polytechnical University, Xi’an 710072 (China); Tang, Chengying [Guangxi Key Laboratory of Informational Materials, Guilin University of Electronic Technology, Guilin, Guangxi 541004 (China)

    2014-06-01

    Highlights: • The Sc–Ni system is reinvestigated via experiments and thermodynamics. • The homogeneity range and the congruent melting point of Sc{sub 2}Ni are clarified. • First-principles calculations are performed for the enthalpies of formation. • Order-disorder model is used to describe Bcc{sub A}2 and Bcc{sub B}2 (ScNi). • The present thermodynamic parameters can fit the experimental data better. - Abstract: The Sc–Ni binary system was investigated via a hybrid of experiment and thermodynamic calculation. Eleven alloys were prepared by arc melting. The as-cast and annealed samples were analyzed by means of X–ray diffraction, scanning electron microscopy with energy-dispersive X–ray spectrometer, electron probe microanalysis and differential thermal analysis/differential scanning calorimetry. The invariant reactions on Sc-rich side were reinvestigated. Five compounds (ScNi{sub 5}, Sc{sub 2}Ni{sub 7}, ScNi{sub 2}, ScNi and Sc{sub 2}Ni) were observed in the present experiment. Their enthalpies of formation at 0 K were computed via first-principles calculations to supply referable thermodynamic data for the modeling. One single function was used to describe the Gibbs energies of both the ordered Bcc{sub B}2 (ScNi) and disordered Bcc{sub A}2 phases. The presently obtained thermodynamic parameters for the Sc–Ni system can reproduce the experimental data reasonably.

  5. Superstructure of NiAs

    International Nuclear Information System (INIS)

    Nozue, Tatsuhiro; Kobayashi, Hisao; Kamimura, Takashi; Yamaguchi, Yasuo

    2001-01-01

    The structural transition in NiAs was studied by neutron diffraction on the single crystalline sample. The crystal structure of NiAs has been reported to be bottom-centered orthorhombic with Cmc2 1 symmetry (niccolite-type). The measurement of temperature dependence of the powder X-ray diffraction revealed that NiAs undergoes a structural transition to the NiAs-type at T t =335 K. In present neutron diffraction experiment at room temperature, we observed the reflections indexed on the basis of the orthorhombic unit cell. The intensities of these reflections are qualitatively explained in terms of the niccolite-type structure with taking account of three domain structures, except for the weak reflections indexed as (001), (003) and (012). Then, the intensities of (001), (002) and (004) reflections were measured in temperature range of 20 to 420 K. The temperature dependences of (002) and (004) reflections qualitatively agree with those of the calculated intensities using the atomic positions of niccolite-type structure. However, the temperature dependence of (001) reflection shows the anomaly around T t , which suggests the symmetry of crystal structure of NiAs is not the Cmc2 1 symmetry. (author)

  6. Mechanical properties of NiTi and CuNiTi wires used in orthodontic treatment. Part 2: Microscopic surface appraisal and metallurgical characteristics

    Directory of Open Access Journals (Sweden)

    Marco Abdo Gravina

    2014-01-01

    Full Text Available 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.

  7. Mechanical properties of NiTi and CuNiTi wires used in orthodontic treatment. Part 2: Microscopic surface appraisal and metallurgical characteristics.

    Science.gov (United States)

    Gravina, Marco Abdo; Canavarro, Cristiane; Elias, Carlos Nelson; das Graças Afonso Miranda Chaves, Maria; Brunharo, Ione Helena Vieira Portella; Quintão, Cátia Cardoso Abdo

    2014-01-01

    This research aimed at comparing the qualitative chemical compositions and the surface morphology of fracture regions of eight types of Nickel/Titanium (NiTi) 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. The analyses were performed in a scanning electronic microscope (JEOL, model JSM-5800 LV) with EDS system of microanalysis (energy dispersive spectroscopy). 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 by Ormco, due to the presence of microcavity formed as a result of pulling out some particles, possibly of NiTi4. 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. CuNiTi 35ºC wires did not present better morphologic characteristics in comparison to the other wires with regard to surfaces and fracture region.

  8. Mechanical properties of NiTi and CuNiTi wires used in orthodontic treatment. Part 2: Microscopic surface appraisal and metallurgical characteristics

    Science.gov (United States)

    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

  9. Giant magnetoimpedance effect in sputtered single layered NiFe film and meander NiFe/Cu/NiFe film

    International Nuclear Information System (INIS)

    Chen, L.; Zhou, Y.; Lei, C.; Zhou, Z.M.; Ding, W.

    2010-01-01

    Giant magnetoimpedance (GMI) effect on NiFe thin film is very promising due to its application in developing the magnetic field sensors with highly sensitivity and low cost. In this paper, the single layered NiFe thin film and NiFe/Cu/NiFe thin film with a meander structure are prepared by the MEMS technology. The influences of sputtering parameters, film structure and conductor layer width on GMI effect in NiFe single layer and meander NiFe/Cu/NiFe film are investigated. Maximum of the GMI ratio in single layer and sandwich film is 5% and 64%, respectively. The results obtained are useful for developing the high-performance magnetic sensors based on NiFe thin film.

  10. The Ni-YSZ interface

    DEFF Research Database (Denmark)

    Jensen, Karin Vels

    content (99.8% Ni and 99.995% Ni) were used to examine the impact of impurities on the polarisation resistance and contact area morphology. The electropolished nickel wires were pressed against a polished 8 mol% YSZ surface. Extensive structural changes from a flat interface to a hill and valley structure...... between polarised and non-polarised samples. With pure nickel wires, however, the microstructures depended on the polarisation/non-polarisation conditions. At non-polarised conditions a hill and valley type structure was found. Anodic polarisation produced an up to 1 μm thick interface layer consisting...... of nano-sized YSZ particles with some Ni present. At cathodic polarisation both a granulated structure and a hill and valley structure resembling the structure of non-polarised samples were found. Small impurity ridges were surrounding the contact areas on non-polarised and cathodically polarised samples...

  11. Umreti ni mogla stara Sibila

    Directory of Open Access Journals (Sweden)

    Matej Hriberšek

    2001-07-01

    Full Text Available Izid omenjene knjige prof. Jožeta Kastelica predstavlja še enega od dogodkov v sklopu proslave 200-letnice Prešernovega rojstva. Delo je nastalo na osnovi njegove (kot sam pravi »Že davno napisane in neobjavljene« doktorske disertacije, ki jo je za izdajo v knjižni obliki dopolnil in obogatil ne le vsebinsko, ampak tudi oblikovno. Naslov sam skriva v sebi globoko simboliko; na eni strani kaže na simbolično povezavo med Sibilo, ki ni mogla umreti prej, dokler se ni dotaknila prsti iz svoje domovine (zgodba je povzeta po Serviju in Prešernom kot prvim imenom slovenskega parnasa ter aludira na njuno nesmrtnost, po drugi pa že sam po sebi kaže na Prešernovo izjemno poznavanje antike.

  12. ni potni list

    Directory of Open Access Journals (Sweden)

    Ana Krajnc

    1996-12-01

    Full Text Available Decembra 1994 je bila v Rimu velika mednarodna konferenca o permanentnem ali vse življenje trajajočem izobraževanju. Široki strokovni javnosti sta bila takrat prvič predstavljena tudi dva nova pojma: osebni učni načrt in učni potni list. Pri priči sta se prijela v teoriji in praksi - očitno sta bila oba predloga odsev potreb.

  13. Thermomechanical model for NiTi-based shape memory alloys including R-phase and material anisotropy under multi-axial loadings

    Czech Academy of Sciences Publication Activity Database

    Sedlák, Petr; Frost, Miroslav; Benešová, Barbora; Zineb, T.B.; Šittner, Petr

    2012-01-01

    Roč. 39, DEC 2012 (2012), s. 132-151 ISSN 0749-6419 R&D Projects: GA ČR GAP108/10/1296; GA ČR GA106/09/1573; GA ČR(CZ) GA101/09/0702; GA ČR GAP107/12/0800 Institutional research plan: CEZ:AV0Z20760514; CEZ:AV0Z10100521 Keywords : shape memory alloys * constitutive modeling * R-phase * non-proportional loading * dissipation function Subject RIV: BJ - Thermodynamics; JJ - Other Materials (FZU-D) Impact factor: 4.356, year: 2012 http://www.sciencedirect.com/science/article/pii/S0749641912001027

  14. Modeling of mechanical response of NiTi shape memory alloy subjected to combined thermal and non-proportional mechanical loading: A case study on helical spring actuator

    Czech Academy of Sciences Publication Activity Database

    Frost, Miroslav; Sedlák, Petr; Kadeřávek, Lukáš; Heller, Luděk; Šittner, Petr

    2016-01-01

    Roč. 27, č. 14 (2016), s. 1927-1938 ISSN 1045-389X R&D Projects: GA ČR(CZ) GP14-28306P; GA ČR GA14-15264S; GA ČR GAP107/12/0800 Institutional support: RVO:61388998 ; RVO:68378271 Keywords : shape memory alloys * R-phase * modeling * elastic anisotropy * helical spring Subject RIV: BM - Solid Matter Physics ; Magnetism; BM - Solid Matter Physics ; Magnetism (FZU-D) Impact factor: 2.255, year: 2016 http://jim.sagepub.com/content/27/14/1927.full.pdf

  15. Australasian microtektites: Impactor identification using Cr, Co and Ni ratios

    Science.gov (United States)

    Folco, L.; Glass, B. P.; D'Orazio, M.; Rochette, P.

    2018-02-01

    Impactor identification is one of the challenges of large-scale impact cratering studies due to the dilution of meteoritic material in impactites (typically Australasian tektite/microtektite strewn field, i.e., the largest Cenozoic strewn field (∼15% of the Earth's surface), the youngest (∼0.78 Myr old) on Earth, and the only one without an associated impact crater so far, is an outstanding issue. We identify a chondritic impactor signature in 77 Australasian microtektites (size range: ∼200-700 μm) from within 3000 km from the hypothetical impact location in Indochina (∼17°N, 107°E) based on variations of Cr, Co and Ni interelement ratios in a Co/Ni vs Cr/Ni space (46 microtektites analyzed in this work by Laser Ablation-Inductively Coupled Plasma -Mass Spectrometry and 31 from literature by means of Neutron Activation Analyses with Cr, Co and Ni concentrations up to ∼370, 50 and 680 μg/g, respectively). Despite substantial overlap in Cr/Ni versus Co/Ni composition for several meteorite types with chondritic composition (chondrites and primitive achondrites), regression calculation based on ∼85% of the studied microtektites best fit a mixing line between crustal compositions and an LL chondrite. However, due to some scatter mainly in the Cr versus Ni ratios in the considered dataset, an LL chondrite may not be the best fit to the data amongst impactors of primitive compositions. Eight high Ni/Cr and five low Ni/Cr outlier microtektites (∼15% in total) deviate from the above mixing trend, perhaps resulting from incomplete homogenization of heterogeneous impactor and target precursor materials at the microtektite scale, respectively. Together with previous evidence from the ∼35 Myr old Popigai impact spherules and the ∼1 Myr old Ivory Coast microtektites, our finding suggests that at least three of the five known Cenozoic distal impact ejecta were generated by the impacts of large stony asteroids of chondritic composition, and possibly of

  16. Submicron particles of Co, Ni and Co–Ni alloys

    Indian Academy of Sciences (India)

    Home; Journals; Bulletin of Materials Science; Volume 24; Issue 5. Submicron particles of Co, Ni and ... bulk values. The alloy particles follow a trend similar to the bulk alloys. ... G U Kulkarni1. Chemistry and Physics of Materials Unit, Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore 560 064, India ...

  17. Adjustable Model of Renewable Energy Projects for Sustainable Development: A Case Study of the Nišava District in Serbia

    Directory of Open Access Journals (Sweden)

    Violeta Dimić

    2018-03-01

    Full Text Available This paper explores and ranks the key performance indicators of multi-criteria decision-making in the process of selecting renewable energy sources (RES. Different categories of factors (e.g., political, legal, technological, economic and financial, sociocultural, and physical are crucial for the analysis of such projects. In this paper, we apply the fuzzy analytic hierarchy process (fuzzy AHP method—a mathematical method—in order to analyze the main criteria for such projects, which include the environment, the organizational management structure, project participants, and participants’ relationship with the performance indicators. In order of ranking, the indicators are the following: time, costs, quality, monitoring the project’s sustainability, user feedback, and users’ health and safety. The aim of this paper is to point out the necessity of creating an adjustable model for renewable energy projects in order to proceed with the sustainable development of the southeast part of Serbia. This model should lead the creation process for such a project, with the aim of increasing its energy efficiency.

  18. Synthesis of hierarchical Ni(OH)2 and NiO nanosheets and their adsorption kinetics and isotherms to Congo red in water

    International Nuclear Information System (INIS)

    Cheng Bei; Le Yao; Cai Weiquan; Yu Jiaguo

    2011-01-01

    Ni(OH) 2 and NiO nanosheets with hierarchical porous structures were synthesized by a simple chemical precipitation method using nickel chloride as precursors and urea as precipitating agent. The as-prepared samples were characterized by X-ray diffraction, scanning electron microscopy and nitrogen adsorption-desorption isotherms. Adsorption of Congo red (CR) onto the as-prepared samples from aqueous solutions was investigated and discussed. The pore structure analyses indicate that Ni(OH) 2 and NiO nanosheets are composed of at least three levels of hierarchical porous organization: small mesopores (ca. 3-5 nm), large mesopores (ca. 10-50 nm) and macropores (100-500 nm). The equilibrium adsorption data of CR on the as-prepared samples were analyzed by Langmuir and Freundlich models, suggesting that the Langmuir model provides the better correlation of the experimental data. The adsorption capacities for removal of CR was determined using the Langmuir equation and found to be 82.9, 151.7 and 39.7 mg/g for Ni(OH) 2 nanosheets, NiO nanosheets and NiO nanoparticles, respectively. Adsorption data were modeled using the pseudo-first-order, pseudo-second-order and intra-particle diffusion kinetics equations. The results indicate that pseudo-second-order kinetic equation and intra-particle diffusion model can better describe the adsorption kinetics. The as-prepared Ni(OH) 2 and NiO nanosheets are found to be effective adsorbents for the removal of Congo red pollutant from wastewater as a result of their unique hierarchical porous structures and high specific surface areas.

  19. Supergene neoformation of Pt-Ir-Fe-Ni alloys: multistage grains explain nugget formation in Ni-laterites

    Science.gov (United States)

    Aiglsperger, Thomas; Proenza, Joaquín A.; Font-Bardia, Mercè; Baurier-Aymat, Sandra; Galí, Salvador; Lewis, John F.; Longo, Francisco

    2017-10-01

    Ni-laterites from the Dominican Republic host rare but extremely platinum-group element (PGE)-rich chromitites (up to 17.5 ppm) without economic significance. These chromitites occur either included in saprolite (beneath the Mg discontinuity) or as `floating chromitites' within limonite (above the Mg discontinuity). Both chromitite types have similar iridium-group PGE (IPGE)-enriched chondrite normalized patterns; however, chromitites included in limonite show a pronounced positive Pt anomaly. Investigation of heavy mineral concentrates, obtained via hydroseparation techniques, led to the discovery of multistage PGE grains: (i) Os-Ru-Fe-(Ir) grains of porous appearance are overgrown by (ii) Ni-Fe-Ir and Ir-Fe-Ni-(Pt) phases which are overgrown by (iii) Pt-Ir-Fe-Ni mineral phases. Whereas Ir-dominated overgrowths prevail in chromitites from the saprolite, Pt-dominated overgrowths are observed within floating chromitites. The following formation model for multistage PGE grains is discussed: (i) hypogene platinum-group minerals (PGM) (e.g. laurite) are transformed to secondary PGM by desulphurization during serpentinization; (ii) at the stages of serpentinization and/or at the early stages of lateritization, Ir is mobilized and recrystallizes on porous surfaces of secondary PGM (serving as a natural catalyst) and (iii) at the late stages of lateritization, biogenic mediated neoformation (and accumulation) of Pt-Ir-Fe-Ni nanoparticles occurs. The evidence presented in this work demonstrates that in situ growth of Pt-Ir-Fe-Ni alloy nuggets of isometric symmetry is possible within Ni-laterites from the Dominican Republic.

  20. Different influences of two types of El Niños on the Indian Ocean SST variations

    Science.gov (United States)

    Tao, Weichen; Huang, Gang; Hu, Kaiming; Qu, Xia; Wen, Guanhuan; Gong, Yuanfa

    2014-08-01

    By comparing correlation of sea surface temperature (SST) and vertical circulation with canonical El Niño and El Niño Modoki, we find that El Niño Modoki has an effect on the Indian Ocean different from traditional El Niño. There exists obvious Indian Ocean basin mode (IOBM) after canonical El Niño, while insignificant SST anomalies exist in the Indian Ocean after El Niño Modoki. Anomalous downdraft and updraft appear over the eastern and western Indian Ocean, respectively, during canonical El Niño, while anomalous updraft is weak over the Indian Ocean during El Niño Modoki. Besides, the strength of El Niño Modoki is slightly weaker than that of canonical El Niño. According to previous studies, two mechanisms can explain IOBM after canonical El Niño: tropospheric temperature (TT) mechanism and ocean dynamics. However, both of them do not exist during El Niño Modoki. Comparing with the complicated oceanic processes, it is convenient to verify the observed TT anomalies and test the possible mechanism using the simple model. Therefore, we pay more attention on the question why TT mechanism does not work during El Niño Modoki. Using a linear barocinic model (LBM), we demonstrate that the strength of SST anomalies and cold SST anomalies in the eastern Pacific have an influence on TT anomalies. Especially, cold SST anomalies in the eastern Pacific cancel the effects of warm SST anomalies in the central Pacific on TT anomalies. It suggests that the SST anomalies in the eastern Pacific are important for the TT mechanism in two types of El Niño.

  1. Komunitaristični pristopi k novinarstvu: naslovnik kot subjekt

    OpenAIRE

    Poler Kovačič, Melita

    2014-01-01

    Kriza sodobnega novinarstva je tudi kriza naslovnika. Model klasičnega novinarstva predpostavlja skupnost naslovnikov, ki jih opredeljuje status državljanov kot nosilcev sporočanjskih pravic. Novinar ima do njih primarno odgovornost. Toda naslovnik tržnega novinarstva ni državljan

  2. Origin of perpendicular magnetic anisotropy in Co/Ni multilayers

    Science.gov (United States)

    Arora, M.; Hübner, R.; Suess, D.; Heinrich, B.; Girt, E.

    2017-07-01

    We studied the variation in perpendicular magnetic anisotropy of (111) textured Au /N ×[Co /Ni ]/Au films as a function of the number of bilayer repeats N . The ferromagnetic resonance and superconducting quantum interference device magnetometer measurements show that the perpendicular magnetic anisotropy of Co/Ni multilayers first increases with N for N ≤10 and then moderately decreases for N >10 . The model we propose reveals that the decrease of the anisotropy for N reduction in the magnetoelastic and magnetocrystalline anisotropies. A moderate decrease in the perpendicular magnetic anisotropy for N >10 is due to the reduction in the magnetocrystalline and the surface anisotropies. To calculate the contribution of magnetoelastic anisotropy in the Co/Ni multilayers, in-plane and out-of-plane x-ray diffraction measurements are performed to determine the spacing between Co/Ni (111) and (220) planes. The magnetocrystalline bulk anisotropy is estimated from the difference in the perpendicular and parallel g factors of Co/Ni multilayers that are measured using the in-plane and out-of-plane ferromagnetic resonance measurements. Transmission electron microscopy has been used to estimate the multilayer film roughness. These values are used to calculate the roughness-induced surface and magnetocrystalline anisotropy coefficients as a function of N .

  3. Theory of Valence Transition in BiNiO_{3}.

    Science.gov (United States)

    Naka, Makoto; Seo, Hitoshi; Motome, Yukitoshi

    2016-02-05

    Motivated by the colossal negative thermal expansion recently found in BiNiO_{3}, the valence transition accompanied by the charge transfer between the Bi and Ni sites is theoretically studied. We introduce an effective model for Bi-6s and Ni-3d orbitals taking into account the valence skipping of Bi cations, and investigate the ground-state and finite-temperature phase diagrams within the mean-field approximation. We find that the valence transition is caused by commensurate locking of the electron filling in each orbital associated with charge and magnetic orderings, and the critical temperature and the nature of the transitions are strongly affected by the relative energy between the Bi and Ni levels and the effective electron-electron interaction in the Bi sites. The obtained phase diagram well explains the temperature- and pressure-driven valence transitions in BiNiO_{3} and the systematic variation of valence states for a series of Bi and Pb perovskite oxides.

  4. Theory of Valence Transition in BiNiO3

    Science.gov (United States)

    Naka, Makoto; Seo, Hitoshi; Motome, Yukitoshi

    2016-02-01

    Motivated by the colossal negative thermal expansion recently found in BiNiO3 , the valence transition accompanied by the charge transfer between the Bi and Ni sites is theoretically studied. We introduce an effective model for Bi -6 s and Ni -3 d orbitals taking into account the valence skipping of Bi cations, and investigate the ground-state and finite-temperature phase diagrams within the mean-field approximation. We find that the valence transition is caused by commensurate locking of the electron filling in each orbital associated with charge and magnetic orderings, and the critical temperature and the nature of the transitions are strongly affected by the relative energy between the Bi and Ni levels and the effective electron-electron interaction in the Bi sites. The obtained phase diagram well explains the temperature- and pressure-driven valence transitions in BiNiO3 and the systematic variation of valence states for a series of Bi and Pb perovskite oxides.

  5. Revisiting El Niño Modokis

    Science.gov (United States)

    Marathe, Shamal; Ashok, Karumuri; Swapna, P.; Sabin, T. P.

    2015-12-01

    The suggestion that there exist two types of El Niño in the tropical Pacific has generated a debate in the community. Applying various linear and non-linear approaches and composite analysis technique on observed and reanalyzed climate datasets primarily for the 1950-2010 period, we revisit the variability of the tropical Pacific in the light of this debate. Our objective is to examine whether the proposed El Niño Modokis need a classification distinct from canonical El Niños. Even if the distinction is subject to short data records, we demonstrate that the El Niño Modoki events indeed display a seasonal evolution and teleconnections different from the canonical El Niños, and that the distinction is not subject to inclusion of the two extreme El Niños 1982 and 1997 as canonical El Niños. We show that the El Niño Modoki events are not an artifact associated with the orthogonality constraint associated with the EOF technique. Our cluster analysis shows that evolutions of the canonical El Niño and El Niño Modokis through various seasons differ from one another. Importantly, the dynamic and thermodynamic air-sea coupling strength is distinctly different between the El Niño Modoki and the canonical El Niño events. We find that, dynamic feedback intensity is stronger for El Niño Modoki (canonical El Niño) during boreal summer (winter); though the air-sea coupling strength, a major contributor to Bjerknes feedback, is maximum for Modokis during the developing stages, it decreases thereafter. In case of thermodynamic feedback intensity, SST-wind-evaporation feedback is dominant for El Niños while SST-SHF feedback is important during El Niño Modokis. However, we find that the thermodynamic feedback values significantly differ across the flux datasets.

  6. NiMax system for hadronic event generators in HEP

    International Nuclear Information System (INIS)

    Amelin, N.S.; Komogorov, M.E.

    2001-01-01

    We have suggested a new approach to the development and use of Monte Carlo event generators in high-energy physics (HEP). It is a component approach, when a complex numerical model is composed of standard components. Our approach opens a way to organize a library of HEP model components and provides a great flexibility for the construction of very powerful and realistic numerical models. To support this approach we have designed the NiMax software system (framework) written in C++

  7. First-principles assessment of hole transport in pure and Li-doped NiO.

    Science.gov (United States)

    Alidoust, Nima; Carter, Emily A

    2015-07-21

    Alloying nickel oxide (NiO) with lithium oxide (Li2O) at high Li concentrations may reduce NiO's band gap and expand its use as a light absorber in photocatalytic and tandem dye-sensitized solar cell technologies. In this work, we evaluate the viability of this alloy as a p-type hole transport material. We use embedded cluster models, along with unrestricted Hartree-Fock and complete active space self-consistent field theories, to study the impact of alloying on polaronic transport of holes. Our calculated energy barrier for hole transfer in undoped NiO is in excellent agreement with the experimental value of ∼0.1 eV. We predict that hole transport in NiO is anisotropic and mostly confined parallel to the (111) ferromagnetic planes. Applying the same model to Li-doped NiO indicates that isolated Li ions do not introduce free holes into NiO samples. However, free holes can be created in the homogeneous Li0.125Ni0.875O alloy, in which the Li concentration is very high. Our kinetic Monte Carlo calculations show that hole mobility in this alloy is lower than in undoped NiO. However, the additional free holes and the predicted lower band gap of Li0.125Ni0.875O should increase hole conductivity compared to NiO upon alloy formation. Therefore, Li0.125Ni0.875O alloys have potential for use as a hole transporter, as well as a sunlight absorber, in a variety of solar energy applications.

  8. Is El Niño really changing?

    Science.gov (United States)

    Capotondi, Antonietta; Sardeshmukh, Prashant D.

    2017-08-01

    El Niño-Southern Oscillation (ENSO) is the leading mode of tropical Pacific climate variability, with global impacts. Understanding how the statistics of ENSO events may be changing in response to global warming is of great interest and importance for society. A clear detection of such signals in observations has, however, been obscured by large event-to-event differences and apparent "regime shifts" such as that of the late 1970s. In particular, despite extensive research, it is not clear to what extent the observed long-term changes are systemic or random. Here we show using a multicomponent linear inverse modeling technique that statistically significant systemic changes have indeed occurred in ENSO dynamics since the late 1970s and have affected the evolution of El Niño and La Niña events from their embryonic to fully mature stages.

  9. Laser alloyed Al-Ni-Fe coatings

    CSIR Research Space (South Africa)

    Pityana, SL

    2008-10-01

    Full Text Available The aim of this work was to produce crack-free thin surface layers consisting of binary (Al-Ni, Al-Fe) and ternary (Al-Ni-Fe) intermetallic phases by means of a high power laser beam. The laser surface alloying was carried out by melting Fe and Ni...

  10. Study of the 66Ni(t,d)67Ni Transfer Reaction in Inverse Kinematics

    CERN Document Server

    Callens, Maarten

    The nickel isotopes with 28 protons are an interesting series in the study of nuclear structure. In the framework of the shell model nickel has a closed proton shell and the number of neutrons ranges from the magic numbers 20 to 50. The neutron-rich isotope $^{78}$Ni, is a waiting point in the nucleosynthesis r-process. In this process an intense neutron flux such as in supernovae results in the rapid capture of neutrons. The reaction sequence halts at $^{78}$Ni and waits for this nucleus to decay [Hea05]. For several decades the nickel isotopes have been studied extensively, particularly how the nuclear structure evolves when moving to the exotic boundaries of the nuclear chart. A remarkable feature was observed in $^{68}$Ni. This nucleus with 40 neutrons exhibits properties that are characteristic for doubly magic nuclei. Such as the energy of the first 2$^+$ state lies significantly higher than in neighbouring even-A isotopes, and is also higher than the energy of the second 0$^+$ state. Moreover also the ...

  11. Study of shell evolution in the Ni isotopes via one-neutron transfer reaction in $^{70}$Ni

    CERN Multimedia

    This proposal aims at the study of the single particle properties of the neutron-rich nickel isotopes, specifically of the $^{71}$Ni isotope via a $^{70}$Ni(d,p) $^{71}$Ni reaction. The $^{70}$Ni beam will be delivered by HIE-ISOLDE at 5.5 MeV/u onto a 1.0 mg/cm$^{2}$ CD$_{2}$ target. The protons produced in the (d,p) reaction will be detected with the T-REX silicon array either in singles or in coincidence with $\\gamma$- rays recorded by MINIBALL. The experimental results will be compared with large-scale shell-model calculations using effective interactions that involve large valence spaces for protons and neutrons, with excitations beyond the Z =28 and N=50 shell gap. This comparison will permit the study of the single-particle orbital d$_{5/2}$ that together with the quasi-SU3 partner g$_{9/2}$ gives rise to the collectivity in this region and has direct implications on the $^{78}$Ni.

  12. Nanostructure analysis of friction welded Pd-Ni-P/Pd-Cu-Ni-P metallic glass interface

    International Nuclear Information System (INIS)

    Ohkubo, T.; Shoji, S.; Kawamura, Y.; Hono, K.

    2005-01-01

    Friction welded Pd 40 Ni 40 P 20 /Pd 40 Cu 30 Ni 10 P 20 metallic glass interface has been characterized by energy filtering transmission electron microscopy. The interface is fully amorphous with a gradual compositional change of Cu and Ni in the range of 30 nm. By annealing above T g , the interdiffusion of Cu and Ni progressed in the supercooled liquid region, and the crystallization occurred from the Pd 40 Ni 40 P 20 glass

  13. Reservoir operation using El Niño forecasts-case study of Daule Peripa and Baba, Ecuador

    DEFF Research Database (Denmark)

    Gelati, Emiliano; Madsen, Henrik; Rosbjerg, Dan

    2014-01-01

    Reservoir operation is studied for the Daule Peripa and Baba system in Ecuador, where El Niño events cause anomalously heavy precipitation. Reservoir inflow is modelled by a Markov-switching model using El Niño-Southern Oscillation (ENSO) indices as input. Inflow is forecast using 9-month lead time...

  14. Microstructural degradation of Ni-YSZ anodes for solid oxide fuel cells

    Energy Technology Data Exchange (ETDEWEB)

    Thyden, K.

    2008-03-15

    Ni-YSZ cermets have been used as anode materials in SOFCs for more than 20 years. Despite this fact, the major cause of degradation within the Ni-YSZ anode, namely Ni sintering / coarsening, is still not fully understood. Even if microstructural studies of anodes in tested cells are of technological relevance, it is difficult to identify the effect from isolated parameters such as temperature, fuel gas composition and polarization. Model studies of high temperature aged Ni-YSZ cermets are generally performed in atmospheres containing relatively low concentrations of H2O. In this work, the microstructural degradation in both electrochemically longterm tested cells and high-temperature aged model materials are studied. Since Ni particle sintering / coarsening is attributed to be the major cause of anode degradation, this subject attains the primary focus. A large part of the work is focused on improving microstructural techniques and shows that the application of low acceleration voltages (<= 1 kV) in a FE-SEM makes it possible to obtain two useful types of contrast between the phases in Ni-YSZ composites. By changing between the ordinary lateral SE detector and the inlens detector, using similar microscope settings, two very different sample characteristics are probed: 1) The difference in secondary emission coefficient, delta, between the percolating and non-percolating Ni is maximized in the low-voltage range due to a high delta for the former and the suppression of delta by a positive charge for the latter. This difference yields a contrast between the two phases which is picked up by an inlens secondary electron detector. 2) The difference in backscatter coefficient, eta, between Ni and YSZ is shown to increase with decreasing voltage. The contrast is illustrated in images collected by the normal secondary detector since parts of the secondary signals are generated by backscattered electrons. High temperature aging experiments of model Ni-YSZ anode cermets show

  15. Effect of local metal microstructure on adsorption on bimetallic surfaces: Atomic nitrogen on Ni/Pt(111)

    Science.gov (United States)

    Guo, Wei; Vlachos, Dionisios G.

    2013-05-01

    The adsorption of atomic nitrogen on Ni/Pt(111) surface bimetallics has been investigated as a function of the local microstructure of Ni and Pt atoms via density functional theory (DFT) calculations. Microstructures include surface and subsurface Ni atoms on Pt(111) as limiting cases, and also small clusters of Ni in the first and/or second layer of Pt. It is shown that the binding energy of N can be approximated as a perturbation from that on the host metal (Pt) with a linear short-ranged correction from the guest metal (Ni) that accounts for the coordination environment of nitrogen up to the 3rd nearest Ni neighbor. This model is rationalized with the d-band center theory. Coverage effects are also included. The model can be parameterized with a limited number of DFT calculations and applied to other bimetallic catalysts to estimate the coverage dependent binding energy on complex metal microstructures.

  16. Simple synthesis of Ni-containing ordered mesoporous carbons and their adsorption/desorption of methylene orange

    International Nuclear Information System (INIS)

    Tian, Yong; Wang, Xiufang; Pan, Yufang

    2012-01-01

    Highlights: ► A simple route has been developed to synthesize Ni/OMCs without using a solvent for dissolving carbon precursor or magnetic source. ► The materials exhibited soft ferromagnetic characteristics desirable for the application in dye adsorption and separation under an external magnetic field. ► A simple desorption equation was obtained and the physical meanings of the parameters were well defined. - Abstract: A simple route has been developed to synthesize magnetic Ni-containing ordered mesoporous carbons (Ni/OMCs) without using a solvent for dissolving carbon precursor or magnetic source. The adsorption and desorption of methylene orange (MO) on the obtained Ni/OMCs were investigated. The effects of Ni(NO 3 ) 2 loading amount and carbonization temperature on the morphologies, the structural parameters and magnetic properties of these Ni/OMCs were evaluated by X-ray diffraction(XRD), N 2 sorption analysis, transmission electron microscopy(TEM) and physical property measurements. With the increase of Ni(NO 3 ) 2 loading amount, the ordering of the mesoporous structures, the specific surface area and the total pore volumes of Ni/OMCs decreased, but the pore diameters of Ni/OMCs and the sizes of Ni particle increased. The saturation magnetization strength could be easily adjusted by varying the amount of Ni(NO 3 ) 2 . The specific surface area and total pore volumes decreased with the increasing of carbonization temperature. The size of Ni particle was the biggest at 750 °C. The adsorption of MO into Ni/OMCs followed the Sips adsorption model. More interestingly, a simple equation was obtained and was proved to well fit the desorption behavior of MO on Ni/OMCs. The values for the relative fitted parameters were obtained and the physical meanings of the parameters were well defined.

  17. NiS(NPs)-PEDOT-PSS composite counter electrode for a high efficiency dye sensitized solar cell

    Energy Technology Data Exchange (ETDEWEB)

    Maiaugree, Wasan [Integrated Nanotechnology Research Center, Department of Physics, Faculty of Science, Khon Kaen University, Khon Kaen 40002 (Thailand); Center for Alternative Energy Research and Development, Khon Kaen University, Khon Kaen 40002 (Thailand); Pimparue, Pachara; Jarernboon, Wirat [Integrated Nanotechnology Research Center, Department of Physics, Faculty of Science, Khon Kaen University, Khon Kaen 40002 (Thailand); Pimanpang, Samuk [Department of Physics, Faculty of Science, Srinakharinwirot University, Bangkok 10110 (Thailand); Amornkitbamrung, Vittaya [Integrated Nanotechnology Research Center, Department of Physics, Faculty of Science, Khon Kaen University, Khon Kaen 40002 (Thailand); Swatsitang, Ekaphan, E-mail: ekaphan@kku.ac.th [Integrated Nanotechnology Research Center, Department of Physics, Faculty of Science, Khon Kaen University, Khon Kaen 40002 (Thailand); Center for Alternative Energy Research and Development, Khon Kaen University, Khon Kaen 40002 (Thailand)

    2017-06-15

    Graphical abstract: Figure(a) and (b) represent models depict PEDOT-PSS counter electrodes of DSSC without and with NiS NPs modification, respectively. The active surface area of PEDOT-PSS polymer can be improved by combining with NiS(NPs). The I-V curves in figure (c) show the superior photovoltaic conversion efficiency of 8.18% for NiS(NPs)/PEDOT-PSS DSSC. - Highlights: • Active surface area of PEDOT-PSS CE can be improved by mixing with NiS(NPs). • Electrocatalytic activity of mixed NiS(NPs)/PEDOT-PSS polymer is also improved. • NiS(NPs)/PEDOT-PSS CE shows a very low charge transfer resistance of 0.46 Ω. • In this work, the high photovoltaic conversion efficiency of 8.18% is achieved. - Abstract: Nickel sulfide (NiS) nanoparticles (NPs) (NiS(NPs)) were prepared by the hydrothermal method. X-ray diffraction (XRD) results indicate the hexagonal structure of NiS(NPs). SEM micrographs reveal the agglomeration of irregular hexagonal – shaped NiS(NPs) with estimated particle size in the range of 50–150 nm. Counter electrodes (CEs) of dye-sensitized solar cells (DSSCs) were prepared by coating the composite slurry of different NiS(NPs) loadings and Poly (3, 4-Ethylendioxythiophene) – Poly (Styrene Sulfonate) (PEDOT-PSS) on fluoride-doped tin oxide (FTO) substrates using a doctor blading technique. Cyclic voltammetry (CV) results indicate that the composites of NiS(NPs) and PEDOT-PSS (NiS(NPs)/PEDOT-PSS) films could function as a catalyst for I{sub 3}{sup −} reduction with a maximum cell efficiency of 8.18% for a cell of 0.3 g NiS(NPs) loading.

  18. A new index for identifying different types of El Niño Modoki events

    Science.gov (United States)

    Wang, Xin; Tan, Wei; Wang, Chunzai

    2018-04-01

    El Niño Modoki events can be further classified into El Niño Modoki I and II in terms of their opposite impacts on southern China rainfall (Wang and Wang, J Clim 26:1322-1338, 2013) and the Indian Ocean dipole mode (Wang and Wang, Clim Dyn 42:991-1005, 2014). The present paper develops an index to identify the types of El Niño events. The El Niño Modoki II (MII) index is defined as the leading principle component of multivariate empirical orthogonal function analysis of the normalized El Niño Modoki index, Niño4 index and 850 hPa relative vorticity anomalies averaged near the Philippine Sea during autumn. The MII index exhibits dominant variations on interannual (2-3 and 4-5 years) and decadal (10-20 years) timescales. El Niño Modoki II events can be well identified by using the MII index value being larger than 1 standard deviation. Further analyses and numerical model experiments confirm that the MII index can portray the major oceanic and atmospheric features of El Niño Modoki II events. The constructed MII index along with previous ENSO indices can be used for classifying and identifying all types of El Niño events. Because of distinct impacts induced by different types of El Niño events, the implication of the present study is that climate prediction and future climate projection under global warming can be improved by using the MII index and other indices to identify the types of El Niño events.

  19. Noncollinear Spin Structure in Fe--Ni Invar Alloy Probed by Magnetic EXAFS at High Pressure

    Science.gov (United States)

    Matsumoto, Ken; Maruyama, Hiroshi; Ishimatsu, Naoki; Kawamura, Naomi; Mizumaki, Masaichiro; Irifune, Tetsuo; Sumiya, Hitoshi

    2011-02-01

    To examine theoretical models of the Invar effect, X-ray magnetic circular dichroism and magnetic extended X-ray absorption fine structure (MEXAFS) measurements are performed under high pressures at the Fe and Ni K-edges in 35.4 at. % Ni--Fe alloy. An oscillatory MEXAFS signal is observed up to 6 GPa. Its amplitude significantly decreases with increasing pressure. The magnetic component of the radial distribution function, obtained by taking the Fourier transform, shows a different reduction in the ferromagnetic correlations of Fe and Ni absorbing atoms. The present results are favorable to the noncollinear spin structure picture rather than the Fe 2γ-state model.

  20. Strangeness production in Ni+Ni collisions at 1.93 AGeV

    International Nuclear Information System (INIS)

    Lopez, X.

    2004-12-01

    This work deals with the production of strange particles in Ni + Ni collisions at 1.93 A GeV detected with the Fopi (four pi) detector at the heavy ion synchrotron SIS (GSI - Germany). We have limited our investigation to the study of Λ and Ξ hyperons. The first chapter presents the models used to describe ultra-relativistic heavy ions collisions. In the second chapter we present the main experimental results concerning the production and transport of strange particles in an energy domain ranging from SIS to RHIC (relativistic heavy ion collider) energies. The third chapter is dedicated to the specificities of the Fopi detector. The fourth chapter deals with the production of Λ particles in Ni + Ni collisions. An analysis method based on neuron network has been used in parallel with a more classical method. The production rate and temperature of Λ have been deduced from both methods. The neuron network method gives a statistical gain and allows a better identification of particles with low transverse impulses. The fifth chapter is dedicated to the detection of the doubly strange Ξ - particle. A detailed study about the stability of the signal is presented. In the last chapter all our experimental results are confronted with theoretical predictions. The UrQMD model that uses a hard equation of state, can simulate satisfactorily the production rates of Λ and K + as well as their dependency on collision centrality despite the fact that this model does not use a potential linked to the medium density. The comparison between experimental results and predictions given by the IQMD model (that is based on a soft equation of state) is better when the version of the model that does not take into account the effects of the media is used. We see that the choices for the nuclear matter compressibility, for the particles involved in Kaon and Λ creation process, or for the interaction potential with dense medium, appear to be degrees of freedom that are difficult to adjust

  1. Polymorphous band structure model of gapping in the antiferromagnetic and paramagnetic phases of the Mott insulators MnO, FeO, CoO, and NiO

    Science.gov (United States)

    Trimarchi, Giancarlo; Wang, Zhi; Zunger, Alex

    2018-01-01

    The existence of band gaps in both the antiferromagnetic (AFM) and paramagnetic (PM) phases of the classic NaCl-structure Mott insulators MnO, FeO, CoO, and NiO is traditionally viewed and taught as a manifestation of strong correlation whereby insulation results from electrons moving across the lattice forming states with doubly occupied d orbitals on certain atomic sites and empty d orbitals on other sites. Within such theories, the gap of the AFM and PM phases of these oxides emerges even in the absence of spatial symmetry breaking. The need for such a correlated picture is partially based on the known failure of the commonly used band models for the PM phase that assume for such a spin disordered state the macroscopically averaged NaCl structure, where all transition metal (TM) sites are symmetry-equivalent (a monomorphous description), producing a gapless PM state with zero magnetic moments, in sharp conflict with experiment. Here, we seek to understand the minimum theoretical description needed to capture the leading descriptors of ground state Mott insulation in the classic, 3 d monoxide Mott systems—gapping and moment formation in the AFM and PM phase. As noted by previous authors, the spin-ordered AFM phase in these materials already shows in band theory a significant band gap when one doubles the NaCl unit cell by permitting different potentials for transition-metal atoms with different spins. For the spin-disordered PM phase, we allow analogously larger NaCl-type supercells where each TM site can have different spin direction and local bonding environments (i.e., disordered), yet the total spin is zero. Such a polymorphous description has the flexibility to acquire symmetry-breaking energy-lowering patterns that can lift the degeneracy of the d orbitals and develop large on-site magnetic moments without violating the global, averaged NaCl symmetry. Electrons are exchanged between spin-up and spin-down bands to create closed-shell insulating

  2. Neutron components of isoscalar giant quadrupole resonance states in 58,60,62,64Ni

    International Nuclear Information System (INIS)

    Antalik, R.

    1989-01-01

    The neutron-proton matrix element ratios (η) for isoscalar giant quadrupole resonance states of even Ni isotopes are investigated within the framework of the shell model quasiparticle random-phase approximation. The dependence of η ratios on radial neutron and proton ground state density distribution differences (Δ np ) is found to be about 1.0-1.5 Δ np . The theoretical η ratios are 14-23% lower than the hydrodynamical limit. The agreement between theoretical and experimental η ratios is observed for 58 Ni and 60 Ni isotopes. The η ratios for 62 Ni and 64 Ni suggested by the resonance π ± inelastic scattering cannot be interpreted even including the radial variations of the neutron fields. 18 refs.; 3 tabs

  3. Gamma-ray spectroscopy of the neutron-rich Ni region through heavy-ion deep-inelastic collisions

    International Nuclear Information System (INIS)

    Ishii, T.; Asai, M.; Matsuda, M.; Ichikawa, S.; Makishima, A.; Hossain, I.; Kleinheinz, P.; Ogawa, M.

    2002-01-01

    Nuclei in the neutron-rich Ni region have been studied by γ-ray spectroscopy. Gamma-rays emitted from isomers, with T 1/2 >1 ns, produced in heavy-ion deep-inelastic collisions were measured with an isomer-scope. The nuclear structure of the doubly magic 68 Ni and its neighbor 69,71 Cu is discussed on the basis of the shell model. Future experiments for more neutron-rich Ni nuclei are also viewed. (orig.)

  4. Gamma-ray spectroscopy of the neutron-rich Ni region through heavy-ion deep-inelastic collisions

    Science.gov (United States)

    Ishii, T.; Asai, M.; Makishima, A.; Hossain, I.; Kleinheinz, P.; Ogawa, M.; Matsuda, M.; Ichikawa, S.

    Nuclei in the neutron-rich Ni region have been studied by γ-ray spectroscopy. Gamma-rays emitted from isomers, with T1/2 > 1 ns, produced in heavy-ion deep-inelastic collisions were measured with an isomer-scope. The nuclear structure of the doubly magic 68Ni and its neighbor 69,71Cu is discussed on the basis of the shell model. Future experiments for more neutron-rich Ni nuclei are also viewed.

  5. Synthesis and magnetic characterization of Sr-based Ni{sub 2}X-type hexaferrite

    Energy Technology Data Exchange (ETDEWEB)

    Kamishima, K., E-mail: kamisima@fms.saitama-u.ac.jp; Mashiko, T.; Kakizaki, K.; Sakai, M. [Graduate School of Science and Engineering, Saitama University, 255 Shimo-Okubo, Saitama 338-8570 (Japan); Watanabe, K. [Biomolecular Characterization Unit, Center of Sustainable Resource Science, RIKEN, 2-1 Wako, Saitama 351-0198 (Japan); Abe, H. [Advanced Electronic Materials Center, National Institute of Materials Science, 1-1 Namiki, Tsukuba 305-0044 (Japan)

    2015-10-15

    We have investigated the synthesis conditions, and the magnetic properties of the Sr{sub 2}Ni{sub 2}X-type hexagonal ferrite, Sr{sub 2}Ni{sub 2}Fe{sub 28}O{sub 46}. The Sr{sub 2}Ni{sub 2}X-type hexaferrite was synthesized at 1240{sup ∘}C. The spontaneous magnetization at 5 K was 44.2 μ{sub B}/f.u., suggesting that most of the Ni{sup 2+} ions are at the up-spin octahedral sites in the spinel-structure blocks within the model of a Néel-type collinear ferrimagnetic structure. The Curie temperature of the Sr{sub 2}Ni{sub 2}X-type hexaferrite was estimated to be T{sub C}[Sr{sub 2}Ni{sub 2}X] = 472{sup ∘}C. This is consistent with the difference of the block stacking structures of SrM-type, Sr{sub 2}Ni{sub 2}X-type, SrNi{sub 2}W-type, and nickel spinel ferrites.

  6. Phase equilibria in the ternary In-Ni-Sn system at 700 °C.

    Science.gov (United States)

    Schmetterer, C; Zemanova, A; Flandorfer, H; Kroupa, A; Ipser, H

    2013-04-01

    The phase equilibria of the ternary system In-Ni-Sn were investigated experimentally at 700 °C using X-ray diffraction (XRD) and scanning electron microscopy (SEM) including electron micro probe analysis (EMPA) and energy dispersive X-ray spectroscopy (EDX). A corresponding isothermal section was established based on these results. This particular temperature was chosen because it allowed obtaining reliable results within reasonable time. The existence of the ternary phase InNi 6 Sn 5 was confirmed whereas the ternary compound In 2 NiSn, reported earlier in literature, was found to be part of a large solid solution field based on binary InNi. The ternary solubility of the binary phases was established, and continuous solid solutions were found between the isostructural phases Ni 3 Sn LT and InNi 3 as well as between Ni 3 Sn 2 HT and InNi 2 . In addition, this isothermal section could be well reproduced by CALPHAD modelling. The resulting calculated isotherm at 700 °C is presented, too, and compared with the experimental results.

  7. Structural and hyperfine properties of Ni-doped SnO{sub 2} nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Aragon, Fermin H.; Coaquira, Jose Antonio H., E-mail: coaquira.ja@gmail.com [Universidade de Brasilia, Instituto de Fisica (Brazil); Cohen, Renato; Nagamine, Luiz C. C. M. [Universidade de Sao Paulo, Instituto de Fisica (Brazil); Hidalgo, Pilar [Universidade de Brasilia, Faculdade Gama- FGA (Brazil); Brito, S. L. M.; Gouvea, D. [Universidade de Sao Paulo, Departamento de Metalurgia e Engenharia de Materiais, Escola Politecnica (Brazil)

    2012-05-15

    In this work, we report on the study of Ni-doped SnO{sub 2} nanoparticles prepared by a polymer precursor method. X-ray diffraction (XRD) data analysis evidenced the formation of only the tetragonal rutile-type phase in all samples. Meanwhile, the mean crystallite size shows a progressive reduction with the Ni content, the unit cell volume and residual strain does not show any clear dependence on the Ni content. Room temperature Moessbauer spectra were well modeled by using two doublets which represent the particle core and shell surface regions. Assuming that the isomer shift (IS) of the core region remains constant for all samples, the isomer shift of the shell region shows a linear increase with the Ni content. That increase was assigned to the progressive increase in the s-electronic density produced by either the generation of oxygen vacancies or the formation of Ni complexes at the surface due to the surface segregation of Ni ions as the Ni content is increased. Larger QS values obtained for the doublet of the shell are associated with the stronger distortions in the nearest surrounding of tin atoms produced by the surface segregation of Ni ions.

  8. Seed-mediated synthesis of cross-linked Pt-NiO nanochains for methanol oxidation

    Science.gov (United States)

    Gu, Zhulan; Bin, Duan; Feng, Yue; Zhang, Ke; Wang, Jin; Yan, Bo; Li, Shumin; Xiong, Zhiping; Wang, Caiqin; Shiraishi, Yukihide; Du, Yukou

    2017-07-01

    A simple method was reported for employing NiO nanoparticles act as seeds and then different amounts of Pt2+ were reduced on the NiO nanoparticles, forming a cross-linked Pt-NiO nanocatalysts. These as-prepared catalysts were characterized using different physical-chemical techniques, including X-ray diffraction (XRD), transmission electron microscopy (TEM) and X-ray photoelectron spectroscopy (XPS). The results indicate that the morphology of the cross-linked Pt-NiO nanochain was successfully produced regardless of the molar ratio of Pt2+ to NiO precursors. The electrochemical characteristics of Pt-NiO nanochain catalysts were evaluated for the oxidation of methanol as a model reaction, which verify that the Pt-NiO catalysts show enhanced activity and high stability in comparison with the commercial Pt/C catalyst. The optimized ratio of Pt to NiO is 1:1, then tuned by simple adjusting the feed ratio of the precursors as well. The synthesized nanocatalysts will be found the great potential applications as electrocatalysts for fuel cells owe to their enhanced catalytic performance and long-term stability.

  9. Physical Simulation of the Random Failure of Implanted Braided NiTi Stents

    Science.gov (United States)

    Hirmanová, Klára; Pilch, Jan; Racek, Jan; Heller, Luděk; Šittner, Petr; Recman, Lukáš; Petrenec, Martin; Sedlák, Petr

    2014-07-01

    A problem of random clinical failures of the braided esophageal NiTi stents has been addressed by performing physical simulation experiments on helical NiTi springs loaded in cyclic tension in air, water, and simulated biological fluid. Strains and stresses involved in spring deformation were analyzed through simulation by FEM implemented SMA model. It was found that the fatigue life of NiTi springs is significantly lower in fluids than in the air pointing toward the corrosion fatigue mechanism. There is, however, a fatigue limit roughly corresponding to the onset of martensitic transformation in the wire, which is not common for corrosion fatigue. It is proposed that surface TiO2 oxide cracking plays major role in that. Once the oxide layer on the NiTi wire surface fractures, typically during the first mechanical cycle, cracks in the oxide layer periodically open and close during subsequent mechanical cycling. This leads to the localization of mechanical and corrosion attacks under the oxide cracked regions. Microcracks within the surface oxide layer crossing over into the NiTi matrix were indeed revealed by scanning electron microscopy of FIB sections of fatigued wires. A corrosion assisted mechanism for fatigue crack nucleation at the interface between the surface oxide and NiTi matrix is proposed based on the available evidence. The approach opens a space for a better assessment of the corrosion fatigue performance of superelastic NiTi and ultimately for estimation of the lifetime of implanted braided NiTi stents.

  10. Behavioural and biochemical responses to metals tested alone or in mixture (Cd-Cu-Ni-Pb-Zn) in Gammarus fossarum: From a multi-biomarker approach to modelling metal mixture toxicity.

    Science.gov (United States)

    Lebrun, Jérémie D; Uher, Emmanuelle; Fechner, Lise C

    2017-12-01

    Metals are usually present as mixtures at low concentrations in aquatic ecosystems. However, the toxicity and sub-lethal effects of metal mixtures on organisms are still poorly addressed in environmental risk assessment. Here we investigated the biochemical and behavioural responses of Gammarus fossarum to Cu, Cd, Ni, Pb and Zn tested individually or in mixture (M2X) at concentrations twice the levels of environmental quality standards (EQSs) from the European Water Framework Directive. The same metal mixture was also tested with concentrations equivalent to EQSs (M1X), thus in a regulatory context, as EQSs are proposed to protect aquatic biota. For each exposure condition, mortality, locomotion, respiration and enzymatic activities involved in digestive metabolism and moult were monitored over a 120h exposure period. Multi-metric variations were summarized by the integrated biomarker response index (IBR). Mono-metallic exposures shed light on biological alterations occurring at environmental exposure levels in gammarids and depending on the considered metal and gender. As regards mixtures, biomarkers were altered for both M2X and M1X. However, no additive or synergistic effect of metals was observed comparing to mono-metallic exposures. Indeed, bioaccumulation data highlighted competitive interactions between metals in M2X, decreasing subsequently their internalisation and toxicity. IBR values indicated that the health of gammarids was more impacted by M1X than M2X, because of reduced competitions and enhanced uptakes of metals for the mixture at lower, EQS-like concentrations. Models using bioconcentration data obtained from mono-metallic exposures generated successful predictions of global toxicity both for M1X and M2X. We conclude that sub-lethal effects of mixtures identified by the multi-biomarker approach can lead to disturbances in population dynamics of gammarids. Although IBR-based models offer promising lines of enquiry to predict metal mixture toxicity

  11. Exchange bias of Ni nanoparticles embedded in an antiferromagnetic IrMn matrix

    International Nuclear Information System (INIS)

    Kuerbanjiang, Balati; Herr, Ulrich; Wiedwald, Ulf; Haering, Felix; Ziemann, Paul; Biskupek, Johannes; Kaiser, Ute

    2013-01-01

    The magnetic properties of Ni nanoparticles (Ni-NPs) embedded in an antiferromagnetic IrMn matrix were investigated. The Ni-NPs of 8.4 nm mean diameter were synthesized by inert gas aggregation. In a second processing step, the Ni-NPs were in situ embedded in IrMn films or SiO x films under ultrahigh vacuum (UHV) conditions. Findings showed that Ni-NPs embedded in IrMn have an exchange bias field H EB = 821 Oe at 10 K, and 50 Oe at 300 K. The extracted value of the exchange energy density is 0.06 mJ m −2 at 10 K, which is in good accordance with the results from multilayered thin film systems. The Ni-NPs embedded in SiO x did not show exchange bias. As expected for this particle size, they are superparamagnetic at T = 300 K. A direct comparison of the Ni-NPs embedded in IrMn or SiO x reveals an increase of the blocking temperature from 210 K to around 400 K. The coercivity of the Ni-NPs exchange coupled to the IrMn matrix at 10 K is 8 times larger than the value for Ni-NPs embedded in SiO x . We studied time-dependent remanent magnetization at different temperatures. The relaxation behavior is described by a magnetic viscosity model which reflects a rather flat distribution of energy barriers. Furthermore, we investigated the effects of different field cooling processes on the magnetic properties of the embedded Ni-NPs. Exchange bias values fit to model calculations which correlate the contribution of the antiferromagnetic IrMn matrix to its grain size. (paper)

  12. Comment on Qian et al. 2008: La Niña and El Niño composites of atmospheric CO2 change

    Directory of Open Access Journals (Sweden)

    Andrew M. Chiodi

    2014-02-01

    Full Text Available It is well known that interannual extremes in the rate of change of atmospheric CO2 are strongly influenced by the occurrence of El Niño-Southern Oscillation (ENSO events. Qian et al. presented ENSO composites of atmospheric CO2 changes. We show that their composites do not reflect the atmospheric changes that are most relevant to understanding the role of ENSO on atmospheric CO2 variability. We present here composites of atmospheric CO2 change that differ markedly from those of Qian et al., and reveal previously unreported asymmetries between the effects on the global carbon system of El Niño and La Niña events. The calendar-year timing differs; La Niña changes in atmospheric CO2 typically occur primarily over September–May, while El Niño changes occur primarily over December–August. And the net concentration change is quite different; La Niña changes are about half the size of El Niño changes. These results illustrate new aspects of the ENSO/global carbon budget interaction and provide useful global-scale benchmarks for the evaluation of Earth System Model studies of the carbon system.

  13. Link between chemotactic response to Ni2+ and its adsorption onto the Escherichia coli cell surface.

    Science.gov (United States)

    Borrok, David; Borrok, M Jack; Fein, Jeremy B; Kiessling, Laura L

    2005-07-15

    Bacterial chemotaxis is of medical, biological, and geological significance. Despite its importance, current chemotaxis measurements fail to account for the speciation of the chemical effector and the protonation state of the bacterial surface. We hypothesize that adsorption of Ni2+ onto the surface of Escherichia coli can influence its effective concentration and therefore influence its ability to induce a repellent response. By measuring repellent response at different pH values, the influence of Ni2+ adsorption on chemotaxis was assessed. In addition, we tested the effect of different Ni2+ chelating agents. Our data indicate that adsorption reactions influence the chemotactic response to Ni2+. We use potentiometric titration and Ni2+ adsorption experiments to develop and constrain a thermodynamic model capable of quantifying the concentration of Ni2+ at the bacteria/solution interface. Results from this model predict that the concentration of adsorbed Ni2+ is linearly proportional to the magnitude of the chemotactic response in E. coli. If adsorption is linked to chemotaxis in other cases, then chemotactic responses in realistic settings depend on a number of environmental factors such as pH, competing binding agents (e.g., aqueous organic acids, natural organic matter, mineral surfaces, etc.), and ionic strength. Our modeling approach quantifies adsorbed species on bacterial surfaces and may be used to predict the responses of different species to a variety of chemoeffectors. Our data suggest that specified changes in environmental conditions can be used to tune chemotactic responses in natural biological and geological settings.

  14. Niños investigadores

    OpenAIRE

    Manfred Liebel

    2007-01-01

    EN LA SOCIOLOGÍA INFANTIL, EL PRINCIPIO DE HACER PARTICIPAR A NIÑAS Y NIÑOS en los procesos de investigación está ampliamente reconocido. Tomando como punto de partida ese principio de participación, el presente aporte analiza la pregunta de en qué medida y de qué manera los niños mismos pueden actuar como investigadores. A fin de apreciar en lo justo la perspectiva de los niños, el presente trabajo aboga por que –con el debido acompañamiento de personas adultas– la investigación esté en mano...

  15. Flowsheet for 63Ni production

    International Nuclear Information System (INIS)

    Williams, D.F.; Knauer, J.B.; O'Kelley, G.D.; Wiggins, J.T.; Porter, C.E.

    1992-01-01

    The production of large quantities of high specific activity 63 Ni (>10Ci/g) requires both a highly enriched 62 Ni target and a long irradiation period at high neutron flux. Trace impurities in the nickel and associated target materials are also activated and account for a significant fraction of the discharged activity and essentially all of the gamma activity. While most of these undesirable activation products (mainly transition metals) can be easily removed as chloride complexes during anion exchange, chromium, present as 51 Cr, and manganese, present as 54 Mn, are exceptions and require solvent extraction of the in-cell product to achieve the desired purity. In addition to summarizing the current development and production experience, optimized flowsheets are discussed

  16. niños preescolares

    Directory of Open Access Journals (Sweden)

    Claudia Rosario Portilla Ramírez

    2007-01-01

    Full Text Available Este estudio explora la relación entre la escritura y la comprensión de la referencia a través de una tarea de sinonimia en niños entre 5 y 6 años de edad, de origen latinoamericano, escolarizados en Barcelona (España. Las variables relacionadas con la tarea de sinonimia fueron (a la comprensión de la entidad lingüística nombre y (b el nivel de conceptualización de la escritura de los niños y la presencia de etiquetas escritas durante la tarea. Para la tarea de sinonimia se utilizaron pares de sinónimos dialectales del español (de Latinoamérica y de la Península Ibérica. Los resultados mostraron una diferenciación en el razonamiento de los niños, la cual dependía de la comparación entre lenguaje oral y lenguaje escrito en el desarrollo de la tarea, evidenciando una mayor aceptación de la sinonimia en la modalidad de lenguaje oral que en la modalidad de lenguaje escrito.

  17. Robust contribution of decadal anomalies to the frequency of central-Pacific El Niño

    Science.gov (United States)

    Sullivan, Arnold; Luo, Jing-Jia; Hirst, Anthony C.; Bi, Daohua; Cai, Wenju; He, Jinhai

    2016-12-01

    During year-to-year El Niño events in recent decades, major sea surface warming has occurred frequently in the central Pacific. This is distinct from the eastern Pacific warming pattern during canonical El Niño events. Accordingly, the central-Pacific El Niño exerts distinct impacts on ecosystems, climate and hurricanes worldwide. The increased frequency of the new type of El Niño presents a challenge not only for the understanding of El Niño dynamics and its change but also for the prediction of El Niño and its global impacts at present and future climate. Previous studies have proposed different indices to represent the two types of El Niño for better understanding, prediction and impact assessment. Here, we find that all popularly used indices for the central-Pacific El Niño show a dominant spectral peak at a decadal period with comparatively weak variance at interannual timescales. Our results suggest that decadal anomalies have an important contribution to the occurrence of the central-Pacific El Niño over past decades. Removing the decadal component leads to a significant reduction in the frequency of the central-Pacific El Niño in observations and in Coupled Model Intercomparison Project Phase 5 simulations of preindustrial, historical and future climate.

  18. Valence changes associated with the metal-insulator transition in Bi1-xLaxNiO3

    Science.gov (United States)

    Wadati, H.; Takizawa, M.; Tran, T. T.; Tanaka, K.; Mizokawa, T.; Fujimori, A.; Chikamatsu, A.; Kumigashira, H.; Oshima, M.; Ishiwata, S.; Azuma, M.; Takano, M.

    2005-10-01

    Perovskite-type BiNiO3 is an insulating antiferromagnet in which a charge disproportionation occurs at the Bi site. La substitution for Bi suppresses the charge disproportionation and makes the system metallic. We have measured the photoemission and x-ray-absorption (XAS) spectra of Bi1-xLaxNiO3 to investigate how the electronic structure changes with La doping. From Ni 2p XAS, we observed an increase of the valence of Ni from 2+ toward 3+ . Combined with the core-level photoemission study, it was found that the average valence of Bi remains ˜4+ and that the Ni valence behaves as ˜(2+x)+ , that is, La substitution results in a hole doping at the Ni sites. In the valence-band photoemission spectra, we observed a Fermi cutoff for x>0 , consistent with the metallic behavior of the La-doped compounds. The Ni 2p XAS, Ni 2p core-level photoemission, and valence-band photoemission spectra were analyzed by configuration-interaction cluster-model calculation, and the spectral line shapes were found to be consistent with the gradual Ni2+→Ni3+ valence change.

  19. Performance of the PdNi and PdNiSe as cathodes in PEM fuel cells; Desempeno de PdNi y PdNiSe como catodos en celdas de combustible tipo PEM

    Energy Technology Data Exchange (ETDEWEB)

    Santana, A.; Ramos-Sanchez, G.; Vazquez, G.; Solorza-Feria, O. [Centro de Investigaciones y de Estudios Avanzados del IPN, Mexico D.F. (Mexico)]. E-mail: gramos@cinvestav.mx

    2009-09-15

    The search for new materials capable of catalyzing oxygen reactions in low temperature fuel cells continues to be one of the key issues in the development of a hydrogen economy. Electrochemical and physical characterization studies have demonstrated that the PdNi and PdNiSe catalysts have adequate properties for use as cathodes in fuel cells. Nevertheless, the performance of the materials in proton exchange membrane (PEM) fuel cells depends not only on the catalytic properties but also on the adequate preparation of the electrocatalyst membrane interface (EMI). This work presents the results of the search for optimal conditions to prepare the EMIs with PdNi and PdNiSe cathodes. There are many variables for handling the preparation of the interfaces, nevertheless our search focuses on two: catalyst ratio/Vulcan Carbon® and the catalyst amount. Interfaces were prepared with an active area of 5 cm{sup 2} with PdNi and PdNiSe cathodes and carbon fabric anode with Pt E-tek®. These interfaces were tested with an ElectroChem model under different gas pressure and temperature conditions. The optimization method was carried out using a simplex method with the variables mentioned above and power density per unit mass and catalyst area as response variables. [Spanish] La busqueda de nuevos materiales capaces de catalizar la Reaccion de Oxigeno (RRO) en celdas de combustible de baja temperatura, sigue siendo uno de los temas clave para el desarrollo de una Economia del Hidrogeno. Estudios electroquimicos y de caracterizacion fisica han demostrado que los catalizadores PdNi y PdNiSe, tienen las propiedades adecuadas para poder ser utilizados como catodos en celdas de combustible; sin embargo el desempeno de los materiales en celdas de combustible de membrana de intercambio protonico (PEM), no solo depende de las propiedades del catalizador, sino tambien de la preparacion adecuada del Ensamble Membrana Electrocatalizador (EME). En este trabajo se presentan los resultados de la

  20. Processing and Mechanical Properties of Directionally Solidified NiAl/NiAlTa Alloys

    Science.gov (United States)

    Johnson, D. R.; Oliver, B. F.; Noebe, R. D.; Whittenberger, J. D.

    1994-01-01

    Promising creep strengths were found for a directionally solidified NiAl-NiAlTa alloy when compared to other NiAl based intermetallics. The directionally solidified alloy had an off-eutectic composition that resulted in microstructures consisting of NiAl dendrites surrounded by aligned eutectic regions. The room temperature toughness of the two phase alloy was similar to that of polycrystalline NiAl even with the presence of the brittle Laves phase NiAlTa. Alloying additions that may improve the room temperature toughness by producing multiphase alloys are discussed.

  1. Exploring dissipative processes at high angular momentum in 58Ni+60Ni reactions

    Directory of Open Access Journals (Sweden)

    Williams E.

    2016-01-01

    Full Text Available Current coupled channels (CC models treat fusion as a coherent quantum-mechanical process, in which coupling between the collective states of the colliding nuclei influences the probability of fusion in near-barrier reactions. While CC models have been used to successfully describe many experimental fusion barrier distribution (BD measurements, the CC approach has failed in the notable case of 16O+208Pb. The reason for this is poorly understood; however, it has been postulated that dissipative processes may play a role. Traditional BD experiments can only probe the physics of fusion for collisions at the top of the Coulomb barrier (L = 0ħ. In this work, we will present results using a novel method of probing dissipative processes inside the Coulomb barrier. The method exploits the predicted sharp onset of fission at L ~ 60ħ for reactions forming compound nuclei with A < 160. Using the ANU’s 14UD tandem accelerator and CUBE spectrometer, reaction outcomes have been measured for the 58Ni+60Ni reaction at a range of energies, in order to explore dissipative processes at high angular momentum. In this reaction, deep inelastic processes have been found to set in before the onset fission at high angular momentum following fusion. The results will be discussed in relation to the need for a dynamical model of fusion.

  2. Theoretical study on instability mechanism of jet-induced sloshing. Model development using Orr-Sommerfeld equation generalized for non-parallel flow; Funryu reiki sloshing gensho no hassei kiko ni kansuru rironteki kenkyu. Hiheiko nagare ni ippankashita Orr-Sommerfeld hoteishiki wo mochiita model ka

    Energy Technology Data Exchange (ETDEWEB)

    Eguchi, Y. [Central Research Institute of Electric Power Industry, Tokyo (Japan)

    1998-07-25

    A theoretical model was developed to study the mechanism of free surface sloshing in a vessel induced by a steady vertical jet flow. In the model, jet deflection is calculated with eigen values of the generalized Orr-Sommerfeld equation which is applicable to slightly non-parallel jet. Instability criteria employed in the model are (1) resonace condition between sloshing and jet frequencies and (2) {pi} phase relation between jet displacement at an inlet and global jet deflection. Numerical results of the mathematical model have shown good agreement with experimental ones, which justifies that the inherent instability of free jet itself and edge tone feedback are the main causes of the self-excited sloshing. 9 refs., 10 figs.

  3. Mechanical properties of NiTi and CuNiTi shape-memory wires used in orthodontic treatment. Part 1: stress-strain tests

    Directory of Open Access Journals (Sweden)

    Marco Abdo Gravina

    2013-08-01

    Full Text Available OBJECTIVE: This research aimed to compare, through traction tests, eight types of superelastic and heat-activated NiTi archwires, by six trade companies (GAC, TP, Ormco, Masel, Morelli and Unitek to those with addition of copper (CuNiTi 27ºC and 35ºC, Ormco. METHODS: The tests were performed in an EMIC mechanical testing machine, model DL10000, capacity of 10 tons, at the Military Institute of Engineering (IME. RESULTS: The results showed that, generally, heat-activated NiTi archwires presented slighter deactivation loadings in relation to superelastic. Among the archwires that presented deactivation loadings biologically more adequate are the heat-activated by GAC and by Unitek. Among the superelastic NiTi, the CuNiTi 27ºC by Ormco were the ones that presented slighter deactivation loadings, being statistically (ANOVA similar, to the ones presented by the heat-activated NiTi archwires by Unitek. When compared the CuNiTi 27ºC and 35ºC archwires, it was observed that the 27ºC presented deactivation forces of, nearly, ⅓ of the presented by the 35ºC. CONCLUSION: It was concluded that the CuNiTi 35ºC archwires presented deactivation loadings biologically less favorable in relation to the other heat-activated NiTi archwires, associated to lower percentage of deformation, on the constant baselines of deactivation, showing less adequate mechanical behavior, under traction, in relation to the other archwires.

  4. Mechanical properties of NiTi and CuNiTi shape-memory wires used in orthodontic treatment. Part 1: stress-strain tests.

    Science.gov (United States)

    Gravina, Marco Abdo; Brunharo, Ione Helena Vieira Portella; Canavarro, Cristiane; Elias, Carlos Nelson; Quintão, Cátia Cardoso Abdo

    2013-01-01

    This research aimed to compare, through traction tests, eight types of superelastic and heat-activated NiTi archwires, by six trade companies (GAC, TP, Ormco, Masel, Morelli and Unitek) to those with addition of copper (CuNiTi 27°C and 35°C, Ormco). The tests were performed in an EMIC mechanical testing machine, model DL10000, capacity of 10 tons, at the Military Institute of Engineering (IME). The results showed that, generally, heat-activated NiTi archwires presented slighter deactivation loadings in relation to the superelastic ones. Among the archwires that presented deactivation loadings biologically more adequate are the heat-activated by GAC and by Unitek. Among the superelastic NiTi, the CuNiTi 27°C by Ormco were the ones that presented slighter deactivation loadings, being statistically (ANOVA) similar to the ones presented by the heat-activated NiTi archwires from Unitek. When compared the CuNiTi 27°C and 35°C archwires, it was observed that the 27°C presented deactivation forces of, nearly, ⅓ of the presented by the 35°C. It was concluded that the CuNiTi 35°C archwires presented deactivation loadings biologically less favorable in relation to the other heat-activated NiTi archwires, associated to lower percentage of deformation, on the constant baselines of deactivation, showing less adequate mechanical behavior under traction, in relation to the other archwires.

  5. Experimental model for architectural systematization and its basic thermal performance. Part 1. Research on architectural systematization of energy conversion devices; Kenchiku system ka model no gaiyo to kihon seino ni tsuite. 1. Energy henkan no kenchiku system ka ni kansuru kenkyu

    Energy Technology Data Exchange (ETDEWEB)

    Sunaga, N.; Ito, N.; Kimura, G.; Fukao, S.; Shimizu, T.; Tsunoda, M.; Muro, K. [Tokyo Metropolitan University, Tokyo (Japan)

    1996-10-27

    The outline of a model for architectural systematization of natural energy conversion and the experiment result on the basic thermal performance in winter are described. The model is about 20 m{sup 2} in floor space. Foam polystyrene of 100 mm and 200 mm thick was used for the outer wall as heat insulating materials. The model has a solar battery and air conditioner and uses red brick as a heat reservoir. An experiment was made on seven modes obtained when three elements (heating, heat storage, and night insulated door) are combined. The information obtained by the experiment showed that a model for architectural systematization has high heat insulation and tightness and can be used as an energy element or an evaluation model for architectural systematization. In this model for architectural systematization, the power consumption of an air conditioner in winter can be fully supplied by only the power generation based on a solar battery. In an architectural element, the heating energy consumption can be remarkably reduced and the indoor thermal environment can be greatly improved, by the combination of a heat reservoir and night heat insulated door. 1 ref., 6 figs., 3 tabs.

  6. Transparent nanostructured electrodes: Electrospun NiO nanofibers/NiO films

    Energy Technology Data Exchange (ETDEWEB)

    Lamastra, F.R. [Italian Interuniversity Consortium on Materials Science and Technology (INSTM), Research Unit Roma Tor Vergata, Via del Politecnico 1, 00133 Rome (Italy); Nanni, F. [Italian Interuniversity Consortium on Materials Science and Technology (INSTM), Research Unit Roma Tor Vergata, Via del Politecnico 1, 00133 Rome (Italy); Department of Enterprise Engineering, University of Rome Tor Vergata, Via del Politecnico 1, 00133 Rome (Italy); Menchini, F. [ENEA, CR Casaccia, Via Anguillarese 301, 00123 Rome (Italy); Nunziante, P. [Italian Interuniversity Consortium on Materials Science and Technology (INSTM), Research Unit Roma Tor Vergata, Via del Politecnico 1, 00133 Rome (Italy); Department of Chemical Sciences and Technologies, University of Rome Tor Vergata, Via della Ricerca Scientifica 1, 00133 Rome (Italy); Grilli, M.L., E-mail: marialuisa.grilli@enea.it [ENEA, CR Casaccia, Via Anguillarese 301, 00123 Rome (Italy)

    2016-02-29

    Polyvinylpyrrolidone (PVP)/nickel(II) acetate precursor fibers were deposited by electrospinning directly on radio frequency sputtered thin Ni and NiO films grown on quartz substrate, starting from Ni(II) acetate and PVP solution in ethanol. The samples were calcined in air in the temperature range 400–500 °C to obtain transparent and conductive p-type NiO nanofibers on NiO films. A higher density of nanofibers was obtained on Ni/quartz substrates, as compared to NiO/quartz ones, demonstrating the feasibility of fiber adhesion directly to an insulating substrate previously coated by a thin Ni layer. Samples were characterized by field emission-scanning electron microscopy, X-ray diffraction, spectrophotometric and resistance measurements. - Highlights: • Nanostructured electrodes: electrospun NiO nanofibers/NiO films were fabricated. • NiO fibers were directly grown on insulating substrate coated by thin Ni or NiO films. • Good quality crystalline fibers were obtained at low calcination temperatures. • Transparent and conductive p-type electrodes were fabricated.

  7. Ni-Based Solid Oxide Cell Electrodes

    DEFF Research Database (Denmark)

    Mogensen, Mogens Bjerg; Holtappels, Peter

    2013-01-01

    This paper is a critical review of the literature on nickel-based electrodes for application in solid oxide cells at temperature from 500 to 1000 _C. The applications may be fuel cells or electrolyser cells. The reviewed literature is that of experimental results on both model electrodes...... and practical composite cermet electrodes. A substantially longer three-phase boundary (TPB) can be obtained per unit area of cell in such a composite of nickel and electrolyte material, provided that two interwoven solid networks of the two solid and one gaseous phases are obtained to provide a three...... such as milling and sintering. The various electrode properties are deeply related to these parameters, but also much related to the atomic scale structure of the Ni-electrolyte interface, which in turn is affected by segregation of electrolyte components and impurities as well as poisons in the gas phase...

  8. Structure analysis of NiAl martensite

    Energy Technology Data Exchange (ETDEWEB)

    Noda, Y.; Shapiro, S.M.; Shirane, G.; Yamada, Y.; Fuchizaki, K.; Tanner, L.E.

    1989-01-01

    Neutron elastic scattering experiments were performed in order to investigate the structure of the low temperature martensitic phase of Ni/sub 62.5/Al/sub 37.5/ alloy. The average structure analyzed from the integrated intensity was approximately described by the (5,/minus/2) structure proposed by Martynov et al. Small deviation from the exact (5,/minus/2) model in the positional parameters and the anomalously large Debye-Waller factor were obtained. The observed satellite profiles show asymmetrical broadening, and the peak positions shift from the regular reciprocal lattice points. These anomalous features of scattering profiles were tentatively interpreted by introducing spatial modulation of the strain and order parameters. 12 refs., 2 figs., 1 tab.

  9. Structure analysis of NiAl martensite

    International Nuclear Information System (INIS)

    Noda, Y.; Shapiro, S.M.; Shirane, G.; Yamada, Y.; Fuchizaki, K.; Tanner, L.E.

    1989-01-01

    Neutron elastic scattering experiments were performed in order to investigate the structure of the low temperature martensitic phase of Ni 62.5 Al 37.5 alloy. The average structure analyzed from the integrated intensity was approximately described by the (5,-2) structure proposed by Martynov et al. Small deviation from the exact (5,-2) model in the positional parameters and the anomalously large Debye-Waller factor were obtained. The observed satellite profiles show asymmetrical broadening, and the peak positions shift from the regular reciprocal lattice points. These anomalous features of scattering profiles were tentatively interpreted by introducing spatial modulation of the strain and order parameters. 12 refs., 2 figs., 1 tab

  10. Interface stress in Au/Ni multilayers

    DEFF Research Database (Denmark)

    Schweitz, K.O.; Böttiger, J.; Chevallier, J.

    2000-01-01

    The effect of intermixing on the apparent interface stress is studied in -textured dc-magnetron sputtered Au/Ni multilayers by use of two methods commonly used for determining interface stress. The method using profilometry and in-plane x-ray diffraction does not take intermixing...... into account and yields an apparent interface stress of -8.46 +/- 0.99 J m(-2). However, observed discrepancies between model calculations and measured high-angle x-ray diffractograms indicate intermixing, and by use of the profilometry and sin(2) psi method the real interface stress value of -2.69 +/- 0.43 J...... m(-2) is found. This method also reveals a significant and systematic change of the stress-free lattice parameter of both constituents as a function of modulation period which is shown to account for the difference between the two findings. The method using in-plane diffraction is thus shown...

  11. Atomistic calculations of hydrogen interactions with Ni3Al grain boundaries and Ni/Ni3Al interfaces

    International Nuclear Information System (INIS)

    Baskes, M.I.; Angelo, J.E.; Moody, N.R.

    1995-01-01

    Embedded Atom Method (EAM) potentials have been developed for the Ni/Al/H system. The potentials have been fit to numerous properties of this system. For example, these potentials represent the structural and elastic properties of bulk Ni, Al, Ni 3 Al, and NiAl quite well. In addition the potentials describe the solution and migration behavior of hydrogen in both nickel and aluminum. A number of calculations using these potentials have been performed. It is found that hydrogen strongly prefers sites in Ni 3 Al that are surrounded by 6 Ni atoms. Calculations of the trapping of hydrogen to a number of grain boundaries in Ni 3 Al have been performed as a function of hydrogen chemical potential at room temperature. The failure of these bicrystals under tensile stress has been examined and will be compared to the failure of pure Ni 3 Al boundaries. Boundaries containing a preponderance of nickel are severely weakened by hydrogen. In order to investigate the potential embrittlement of γ/γ' alloys, trapping of hydrogen to a spherical Ni 3 Al precipate in nickel as a function of chemical potential at room temperature has been calculated. It appears that the boundary is not a strong trap for hydrogen, hence embrittlement in these alloys is not primarily due to interactions of hydrogen with the γ/γ interface

  12. Launch Load Resistant Spacecraft Mechanism Bearings Made From NiTi Superelastic Intermetallic Materials

    Science.gov (United States)

    DellaCorte, Christopher; Moore, Lewis (Chip) E., III

    2014-01-01

    Compared to conventional bearing materials (tool steel and ceramics), emerging Superelastic Intermetallic Materials (SIMs), such as 60NiTi, have significantly lower elastic modulus and enhanced strain capability. They are also immune to atmospheric corrosion (rusting). This offers the potential for increased resilience and superior ability to withstand static indentation load without damage. In this paper, the static load capacity of hardened 60NiTi 50mm bore ball-bearing races are measured to correlate existing flat-plate indentation load capacity data to an actual bearing geometry through the Hertz stress relations. The results confirmed the validity of using the Hertz stress relations to model 60NiTi contacts; 60NiTi exhibits a static stress capability (3.1GPa) between that of 440C (2.4GPa) and REX20 (3.8GPa) tool steel. When the reduced modulus and extended strain capability are taken into account, 60NiTi is shown to withstand higher loads than other bearing materials. To quantify this effect, a notional space mechanism, a 5kg mass reaction wheel, was modeled with respect to launch load capability when supported on 440C, 60NiTi and REX20 tool steel bearings. For this application, the use of REX20 bearings increased the static load capability of the mechanism by a factor of three while the use of 60NiTi bearings resulted in an order of magnitude improvement compared to the baseline 440C stainless steel bearings.

  13. Response of the tropical Pacific Ocean to El Niño versus global warming

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Fukai; Luo, Yiyong; Lu, Jian; Wan, Xiuquan

    2016-04-15

    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 (CESM) and applying an overriding technique to its ocean component, Parallel Ocean Program version 2 (POP2), 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) the maintaining mechanisms for the eastern equatorial Pacific warming are also substantially different.

  14. Effect of NiAl2O4 Formation on Ni/Al2O3 Stability during Dry Reforming of Methane

    KAUST Repository

    Zhou, Lu

    2015-07-16

    A series of alumina-supported Ni catalysts were prepared to examine their activity and carbon deposition during dry reforming of methane (DRM). With an increase in the final calcination temperature to T=900 °C to form exclusively NiAl2O4, a catalyst with strong metal–support interactions was obtained. During a long-term DRM reaction (of about t=100 h) at T=700 °C and with CH4/CO2=1:1, reduced Ni (from NiAl2O4) showed a high resistance to sintering and coking. The DRM kinetics behaviors of the catalysts calcined at different temperatures were also investigated. Carbon growth models were proposed to rationalize the different carbon morphologies observed on the catalysts.

  15. Microstructural investigations of Ni and Ni2Al3 coatings exposed in biomass power plants

    DEFF Research Database (Denmark)

    Wu, D. L.; Dahl, K. V.; Christiansen, T. L.

    2018-01-01

    temperature pack cementation. After exposure, microstructural investigations were performed by light optical and electron microscopy (SEM-EDS). Electroplated Ni coatings were not protective in straw firing power plants and exhibited similar corrosion morphology as uncoated tubes. For Ni2Al3 coatings......The present work investigates the corrosion resistance of Ni and Ni2Al3 coated austenitic stainless steel (TP347H) tubes, which were exposed in a biomass-fired boiler with an outlet steam temperature of 540 °C for 6757 h. The Ni2Al3 coating was produced by electroplating Ni followed by low......, the nickel aluminide layer was no longer adherent to the tube and was only found within the deposit. However, Ni2Al3 coatings had provided some protection compared to uncoated and Ni coated tubes. The formation of nickel chloride binds aggressive chlorine and slows down the active oxidation mechanism...

  16. Degree of simulated suppression of Atlantic tropical cyclones modulated by flavour of El Niño

    Science.gov (United States)

    Patricola, Christina M.; Chang, Ping; Saravanan, R.

    2016-02-01

    El Niño/Southern Oscillation, the dominant mode of interannual climate variability, strongly influences tropical cyclone activity. During canonical El Niño, the warm phase, Atlantic tropical cyclones are suppressed. However, the past decades have witnessed different El Niño characteristics, ranging from warming over the east Pacific cold tongue in canonical events to warming near the warm pool, known as warm pool El Niño or central Pacific El Niño. Global climate models project possible future increases in intensity of warm pool El Niño. Here we use a climate model at a resolution sufficient to explicitly simulate tropical cyclones to investigate how these flavours of El Niño may affect such cyclones. We show that Atlantic tropical cyclones are suppressed regardless of El Niño type. For the warmest 10% of each El Niño flavour, warm pool El Niño is substantially less effective at suppressing Atlantic tropical cyclones than cold tongue El Niño. However, for the same absolute warming intensity, the opposite is true. This is because less warming is required near the warm pool to satisfy the sea surface temperature threshold for deep convection, which leads to tropical cyclone suppression through vertical wind shear enhancements. We conclude that an understanding of future changes in not only location, but also intensity and frequency, of El Niño is important for forecasts and projections of Atlantic tropical cyclone activity.

  17. On estimation of stochastic forcing with application to El Niño

    Science.gov (United States)

    Penland, C.

    2014-12-01

    Although Linear Inverse Modeling (LIM) provides skillful forecasts of tropical ocean sea surface temperatures, LIM's diagnostic properties are at least as useful as its prognostic properties. In this presentation, we discuss an updated method for using LIM to obtain time series representing stochastic forcing of El Niño and to quantify particular unpredictable contributions to LIM forecast error. Attention is paid to the proper stochastic calculus and to the time scale separation between the stochastic forcing and El Niño's signal. The method yields seldom-considered sources of El Niño's stochastic forcing.

  18. Analisis Interferensi dalam Kelas Kata Keishiki Meishi Khususnya Penggunaan Tame Ni dan You Ni

    Directory of Open Access Journals (Sweden)

    Nalti Novianti

    2008-05-01

    Full Text Available Article aimed to find out the amount of interference in the translation using tame ni and you ni. The research used analysis description. Data were taken by giving a test to 20 student from the Japanese Department, Bina Nusantara University. The result showed that there is some interference in the exercises in the test given to the respondents. It is concluded that the interference occurs because many students do not understand the differences in using tame ni anda you ni.

  19. Formation enthalpy of NiBe and Ni5Be21

    International Nuclear Information System (INIS)

    Ivanov, M.I.; Karpova, T.F.; Dalago, N.Yu.

    1981-01-01

    The method of dissolution calorimetry is used to determine standard enthalpies of NiBe and Ni 5 Be 21 formation, which are 84.8+-2.2 and (-669+-37)kJ/mol. The enthalpy values of NiBe and Ni 5 Be 21 at 331 K are shown to coincide (within the limits of errors of these values) with the values at the standard temperature of 298.15 K [ru

  20. The Ni-Al-Hf Multiphase Diffusion

    Directory of Open Access Journals (Sweden)

    Romanowska J.

    2016-06-01

    Full Text Available The generalized Darken method was applied to simulate the diffusion between γ-Ni| γ’-Ni3Al and γ’-Ni3Al|β-NiAl interfaces. The results of calculations were compared with the experimental concentration’s profiles of nickel, aluminum and hafnium in aluminide and hafnium doped aluminide coatings deposited by the CVD and PVD methods on pure nickel. The method deals with the Wagner’s integral diffusion coefficients and thermodynamic data - activities of components. The experimental results agree with the simulated ones.

  1. Synthesis, spectroscopic characterization, molecular modeling and antimicrobial activities of Mn(II), Co(II), Ni(II), Cu(II) complexes containing the tetradentate aza Schiff base ligand

    Science.gov (United States)

    Chandra, Sulekh; Ruchi

    2013-02-01

    Mn(II), Co(II), Ni(II), and Cu(II) complexes with a tetradentate macrocyclic ligand [1.2.5.6tetraoxo-3,4,7,8tetraaza-(1,2,3,4,5,6,7,8)tetrabenzene(L)] were synthesized and characterized by elemental analysis, molar conductance measurements, mass, nmr, i.r., electronic and e.p.r. spectral studies. All the complexes are non electrolytes in nature and may be formulated as [M(L)X2] [where, M = Mn(II), Co(II), Ni(II), Cu(II) and X = Cl-, CH3COO-]. On the basis of i.r., electronic and e.p.r. spectral studies a distorted octahedral geometry has been assigned for all complexes. The antimicrobial activities and LD50 values of the ligand and its complexes, as growth inhibiting agents, have been screened in vitro against two different species of bacteria and plant pathogenic fungi.

  2. Ordered mesoporous silica to study the preparation of Ni/Si2 ex nitrate catalysts: impregnation, drying, and thermal treatments

    NARCIS (Netherlands)

    Sietsma, J.R.A.; Meeldijk, J.D.; Versluijs-Helder, M.; Broersma, A.; van Dillen, A.J.; de Jongh, P.E.; de Jong, K.P.

    2008-01-01

    In this contribution, we investigated the preparation of Ni/SiO2 catalysts with aqueous [Ni(OH2)6](NO3)2 solutions via the impregnation and drying method using ordered mesoporous silica SBA-15 (mesopore diameter of 9 nm) as model support to study each step in the preparation: impregnation, drying,

  3. Effects of Ni vacancy, Ni antisite, Cr and Pt on the third-order elastic constants and mechanical properties of NiAl

    KAUST Repository

    Wu, Shaohua

    2014-12-01

    Effects of Ni vacancy, Ni antisite in Al sublattice, Cr in Al sublattice, Pt in Ni sublattice on the second-order elastic constants (SOECs) and third-order elastic constants (TOECs) of the B2 NiAl have been investigated using the first-principles methods. Lattice constant and the SOECs of NiAl are in good agreement with the previous results. The brittle/ductile transition map based on Pugh ratio G/B and Cauchy pressure Pc shows that Ni antisite, Cr, Pt and pressure can improve the ductility of NiAl, respectively. Ni vacancy and lower pressure can enhance the Vickers hardness Hv of NiAl. The density of states (DOS) and the charge density difference are also used to analysis the effects of vacancy, Ni antisite, Cr and Pt on the mechanical properties of NiAl, and the results are in consistent with the transition map. © 2014 Elsevier Ltd. All rights reserved.

  4. Contexto Familiar: Diferencias Conductuales entre Niños y Niñas

    Directory of Open Access Journals (Sweden)

    María Aurelia Ramírez Castillo

    2005-01-01

    Full Text Available En este trabajo se investigan las diferencias por género en problemas de conducta. En una muestra de 200 sujetos (niños y niñas en tre 5 y 18 años de Granada (España, los resultados concluyen que los niños tienen más problemas de conducta delictiva que las niñas. Cuando existen conflictos matrimoniales y prácticas de crianza negativas, de nuevo los niños tienen más problemas externos que las niñas. En este trabajo se investigan las diferencias por género en problemas de conducta. En una muestra de 200 sujetos (niños y niñas en tre 5 y 18 años de Granada (España, los resultados concluyen que los niños tienen más problemas de conducta delictiva que las niñas. Cuando existen conflictos matrimoniales y prácticas de crianza negativas, de nuevo los niños tienen más problemas externos que las niñas.

  5. Porous NiTi shape memory alloys produced by SHS: microstructure and biocompatibility in comparison with Ti2Ni and TiNi3.

    Science.gov (United States)

    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.

  6. Dynamic recovery in nanocrystalline Ni

    International Nuclear Information System (INIS)

    Sun, Z.; Van Petegem, S.; Cervellino, A.; Durst, K.; Blum, W.; Van Swygenhoven, H.

    2015-01-01

    The constant flow stress reached during uniaxial deformation of electrodeposited nanocrystalline Ni reflects a quasi-stationary balance between dislocation slip and grain boundary (GB) accommodation mechanisms. Stress reduction tests allow to suppress dislocation slip and bring recovery mechanisms into the foreground. When combined with in situ X-ray diffraction it can be shown that grain boundary recovery mechanisms play an important role in producing plastic strain while hardening the microstructure. This result has a significant consequence for the parameters of thermally activated glide of dislocations, such as athermal stress and activation volume, which are traditionally derived from stress/strain rate change tests

  7. Low temperature interdiffusion in Cu/Ni thin films

    International Nuclear Information System (INIS)

    Lefakis, H.; Cain, J.F.; Ho, P.S.

    1983-01-01

    Interdiffusion in Cu/Ni thin films was studied by means of Auger electron spectroscopy in conjunction with Ar + ion sputter profiling. The experimental conditions used aimed at simulating those of typical chip-packaging fabrication processes. The Cu/Ni couple (from 10 μm to 60 nm thick) was produced by sequential vapor deposition on fused-silica substrates at 360, 280 and 25 0 C in 10 - 6 Torr vacuum. Diffusion anneals were performed between 280 and 405 0 C for times up to 20 min. Such conditions define grain boundary diffusion in the regimes of B- and C-type kinetics. The data were analyzed according to the Whipple-Suzuoka model. Some deviations from the assumptions of this model, as occurred in the present study, are discussed but cannot fully account for the typical data scatter. The grain boundary diffusion coefficients were determined allowing calculation of respective permeation distances. (Auth.)

  8. Morphological control of Ni/NiO core/shell nanoparticles and production of hollow NiO nanostructures

    International Nuclear Information System (INIS)

    Chopra, Nitin; Claypoole, Leslie; Bachas, Leonidas G.

    2010-01-01

    Chemical synthesis coupled with a microwave irradiation process allowed for the control of size (6-40 nm), shape, and shell thickness of Ni/NiO core/shell nanoparticles. In this unique synthetic route, the size of Ni nanoparticles (NiNPs) was strongly influenced by the nickel salt-to-stabilizer ratio and the amount of the stabilizer. Interestingly, it was observed that the shape of the nanoparticles was altered by varying the reaction time, where longer reaction times resulted in annealing effects and rupture of the stabilizer micelle leading to distinct shapes of Ni/NiO core/shell nanostructures. Product cooling rate was another important parameter identified in this study that not only affected the shape, but also the crystal structure of the core/shell nanoparticles. In addition, a simple and cost-effective method of microwave irradiation of NiNPs led to the formation of distinctly shaped hollow NiO nanoparticles. These high surface area core/shell nanoparticles with well-controlled morphologies are important and can lead to significant advancement in the design of improved fuel cells, electrochromic display devices, and catalysis systems.

  9. .';.:NI~

    African Journals Online (AJOL)

    He mentions, inter alia, the share he had in the passing of Defence Act no 44 of 1957 and expresses his gratitude to God for saving his life and allowing him to ...... gevolg dat vier van ons seniors, brigadiers rang behou het. Een offisier, wat betreklik junior was voor die oorlog, is ook brigadiersrang toegeken, sodat hy in een ...

  10. Effects of strong cathodic polarization of the Ni-YSZ interface

    DEFF Research Database (Denmark)

    Hansen, Karin Vels; Chen, Ming; Jacobsen, Torben

    2016-01-01

    Long-term strong cathodic polarization experiments of down to -2.4 V vs. E°(O2) of the Ni-YSZ interface were performed at 900°C in 97% H2/3% H2O on model electrodes. The Ni-YSZ interface underwent extensive changes and a large affected volume with a complex microstructure and phase distribution r...

  11. Magnetism in Ni2FeVO6-δ

    International Nuclear Information System (INIS)

    Kolpakowa, L.; Pietrzak, J.; Latosinska, J.N.; Pawlicki, P.

    1995-01-01

    The temperature dependence of magnetization M(T) of new polycrystalline ilmenite Ni 2 FeVO 6-δ shows remarkable singularities which can be interpreted as a result of coexistence of three magnetic phases in its magnetic structure. A fit of the dependences following four different models, each of which a combination of three functions of chosen type, to the M(T) experimental dependence has been made. ((orig.))

  12. NiTi-polyimide composites prepared using thermal imidization process

    Czech Academy of Sciences Publication Activity Database

    Vokoun, David; Sysel, P.; Heller, Luděk; Kadeřávek, L.; Svatuška, Michal; Goryczka, T.; Kafka, Vratislav; Šittner, Petr

    2016-01-01

    Roč. 25, č. 5 (2016), 1993-1999 ISSN 1059-9495 R&D Projects: GA ČR GC15-13174J; GA ČR GA14-15264S Institutional support: RVO:68378271 ; RVO:68378297 Keywords : actuator * composite * model * NiTi * polyimide * residual * stress Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.331, year: 2016

  13. Soft mode and magnetic phase transition in PrNi

    International Nuclear Information System (INIS)

    Alekseev, P.A.; Lazukov, V.N.; Sadikov, I.P.; Klement'ev, E.S.; Allenspach, P.; Chumlyakov, Yu.I.

    2002-01-01

    The spectrum of the magnetic excitation of the PrNi intermetallic compound monocrystal is studied through the neutrons inelastic scattering. Essential softening of certain collective modes of the magnetic excitation near the temperature of the ferromagnetic ordering T c ∼ 20 K is identified. The above result is analyzed from the viewpoint of the model, describing the magnetic phase transition in the systems with the directed magnetic moment [ru

  14. The study of quasi-projectiles produced in Ni+Ni and Ni+Au collisions: excitation energy and spin; Etude des quasi-projectiles produits dans les collisions Ni+Ni et Ni+Au: energie d'excitation et spin

    Energy Technology Data Exchange (ETDEWEB)

    Buta, A

    2003-02-01

    During the collision between the projectile and the target nuclei in the intermediate energy regime (E < 100 MeV/nucleon) two excited nuclei are mainly observed in the exit channel, the quasi projectile (QP) and the quasi target. They disintegrate by particle emission. However, this binary picture is perturbed by the emission of particles and light fragments with velocities intermediate between the projectile velocity and the target one, all along the interaction (midrapidity component). This work aim to determine the excitation energy and the intrinsic angular momentum (or spin) of quasi-projectiles produced in the Ni+Ni and Ni+Au collisions at 52 and 90 MeV/nucleon. The excitation energy is deduced from the kinematical characteristics of particles emitted by the quasi-projectile. They have to be separated from midrapidity particles. Three different scenarios have been used for this purpose. The spin of the quasi-projectile has been extracted from the experimental data by mean of proton and alpha particles multiplicities emitted by the QP in the Ni+Au at 52 MeV/nucleon reaction. The results have been compared to the predictions of a theoretical model based on nucleon transfers. Their evolution is qualitatively reproduced as a function of the violence of the collision. (author)

  15. Interfaces in La2NiO4- La2CuO4 superlattices

    Science.gov (United States)

    Smadici, S.; Lee, J. C. T.; Wang, S.; Abbamonte, P.; Logvenov, G.; Gozar, A.; Bozovic, I.

    2009-03-01

    Ni substitution on Cu sites in underdoped La2-xSrxCuO4 quickly restores Neel order. This was attributed to strong interaction between the Ni and doped holes. An open question was whether the additional Ni empty orbital or the different spin on Ni sites was at the origin of this strong interaction. We have addressed this problem with resonant soft x-ray scattering on a La2NiO4- La2CuO4 heterostructure. La2NiO4 and La2CuO4 have close lattice structures and electronic configurations. However, the x-ray scattering contrast between superlattice layers is greatly enhanced at soft x-ray resonant energies. Based on our measurements at the O K, La M, Cu L and Ni L edges a model of the charge, orbital and spin structures in these superlattices will be presented with a special emphasis on the interface region. This work was supported by Grants. DE-FG02- 06ER46285, DE-AC02-98CH10886, MA-509-MACA, DE-FG02-07ER46453 and DE-FG02-07ER46471.

  16. A novel Ni/ceria-based anode for metal-supported solid oxide fuel cells

    Science.gov (United States)

    Rojek-Wöckner, Veronika A.; Opitz, Alexander K.; Brandner, Marco; Mathé, Jörg; Bram, Martin

    2016-10-01

    For optimization of ageing behavior, electrochemical performance, and sulfur tolerance of metal-supported solid oxide fuel cells a new anode concept is introduced, which is based on a Ni/GDC cermet replacing the established Ni/YSZ anodes. In the present work optimized processing parameters compatible with MSC substrates are specified by doing sintering studies on pressed bulk specimen and on real porous anode structures. The electrochemical performance of the Ni/GDC anodes was characterized by means of symmetrical electrolyte supported model-type cells. In this study, three main objectives are pursued. Firstly, the effective technical realization of the Ni/GDC concept is demonstrated. Secondly, the electrochemical behavior of Ni/GDC porous anodes is characterized by impedance spectroscopy and compared with the current standard Ni/YSZ anode. Further, a qualitative comparison of the sulfur poisoning behavior of both anode types is presented. Thirdly, preliminary results of a successful implementation of the Ni/GDC cermet into a metal-supported single cell are presented.

  17. Physical model experiment for wave field measurements by means of laser Doppler vibrometer. Measurement of three components; Laser Doppler shindokei ni yoru butsuri model jikken. Hado sanseibun no kenshutsu

    Energy Technology Data Exchange (ETDEWEB)

    Nishizawa, O.; Sato, T. [Geological Survey of Japan, Tsukuba (Japan); Lei, X. [DIA Consultant Co. Ltd., Tokyo (Japan)

    1997-05-27

    In this experiment, a beam incident from an oblique direction is reflected by a spherical lens toward the direction of incidence. When the surface of a matter is vibrated by elastic waves, the spherical lens comes into a translation motion that accompanies the vibration. It follows accordingly that the vibration on the surface of the matter may be detected by sensing the spherical lens travelling speed. Three components of the vibration may be determined if beams are focused at one spot from three directions. Detection of the S-wave component by LDV (laser Doppler vibrometer) discloses the complicated wave field in a heterogeneous material, and this physical model experiment may be utilized in various fields of study. For instance, information about problems that may surface in the field work may be collected beforehand in a physical model experiment for developing an S-wave-aided probing method. For the study of seismic wave propagation in a complicated three-dimensional ground structure, a numerical model is not enough, and a physical model experiment will be an effective method to fulfill the purpose. In the monitoring of cracks in a rock, again, not only elastic wave velocity but also waveform information collected from a physical model experiment should be fully utilized. 6 refs., 6 figs.

  18. Geotechnical environmental inhomogeneity monitoring by visualization of surface and subsurface electrode array resistivity data. Investigation by simple predictable models in earth resources information system engineering; Chihyo oyobi chichu denkyoku riyohi teiko data ni yoru jiban fukinshitsu kankyo no chika joho kashika monitoring. Shigen joho system kogaku ni okeru tanjunna model no sotei to sono yosoku

    Energy Technology Data Exchange (ETDEWEB)

    Sugano, T.; Ogawa, J.; Moriyama, D.; Kishi, W.

    1998-02-10

    Data of potentials and resistivity obtained by surficial and underground electrodes are utilized for the study of underground information visualization. Current sources are given by dots, to be analyzed by the use of an finite element method 2D-3D algorithm. Resistivity is analyzed as a 2D structure, with the analysis model x-axis made to squarely cross the run of underground structure and the z-axis designated to be positive in the downward direction. In a 3D Poisson equation, Fourier transformation and 2D Helmholtz equation are solved relative to the y axis (structure run direction). The boundary conditions of the x and z are considered for a solution in the domain of investigation, and the use of inverse Fourier transformation determines the potentials distribution in the 3D space. When apparent resistivity due to actual electrode arrangement is calculated based on this potentials distribution and is reverse-analyzed, the underground resistivity distribution may be picturized. To put this technique to practical use, studies are conducted of the assumption of a simple model and prediction accuracy, basics of resistivity data analysis, and fundamental problems in the effective use of resistivity data utilizing the surficial and underground electrodes. A conclusion is reached as to what direction the basic policy should face. 20 refs., 16 figs., 1 tab.

  19. Study of thermal threshold and counter-measures for human body in oceanic working environment. 1st Report. Heat balance model and heat storage index; Shonetsu kankyoka no kaiyo sagyo ni okeru netsuteki genkai to onnetsu taisaku ni kansuru kenkyu. 1. Netsu shushi model to onnetsu shisu

    Energy Technology Data Exchange (ETDEWEB)

    Fukuchi, N. [Kyushu University, Fukuoka (Japan). Faculty of Engineering; Nakamura, M. [Tokyo Gakugei University, Tokyo (Japan); Murayama, M.

    1996-12-31

    Identification was intended on effects of such thermal factors as metabolic amount, environmental temperature and humidity, and clothing resistance on human body temperatures during works under hot environments. Therefore, measurements were carried out on human skin temperatures, rectum temperatures and humidity inside clothing, while amount of motion, environmental temperature, and clothing are changed in a constant temperature room and under a sun irradiation environment. Furthermore, a heat balance model was prepared, which divides the objects into an outer shell layer whose temperature changes depending on the result of this experiment and into a core having constant temperature characteristics. An equation to derive skin temperatures was introduced from the model. The equation formulated a calculation formula for heat accumulation in human body, which can be used as a hot heat index. Relationship between thermal factors and heat storage amount was investigated to consider a thermal limit for a physical work. An equation to derive skin temperatures was confirmed capable of expressing general change in skin temperatures, being proved by comparison with experiments. Calculation formulas for amount of heat stored in human body were shown capable of expressing influence of different thermal factors, the expression being useful as a hot heat index. Calculating the human body heat storage is very largely affected by effect of sweat to dissipate heat, hence it is necessary to improve the accuracy including that for body temperature adjusting reactions. 17 refs., 17 figs., 5 tabs.

  20. Local melting/solidification during peritectic solidification in a steep temperature gradient: analysis of a directionally solidified Al-25at%Ni

    Science.gov (United States)

    Liu, Dongmei; Li, Xinzhong; Su, Yanqing; Rettenmayr, Markus; Guo, Jingjie; Fu, Hengzhi

    2014-09-01

    Melting of primary Al3Ni2 phase and solidification of Al3Ni peritectic phase during directional solidification of an Al-25at%Ni peritectic alloy have been investigated. In a steep temperature gradient of up to 50 K/mm and at a pulling rate of 20 μm/s, an incomplete coverage of peritectic Al3Ni phase on the surface of the primary Al3Ni2 phase has been observed. Below the peritectic temperature in the presence of the incomplete coverage, melting of primary Al3Ni2 on the one side and solidification to the Al3Ni peritectic phase on the other side proceed swiftly via diffusion through the interphase liquid layer. Theoretical calculations based on an incomplete-coverage-related melting/solidification model are in close agreement with the experimental measurements.

  1. Characterising excited states in and around the semi-magic nucleus $^{68}$ Ni using Coulomb excitation and one-neutron transfer

    CERN Multimedia

    It is proposed to investigate the structure of excited states in $^{68, 70}$Ni(Z =28, N=40, 42) via the measurement of electromagnetic matrix elements in a Coulomb excitation experiment in order to study the N = 40 harmonic-oscillator shell and the Z = 28 proton shell closures. The measured B(E2) values connecting low-lying 0$^{+}$ and 2$^{+}$ can be compared to shell-model predictions. It is also proposed to perform the one-neutron transfer reaction ${d}$($^{68}$Ni,$^{69}$Ni)${p}$, with the aim of populating excited states in $^{69}$Ni. Comparisons with the states populated in the recently performed ${d}$($^{66}$Ni,$^{67}$Ni)${p}$ reaction will be useful in determining the role of the neutron $d_{5/2}$ orbital in the semi-magic properties of $^{68}$Ni.

  2. Estilos de vida saludables de niños, niñas y adolescentes

    OpenAIRE

    Lilia Campo-Ternera; Yaneth Herazo-Beltrán; Floralinda García-Puello; Mariela Suarez-Villa; Orlando Méndez; Francisco Vásquez-De la Hoz

    2017-01-01

    Objetivo: Describir los estilos de vida saludables de niños, niñas y adolescentes de Barranquilla. Materiales y métodos: Estudio descriptivo de corte transversal en 991 niños, niñas y ado - lescentes. Se evaluó la actividad física mediante los cuestionarios de Actividad Física para Adolescentes y para niños escolares; se aplicó una encuesta que midió los conocimientos y prácticas de los escolares sobre salud bucal, lavado de manos, consumo de frutas y verduras y ...

  3. Investigation of microstructural evolution and electrical properties for Ni-Sn transient liquid-phase sintering bonding

    Science.gov (United States)

    Feng, Hong-Liang; Huang, Ji-Hua; Yang, Jian; Zhou, Shao-Kun; Zhang, Rong; Wang, Yue; Chen, Shu-Hai

    2017-11-01

    Ni/Ni-Sn/Ni sandwiched simulated package structures were successfully bonded under low temperature and low pressure by Ni-Sn transient liquid-phase sintering bonding. The results show that, after isothermally holding for 240 min at 300 °C and 180 min at 340 °C, Sn was completely transformed into Ni3Sn4 intermetallic compounds. When the Ni3Sn4 phases around Ni particles were pressed together, the porosity of the bonding layer increased, which obviously differed from the normal sintering densification process. With further analysis of this phenomenon, it was found that large volume shrinkage (14.94% at 340 °C) occurred when Ni reacted with Sn to form Ni3Sn4, which caused void formation. A mechanistic model of the microstructural evolution in the bonding layer was proposed. Meanwhile, the resistivity of the bonding layer was measured and analyzed by using the four-probe method; the microstructural evolution was well reflected by the resistivity of the bonding layer. The relationship between the resistivity and microstructure was also discussed in detail.[Figure not available: see fulltext.

  4. DFT investigation of Ni(II) adsorption onto MA-DTPA/PVDF chelating membrane in the presence of coexistent cations and organic acids.

    Science.gov (United States)

    Song, Laizhou; Zhao, Xiaodan; Fu, Jie; Wang, Xiuli; Sheng, Yiping; Liu, Xiaowei

    2012-01-15

    Melamine-diethylenetriaminepentaacetic acid/polyvinylidene fluoride (MA-DTPA/PVDF) chelating membrane bearing polyaminecarboxylate groups was used to remove Ni(II) from nickel plating effluents. Adsorption experiments were conducted to study the adsorption of the membrane towards Ni(II) in Ni(II)-Ca(II), Ni(II)-NH(4)(+), Ni(II)-Fe(III) binary systems, and Ni(II)-lactic acid, Ni(II)-succinic acid and Ni(II)-citric acid complex systems. For the ternary nickel plating processes, the effects of 3d transition metals including Fe(II), Co(II), Cu(II) and Zn(II) on Ni(II) adsorption were evaluated. The influences of the aforementioned coexistent cations and organic acids were elucidated by the continuum solvation model (COSMO)-corrected density functional theory (DFT) method. Geometries and complexation energies were analyzed for metal-MA-DTPA and Ni(II)-organic acid complexes. DFT results accord with the experimental data, indicating that DFT is helpful to evaluate the complexation between the membrane and metal cations. The coexistent Ca(II) tends to form more stable complex with MA-DTPA ligand than NH(4)(+) and Fe(III), and can interfere with the formation of Ni(II)-MA-DTPA complex. The complexing sequence of 3d metals with MA-DTPA ligand is Zn(II)Ni(II)Ni(II). The stabilities of Ni(II)-organic acid complexes follow the order of lactic acidNi(II)-MA-DTPA complex. Copyright © 2011 Elsevier B.V. All rights reserved.

  5. Creatividad en niños superdotados

    OpenAIRE

    González Román, María del Pilar

    1992-01-01

    Se ha realizado un estudio sobre la creatividad en los niños superdotados. Analizándose los diferentes modelos de creatividad y superdotacion avalados por un estudio empírico, en el cual se han valorado las diferencial que existen entre los niños superdotados y contraste a nivel verbal y grafico-espacial.

  6. Who is El Niño?

    Science.gov (United States)

    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.”

  7. Density functional modelling of the interaction between the uranyl ion and TiO{sub 2} and NiFe{sub 2}O{sub 4} surfaces; Simulation par la theorie de la fonctionnelle de la densite de l'interaction de l'ion uranyle avec les surfaces de TiO{sub 2} et de NiFe{sub 2}O{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Perron, H

    2007-07-15

    This study, performed within the framework of a collaboration between the IPN in Orsay and EDF, takes place within the problematic of radioactivity control in geological depository or in nuclear power plants. The interaction mechanisms of ions at solid / liquid interfaces are often very complex and thus very hard to characterize. The use of atomic modelling, and more particularly of ab initio type calculations such as the density functional theory, allow to access to surface complexes structural and energetic properties. First, this theoretical approach has been validated on the experimentally uranyl / rutile TiO{sub 2} well-known system. The systematic comparisons between experimental data and theoretical results have allowed to demonstrate the ability of this approach to properly describe this complex system. Then, a similar study has been performed as a predictive tool on the uranyl / NiFe{sub 2}O{sub 4} system which is not characterized experimentally. The goal of these studies was to determine if theoretical calculations are able to bring usable and reliable data when the experimental studies are too hard to set up. (author)

  8. An Update on Improvements to NiCE Support for RELAP-7

    Energy Technology Data Exchange (ETDEWEB)

    McCaskey, Alex [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Wojtowicz, Anna [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Deyton, Jordan H. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Patterson, Taylor C. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Billings, Jay Jay [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

    2015-01-01

    The Multiphysics Object-Oriented Simulation Environment (MOOSE) is a framework that facilitates the development of applications that rely on finite-element analysis to solve a coupled, nonlinear system of partial differential equations. RELAP-7 represents an update to the venerable RELAP-5 simulator that is built upon this framework and attempts to model the balance-of-plant concerns in a full nuclear plant. This report details the continued support and integration of RELAP-7 and the NEAMS Integrated Computational Environment (NiCE). RELAP-7 is fully supported by the NiCE due to on-going work to tightly integrate NiCE with the MOOSE framework, and subsequently the applications built upon it. NiCE development throughout the first quarter of FY15 has focused on improvements, bug fixes, and feature additions to existing MOOSE-based application support. Specifically, this report will focus on improvements to the NiCE MOOSE Model Builder, the MOOSE application job launcher, and the 3D Nuclear Plant Viewer. This report also includes a comprehensive tutorial that guides RELAP-7 users through the basic NiCE workflow: from input generation and 3D Plant modeling, to massively parallel job launch and post-simulation data visualization.

  9. Excitation function of alpha-particle-induced reactions on {sup nat}Ni from threshold to 44 MeV

    Energy Technology Data Exchange (ETDEWEB)

    Uddin, M.S. [Atomic Energy Research Establishment, Tandem Accelerator Facilities, Institute of Nuclear Science and Technology, Savar, Dhaka (Bangladesh); Kim, K.S.; Nadeem, M.; Kim, G.N. [Kyungpook National University, Department of Physics, Buk-gu, Daegu (Korea, Republic of); Sudar, S. [Debrecen University, Institute of Experimental Physics, Debrecen (Hungary)

    2017-05-15

    Excitation functions of the {sup nat}Ni(α,x){sup 62,63,65}Zn, {sup nat}Ni(α,x){sup 56,57}Ni and {sup nat}Ni(α,x){sup 56,57,58m+g}Co reactions were measured from the respective thresholds to 44MeV using the stacked-foil activation technique. The tests for the beam characterization are described. The radioactivity was measured using HPGe γ-ray detectors. Theoretical calculations on α-particles-induced reactions on {sup nat}Ni were performed using the nuclear model code TALYS-1.8. A few results are new, the others strengthen the database. Our experimental data were compared with results of nuclear model calculations and described the reaction mechanism. (orig.)

  10. Development of the EM tomography system. Part 2. Sensitivity studies of anomalous body by model studies; EM tomography system no kaihatsu. 2. Model kaiseki ni yoru ijotai no kando chosa kekka

    Energy Technology Data Exchange (ETDEWEB)

    Kumekawa, Y.; Miura, Y.; Takasugi, S. [GERD Geothermal Energy Research and Development Co. Ltd., Tokyo (Japan); Arai, E. [Metal Mining Agency of Japan, Tokyo (Japan)

    1997-05-27

    A model analysis was used to investigate sensitivity of a two-dimensional structure on a resistivity anomalous body by using an electromagnetic tomography system. The resistivity model handled a three-dimensional structure. The model was prepared as a pseudo two-dimensional model in which a low resistivity anomalous body with 1 ohm-m was incorporated that has a basic length of 1000 m in the Y-direction in a homogenous medium having 100 ohm-m. As a result of the analysis, the following matters were elucidated: if a low resistivity anomalous body is present in a shallow subsurface, its impact starts appearing from lower frequencies than when the anomalous body exists only at a greater depth; if a high resistivity anomalous body exists, the detection sensitivity is lower than for the low resistivity anomalous body, but the analysis would be possible by using the phase because the phase has made a greater change; the source TxZ shows a change from lower frequencies than for the source TxX, and the amount of change is greater, hence the detection sensitivity on an anomalous body may be said higher with the source TxZ; however, for the anomalous body in shallow subsurface, the source TxX is more effective since it is not subjected to a too great impact at a greater depth. 5 refs., 7 figs.

  11. How Climate Change Affected US Impacts of the 2015-16 El Niño

    Science.gov (United States)

    Hoerling, M. P.; Quan, X. W.

    2016-12-01

    The unusually dry America Southwest winter of 2015-16 is examined in the context of El Niño driving, global ocean forcing, and human-induced climate change. The El Niño event was among the strongest of the last century, as measured by NINO3.4 sea surface temperatures (SSTs). Seasonal forecasts, guided partly by historical effects of the strong 1982-83 and 1997-98 El Niños, called for abundant rains in southern California and the America Southwest. These were seen as likely, though not certain. Yet, November-April 2016 precipitation over southern California, Arizona, and western New Mexico ranked in the lower tercile of historical data, and the prevailing multiyear drought instead intensified. We present a causal storyline for winter precipitation over the America Southwest. We first diagnose if the particular "face" of the 2015-16 El Niño caused the unexpected dryness over the America Southwest. While NINO3.4 anomalies were similar among the three El Niños, the 2015-16 event had stronger warmth over the central equatorial Pacific and less warmth in the far east Pacific. However, atmospheric models forced by central to east tropical Pacific SSTs alone reveal that such distinctions among the three strongest El Niños were of little consequence for America Southwest rainfall, each driving very wet conditions. We next diagnose impacts of global SSTs on America Southwest precipitation. Whereas little difference is found for either the 1982-83 or 1997-98 simulated impacts compared to their east Pacific forcing experiments, a much weaker wet signal occurs in 2015-16 simulations. The latter was immersed in the warmest global ocean in the instrumental record, and the unusually high SSTs of the tropical warm pools were especially important in weakening El Niño's impact on the America Southwest. To isolate effects of El Niño co-acting with climate change, historical coupled model simulations are used to construct analogues for strong El Niños at various time slices of

  12. Critical behavior of Y2NiMnO6 double perovskite

    Science.gov (United States)

    Nhalil, Hariharan; Nair, Harikrishnan S.; Elizabeth, Suja

    2016-05-01

    Critical behavior of double perovskite Y2NiMnO6 near the second-order ferromagnetic transition is studied. Scaling exponents calculated frommodified Arrot plots are confirmed by Kouvel-Fisher method and satisfy the Widom's scaling relation. The exponents do not follow any conventional theoretical models.β values areconsistent with 3D-Ising model whileδconformsto TCMF and γ valueclosely relates to the 3D-Heisenberg model. Critical exponents are compared with similar R2NiMnO6 double perovskites which shows that a decrease in size of R ion changes exponents from mean-field to the 3D-Ising model.

  13. Understanding the double peaked El Niño in coupled GCMs

    Science.gov (United States)

    Graham, Felicity S.; Wittenberg, Andrew T.; Brown, Jaclyn N.; Marsland, Simon J.; Holbrook, Neil J.

    2017-03-01

    Coupled general circulation models (CGCMs) simulate a diverse range of El Niño-Southern Oscillation behaviors. "Double peaked" El Niño events—where two separate centers of positive sea surface temperature (SST) anomalies evolve concurrently in the eastern and western equatorial Pacific—have been evidenced in Coupled Model Intercomparison Project version 5 CGCMs and are without precedent in observations. The characteristic CGCM double peaked El Niño may be mistaken for a central Pacific warming event in El Niño composites, shifted westwards due to the cold tongue bias. In results from the Australian Community Climate and Earth System Simulator coupled model, we find that the western Pacific warm peak of the double peaked El Niño event emerges due to an excessive westward extension of the climatological cold tongue, displacing the region of strong zonal SST gradients towards the west Pacific. A coincident westward shift in the zonal current anomalies reinforces the western peak in SST anomalies, leading to a zonal separation between the warming effect of zonal advection (in the west Pacific) and that of vertical advection (in the east Pacific). Meridional advection and net surface heat fluxes further drive growth of the western Pacific warm peak. Our results demonstrate that understanding historical CGCM El Niño behaviors is a necessary precursor to interpreting projections of future CGCM El Niño behaviors, such as changes in the frequency of eastern Pacific El Niño events, under global warming scenarios.

  14. Novel Assessment of Photorecombination of Ni XI Ions

    Science.gov (United States)

    Gorczyca, Tom; Nikolic, D.; Badnell, N. R.; Savin, D. W.

    2008-05-01

    Standard methods for determining temperatures and densities of high-temperature astrophysical plasmas involve the modeling of the optically thin far-UV and X-ray emission lines of multiply charged atomic ions. Their presence in relatively low concentration can strongly influence the energy and ionization balance evaluations that require detailed knowledge of many elementary radiative and collisional processes, such as dielectronic recombination (DR). DR is the dominant electron-ion recombination mechanism in cosmic plasmas, and to complement existing experimental/theoretical data we have undertaken new, methodical, state-of-the-art calculations of DR rate coefficients (Badnell et. al. A&A 2003) using AUTOSTRUCTURE, a comprehensive suite of atomic structure and collision codes. A significant portion of our efforts is directed at providing reliable DR data for argon-like ions, mainly through various in-depth investigations, and we will present the latest results for Ni XI. Recent astrophysical interests in Ni XI ions range from SXR spectra analysis of the bright nearby F-type star Procyon (Raassen et. al. A&A 2002) or Alpha Centauri's corona by Chandra-LETGS (Raassen et. al. A&A. 2003), to improved modeling of the Sun's EUV irradiance, to derivation of element abundances using a set of F-K dwarfs sampled from the young open cluster IC 4665 (Shen et. al. ApJ 2005). Computations of atomic data for Ni XI, as a potentially valuable diagnostic tool, are scarce in the literature and our multi-configuration Breit-Pauli calculations represent a significant improvement over outdated DR data. Maxwellian DR rate coefficients for Ni XI, resolved into 3-3 and 3-4 core-excitations and covering typical photoionized and electron-collisional plasma temperature ranges, will be presented in a convenient functional form for ease of implementation into plasma modeling codes. This work was funded in part by NASA (APRA), NASA (SHP) SR&T and UK PPARC grants.

  15. Torsional superelasticity of NiTi archwires.

    Science.gov (United States)

    Bolender, Yves; Vernière, Anne; Rapin, Christophe; Filleul, Marie-Pierryle

    2010-11-01

    To reproduce and compare the intraoral torsional behavior of 10 commonly used preformed upper NiTi 0.017 x 0.025 archwires in 0.018-slot brackets at 20 degrees C, 35 degrees C, and 55 degrees C. Ten upper preformed NiTi archwires were compared to a multibraided stainless steel wire. An original testing bench was used to reproduce palatal root torque applied onto an upper central incisor with a maximum value of 1540 g x mm. Ten samples of each wire type were tested at 20 degrees C, 35 degrees C, and 55 degrees C each. Loading and unloading at 20 degrees C revealed three categories of wires: a group of four NiTi wires of relative stiffness bereft of any superelasticity, a group of six NiTi wires displaying some horizontal plateau, and finally the stainless steel wire of lesser stiffness. Testing at the average oral temperature of 35 degrees C produced the same three categories of wires, with only 2 of 10 NiTi wires displaying a superelastic effect (Copper NiTi 35 degrees C and 40 degrees C). None of the NiTi wires was superelastic at 55 degrees C. Moments increased with temperature as the martensite was replaced by the more rigid austenite. This study showed that most NiTi wires did not exhibit in torsion the superelastic effect traditionally described in bending. The combination of straight-wire prescriptions and rectangular superelastic NiTi archwires did not provide optimal constant moments necessary to gain third-order control of tooth movement early in treatment. A braided stainless steel rectangular archwire displayed better torsional behavior at 35 degrees C than most NiTi archwires of the same dimensions.

  16. Influence of annealing temperature on the microstructure and magnetic properties of Ni/NiO core-shell nanowires

    Science.gov (United States)

    Xiang, Wenfeng; Liu, Yuan; Yao, Jiangfeng; Sun, Rui

    2018-03-01

    Ni/NiO core-shell nanowires (NWs) were synthesized by thermal annealing of Ni NWs and variations in the microstructure, surface morphology, and magnetic properties of the NWs as a function of annealing temperature were investigated. The results showed that the grain size and crystal quality of NiO increased with an increasing annealing temperature. Specially, the effect of annealing temperature was much greater than annealing time for the formation of Ni/NiO NWs during the oxidization process. The total weight gain of the Ni/NiO NWs continuously increased when the annealing temperature was lower than 400 °C and the annealing time was more than 2 h; however, the weight gain of the Ni/NiO NWs was almost constant after annealing for 40 min when the annealing temperature was higher than 500 °C. The thorns on the surface of the Ni/NiO NWs gradually passivated and magnetic properties declined when the annealing temperature was increased from 300 °C to 400 °C. Smooth Ni/NiO NWs with no magnetic properties were prepared when the annealing temperature was over 500 °C. The detail study regarding the formation and evolution of Ni/NiO NWs is of considerable value and may provide useful information regarding the choice of post-treatment parameters for different applications of Ni/NiO NWs.

  17. Structural evolution of Ni-20Cr alloy during ball milling of elemental powders

    International Nuclear Information System (INIS)

    Lopez B, I.; Trapaga M, L. G.; Martinez F, E.; Zoz, H.

    2011-01-01

    The ball milling (B M) of blended Ni and Cr elemental powders was carried out in a Simoloyer performing on high-energy scale mode at maximum production to obtain a nano structured Ni-20Cr alloy. The phase transformations and structural changes occurring during mechanical alloying were investigated by X-ray diffraction (XRD) and optical microscopy (Om). A gradual solid solubility of Cr and the subsequent formation of crystalline metastable solid solutions described in terms of the Avrami-Ero fe ev kinetics model were calculated. The XRD analysis of the structure indicates that cumulative lattice strain contributes to the driving force for solid solution between Ni and Cr during B M. Microstructure evolution has shown, additionally to the lamellar length refinement commonly observed, the folding of lamellae in the final processing stage. Om observations revealed that the lamellar spacing of Ni rich zones reaches a steady value near 500 nm and almost disappears after 30 h of milling. (Author)

  18. Structural evolution of Ni-20Cr alloy during ball milling of elemental powders

    Energy Technology Data Exchange (ETDEWEB)

    Lopez B, I.; Trapaga M, L. G. [IPN, Centro de Investigacion y de Estudios Avanzados, Unidad Queretaro, Libramiento Norponiente No. 2000, Juriquilla, 76230 Queretaro (Mexico); Martinez F, E. [Centro de Investigacion e Innovacion Tecnologica, Cerrada de Cecati s/n, Col. Santa Catarina Azcapotzalco, 02250 Mexico D. F. (Mexico); Zoz, H., E-mail: israelbaez@gmail.co [Zoz GmbH, D-57482, Wenden (Germany)

    2011-07-01

    The ball milling (B M) of blended Ni and Cr elemental powders was carried out in a Simoloyer performing on high-energy scale mode at maximum production to obtain a nano structured Ni-20Cr alloy. The phase transformations and structural changes occurring during mechanical alloying were investigated by X-ray diffraction (XRD) and optical microscopy (Om). A gradual solid solubility of Cr and the subsequent formation of crystalline metastable solid solutions described in terms of the Avrami-Ero fe ev kinetics model were calculated. The XRD analysis of the structure indicates that cumulative lattice strain contributes to the driving force for solid solution between Ni and Cr during B M. Microstructure evolution has shown, additionally to the lamellar length refinement commonly observed, the folding of lamellae in the final processing stage. Om observations revealed that the lamellar spacing of Ni rich zones reaches a steady value near 500 nm and almost disappears after 30 h of milling. (Author)

  19. Magnetic properties of NpNiGa(5).

    Science.gov (United States)

    Colineau, E; Sanchez, J P; Wastin, F; Boulet, P; Rebizant, J

    2007-06-20

    We have investigated a polycrystalline sample of NpNiGa(5) by magnetization, specific heat and (237)Np Mössbauer spectroscopy. We confirm that a ferromagnetic order sets in at T(C)≈30 K and that NpNiGa(5) undergoes a second transition at T(N)≈18 K. Mössbauer data indicate that the transition at T(N) is accompanied by a steep increase of the Np magnetic moment, which saturates to a value of 0.94 µ(B), in good agreement with the recently published neutron diffraction results. The Sommerfeld specific heat coefficient γ = 114 mJ mol(-1) K(-2) is the highest among the NpTGa(5) compounds. It compares to the ones observed in the PuTGa(5) superconductors. The trend of the isomer shift along the NpTGa(5) (T = Fe, Co, Ni, Rh) series points to a tendency towards localization of the 5f electrons when increasing the number of d electrons of the transition metal T. Neither fully localized nor fully itinerant models are able to reproduce the whole experimental data. Realistic models should include the dual nature of the 5f electrons, i.e. consider the difference in the degree of itinerancy among 5f electrons in the NpTGa(5) compounds.

  20. Ultra Fast Timing Measurements at $^{78}$Ni and $^{132}$Sn

    CERN Multimedia

    2002-01-01

    We propose to measure level lifetimes in the exotic nuclei of $^{81}$Ga and $^{80}$Ga in the vicinity of $^{78}$Ni and of $^{135}$Sb and $^{134}$Sb above $^{132}$Sn by the time-delayed technique. These are relatively simple nuclear systems with a few particles and/or holes outside of the doubly-magic core thus can be treated rather precisely within the shell model. The anticipated new structure information on these nuclei, and in particular the lifetime results will put constraints on the model parameters and will serve to verify their predictions. The selected nuclei are some of the most exotic ones just above $^{78}$Ni or $^{132}$Sn, where the transition rates can be studied at present. Of the strongest interest is the nucleus of $^{81}$Ga, which has only 3 valence protons outside of $^{78}$Ni with the lowest proton orbits being $p_{3/2}$ and $f_{5/2}$. The Ml transition between these states, although allowed by the selection rules, should be $\\textit{l}$-forbidden thus very slow. This should give rise to a...

  1. Investigation of Partially Crystalline Zr77Ni23 Metallic Glass

    Directory of Open Access Journals (Sweden)

    Amra Salčinović Fetić

    2016-08-01

    Full Text Available This paper presents the results of an extensive research of partially crystalline Zr77Ni23 metallic glass (indicated numbers refer to atomic percentages. The partially crystalline Zr77Ni23 samples were prepared by melt-spinning using a device constructed in the Metal Physics Laboratory, Faculty of Science in Sarajevo. XRD pattern shows crystalline peaks which correspond to an orthorhombic structure of Zr3Ni superimposed on an amorphous pattern. Homogeneity and chemical composition were investigated using scanning electron microscopy (SEM and energy-dispersive X-ray spectroscopy (EDX. Crystallization was studied by differential scanning calorimetry (DSC. DSC analysis indicated a simple thermally activated process. Overall activation energy of the crystallization was calculated using Kissinger's model for nonisothermal process and compared with those given by the Augis-Bennett model. By monitoring of the electrical resistance in the temperature range 80 – 270 K a small and negative thermal coefficient of electrical resistance was observed. This means that electrical resistance varies slightly with temperature and it makes this metallic glass suitable for application in electronic circuits for which this property is an important requirement.

  2. Niño maltratado

    Directory of Open Access Journals (Sweden)

    Ana Ivis Crespo Barrios

    1996-12-01

    Full Text Available Se presentan 200 niños maltratados que acuden al Hospital Pediátrico Docente "Juan Manuel Márquez" en el período comprendido de diciembre de 1990 a enero de 1992; éstos fueron seleccionados teniendo en cuenta los criterios de maltrato, y era el objetivo fundamental del estudio conocer cómo se comporta en nuestro medio. En los resultados se muestra que la forma más frecuente fue el tipo no intencional; la ingestión de tóxicos fue la forma de negligencia física más frecuente dentro del maltrato no intencional, ésta es más usual en los niños menores de 5 años; los trastornos psiquiátricos y el alcoholismo son favorecedores del maltrato intencional, la madre es la que más maltrata; la mortalidad por esta causa no fue elevada (5 fallecidos y los criterios de riesgo de maltrato tienen utilidad para su identificación.200 mistreated children who were seen at the "Juan Manual Márquez" Pediatric Teaching Hospital from December, 1990 to January, 1992, are presented. These patients were selected taking into consideration the abuse criteria. The main objective of this paper was to know how these criteria behave in our enviroment. According to the results, the most common form was the non-intentional type. The ingestion of toxic agents was the most frequent form of physical neglect within the non-intentional mistreatment, and it is the most usual among children under 5. Psychiatric disorders and alcoholism favor the intentional mistreatment, and the mother mistreats the most. Mortality due to this cause was not high (5 deaths, and the abuse risk criteria are useful for its identification.

  3. Kinetic Studies on Ni-YSZ Composite Electrodes

    DEFF Research Database (Denmark)

    Njodzefon, Jean-Claude; Sudireddy, Bhaskar Reddy; Hjelm, Johan

    2015-01-01

    AC and DC techniques were applied to investigate the electrochemical reaction kinetics of porous composite Ni/8-mol% yttria-stabilized zirconia (Ni/8YSZ) solid oxide cell (SOC) electrodes using a novel pseudo-3-electrode cell geometry. From OCV impedance spectra an activation energy Ea of 1.13 e......V, prefactor yan of 3.7·105·T, hydrogen and steam partial pressure dependencies a and b respectively of -0.07 and 0.22 were determined. DC current density vs. overpotential curves compared with those predicted using the determined kinetic parameters. Apparent Butler-Volmer charge transfer coefficients α were...... branch and the need for different α values for each branch suggests that a simple BV model of the measured electrode kinetics is insufficient and/or different reaction mechanisms might be occurring in anodic vs cathodic polarization....

  4. Disorder trapping in Ni3(Al, Ti) by solidification from the undercooled melt

    International Nuclear Information System (INIS)

    Goetzinger, R.; Kurz, W.

    1997-01-01

    Modelling of rapid solidification predicts disorder trapping in the superlattice structure of Ni 3 Al. However, experimental investigations on this compound suffer from ambiguities concerning the solidification path. There is a phase selection competition between the ordered fcc γ'-phase (Ni 3 Al), the ordered bcc β-phase (NiAl), the disordered fcc γ-phase (Ni), the stable γ'/β eutectic and the metastable γ/β eutectic, and there are subsequent solid state transformations. A replacement of several at.% Al by Ti leads to a stabilization of the γ'-phase and to an avoidance of most of the problems encountered on Ni 3 Al. The experiments on Ni 3 (Al, Ti) presented here clearly show the expected disordered crystallization from the undercooled melt. This was proven by measuring the dendrite growth velocity of electromagnetically levitated droplets and by analysing the data in the framework of dendrite and kinetic growth models. Complementary microstructural investigations were performed on the as-solidified samples. (orig.)

  5. Thermodynamic analysis of (Ni, Fe)3Al formation by mechanical alloying

    International Nuclear Information System (INIS)

    Adabavazeh, Z.; Karimzadeh, F.; Enayati, M.H.

    2012-01-01

    Highlights: ► (Ni, Fe) 3 Al intermetallic compound was synthesized by mechanical alloying. ► We use a thermodynamic analysis to predict the more stable phase. ► We calculate the Gibbs free-energy changes by using extended Miedema model. ► The results of MA compared with thermodynamic analysis and showed a good agreement with it. - Abstract: (Ni, Fe) 3 Al intermetallic compound was synthesized by mechanical alloying (MA) of Ni, Fe and Al elemental powder mixtures of composition Ni 50 Fe 25 Al 25 . Phase transformation and microstructure characteristics of the alloy powders were investigated by X-ray diffraction (XRD). The results show that mechanical alloying resulted in a Ni (Al, Fe) solid solution. By continued milling, this structure transformed to the disordered (Ni, Fe) 3 Al intermetallic compound. A thermodynamic model developed on the basis of extended theory of Miedema is used to calculate the Gibbs free-energy changes. Final product of MA is a phase having minimal Gibbs free energy compared with other competing phases in Ni–Fe–Al system. However in Ni–Fe–Al system, the most stable phase at all compositions is intermetallic compound (not amorphous phase or solid solution). The results of MA were compared with thermodynamic analysis and revealed the leading role of thermodynamic on the formation of MA product prediction.

  6. Modified spatial autocorrelation method using autoregressive model for estimating underground velocity structure from microtremor array observation; Bido array tansa ni okeru kukan jiko sokanho no jiko kaiki model wo mochiita kairyo

    Energy Technology Data Exchange (ETDEWEB)

    Yamamoto, H.; Saito, T. [Iwate University, Iwate (Japan). Faculty of Engineering; Obuchi, T. [Kawasaki Geological Engineering Co. Ltd., Tokyo (Japan)

    1998-02-01

    Spatial autocorrelation method (SAC) is an effective analysis for estimating underground S-wave velocity structure from microtremor phase velocity dispersion relation because it has larger detectable range of microtremor wavelength than frequency-wavenumber analysis. However, phase velocities estimated by conventional SAC methods such as band-pass filtered method or Fast Fourier Transform method were not precise if suitable band width was not selected for analysis. We proposed a new technique for SAC using autoregressive model which estimated spectra with high resolution because the best fitting model can be selected using AIC. We apply the new method to calculate phase velocities of microtremors which were observed at a ground of Morioka Technical High School with arrays. As a result, phase velocities calculated by the new method were continuous with frequency although those calculated by the conventional methods were scattered. This indicates that SAC functions calculated by the new method are estimated better than those by conventional SAC methods. 13 refs., 7 figs.

  7. Design optimization of ideal non-imaging concentrators for solar collectors by use of yearly insolation model with frequency distribution; Dosu bunpu wo koryoshita nenkan nissha model ni yoru shunetsuyo riso hikessho shukoki no saitekika

    Energy Technology Data Exchange (ETDEWEB)

    Suzuki, A. [Tokyo University of Agriculture and Technology, Tokyo (Japan)

    1996-10-27

    Optimization was carried out for the 2D-CPC (compound parabolic concentrator) known as an ideal 2-dimensional non-imaging concentrator for its application to stationary solar heat concentrators. A non-imaging optical system is a system that has an angle for incident light called an acceptance angle, and is treated as an effective tool in the field of solar energy application. Analysis was conducted from the viewpoint of energy and exergy on the presumption of constant temperature operation. For the analysis of constant temperature heat concentration, it needs to be presumed that heat concentrators are in operation only in the presence of insolation that is more than a specified level (critical insolation). When the acceptance angle is fixed for optimization, energy efficiency does not have a peak with respect to the critical probability insolation intensity (in a probability model considering frequency distribution). On the other hand, for the optimization of exergy efficiency, the half-acceptance angle should be within a 35-40{degree} range (agreeing with the optimum angle cost-wise), and the critical probability insolation should be set at 250-300W/m{sup 2} (1/4 of the maximum insolation intensity). The obtained results are low in model dependency and are sufficiently reliable. 14 refs., 4 figs.

  8. Phase-field simulation of peritectic solidification closely coupled with directional solidification experiments in an Al-36 wt% Ni alloy.

    Science.gov (United States)

    Siquieri, R; Doernberg, E; Emmerich, H; Schmid-Fetzer, R

    2009-11-18

    In this work we present experimental and theoretical investigations of the directional solidification of Al-36 wt% Ni alloy. A phase-field approach (Folch and Plapp 2005 Phys. Rev. E 72 011602) is coupled with the CALPHAD (calculation of phase diagrams) method to be able to simulate directional solidification of Al-Ni alloy including the peritectic phase Al(3)Ni. The model approach is calibrated by systematic comparison to microstructures grown under controlled conditions in directional solidification experiments. To illustrate the efficiency of the model it is employed to investigate the effect of temperature gradient on the microstructure evolution of Al-36 wt% Ni during solidification.

  9. Nonenzymatic Glucose Sensor Based on In Situ Reduction of Ni/NiO-Graphene Nanocomposite

    Directory of Open Access Journals (Sweden)

    Xiaohui Zhang

    2016-10-01

    Full Text Available Ni/NiO nanoflower modified reduced graphene oxide (rGO nanocomposite (Ni/NiO-rGO was introduced to screen printed electrode (SPE for the construction of a nonenzymatic electrochemical glucose biosensor. The Ni/NiO-rGO nanocomposite was synthesized by an in situ reduction process. Graphene oxide (GO hybrid Nafion sheets first chemical adsorbed Ni ions and assembled on the SPE. Subsequently, GO and Ni ions were reduced by hydrazine hydrate. The electrochemical properties of such a Ni/NiO-rGO modified SPE were carefully investigated. It showed a high activity for electrocatalytic oxidation of glucose in alkaline medium. The proposed nonenzymatic sensor can be utilized for quantification of glucose with a wide linear range from 29.9 μM to 6.44 mM (R = 0.9937 with a low detection limit of 1.8 μM (S/N = 3 and a high sensitivity of 1997 μA/mM∙cm−2. It also exhibited good reproducibility as well as high selectivity.

  10. Enthalpy of mixing of liquid Ni-Zr and Cu-Ni-Zr alloys

    International Nuclear Information System (INIS)

    Witusiewicz, V.T.; Sommer, F.

    2000-01-01

    Since the Al-Cu-Ni-Zr system is a basis for the production of bulk amorphous materials by rapid solidification techniques from the liquid state, it is of great scientific interest to determine the partial and the integral thermodynamic functions of liquid and undercooled liquid alloys. Such data, as was pointed out previously, are important in order to understand their extremely good glass-forming ability in multicomponent metallic systems as well as for processing improvements. In order to measure the thermodynamic properties of the Al-Cu-Ni-Zr quaternary, it is necessary to have reliable thermochemical data for its constituent canaries and ternaries first. In a series of articles, the authors have reported in detail the thermodynamic properties of liquid Al-Cu, Al-Ni, Cu-Ni, Cu-Zr, Al-Zr, Al-Cu-Ni, and Al-Cu-Zr alloys. This article deals with the direct calorimetric measurements of the partial and the integral enthalpies of mixing of liquid Ni-Zr and Cu-Ni-Zr alloys and the heat capacity of liquid Ni 26 Zr 74 . In a subsequent article, the authors will present similar data for the liquid ternary Al-Ni-Zr and for the liquid quaternary Al-Cu-Ni-Zr alloys

  11. Resin monomers act as adjuvants in Ni-induced allergic dermatitis in vivo.

    Science.gov (United States)

    Bando, K; Takahashi, H; Kinbara, M; Tanaka, Y; Kuroishi, T; Sasaki, K; Takano-Yamamoto, T; Sugawara, S; Endo, Y

    2014-11-01

    Resin monomers (RMs) are inflammatory agents and are thought to cause allergic contact dermatitis (ACD). However, mouse models are lacking, possibly because of the weak antigenicities of RMs. We previously reported that inflammatory substances can promote the allergic dermatitis (AD) induced by intradermally injected nickel (Ni-AD) in mice. Here, we examined the effects of RMs on Ni-AD. To sensitize mice to Ni, a mixture containing non-toxic concentrations of NiCl2 and an RM [either methyl methacrylate (MMA) or 2-hydroxyethyl methacrylate (HEMA)] was injected intraperitoneally or into ear-pinnae intradermally. Ten days later, a mixture containing various concentrations of NiCl2 and/or an RM was intradermally injected into ear-pinnae, and ear-swelling was measured. In adoptive transfer experiments, spleen cells from sensitized mice were transferred intravenously into non-sensitized recipients, and 24 h later NiCl2 was challenged to ear-pinnae. Whether injected intraperitoneally or intradermally, RM plus NiCl2 mixtures were effective in sensitizing mice to Ni. AD-inducing Ni concentrations were greatly reduced in the presence of MMA or HEMA (at the sensitization step from 10 mM to 5 or 50 µM, respectively, and at the elicitation step from 10 µM to 10 or 100 nM, respectively). These effects of RMs were weaker in IL-1-knockout mice and in macrophage-depleted mice. Cell-transfer experiments in IL-1-knockout mice indicated that both the sensitization and elicitation steps depended on IL-1. Challenge with an RM alone did not induce allergic ear-swelling in mice given the same RM + NiCl2 10 days before the challenge. These results suggest that RMs act as adjuvants, not as antigens, to promote Ni-AD by reducing the AD-inducing concentration of Ni, and that IL-1 and macrophages are critically important for the adjuvant effects. We speculate that what were previously thought of as "RM-ACD" might include ACD caused by antigens other than RMs that have undergone promotion by

  12. Synthesis, spectroscopic characterization, molecular modeling and potentiometric studies of Co(II), Ni(II), Cu(II) and Zn(II) complexes with 1,1-diaminobutane-Schiff base

    Science.gov (United States)

    Alaghaz, Abdel-Nasser M. A.

    2014-08-01

    Complexes of cobalt(II), nickel(II), copper(II) and zinc(II) of general composition [M(L)(H2O)2]·2H2O have been synthesized [L = N,N";-bis(2-hydroxybenzylidene)-1,1-diaminobutane]. The elemental analysis, molar conductance measurements, magnetic susceptibility measurements, mass, IR, UV, NMR, SEM, EDX, thermal and EPR spectral studies of the compounds led to the conclusion that the ligand acts as a tetradentate manner. The molar conductance of the complexes in fresh solution of DMSO lies in the range of 7.46-9.13 Ω-1 cm2 mol-1 indicating their non-electrolytic behavior. On the basis of analytical and spectroscopic techniques, octahedral geometry of the complexes was proposed. The Schiff base acts as tetradentate ligand, coordinated through deprotonated phenolic oxygen and azomethine nitrogen atoms. The ligand field parameters were calculated for Co(II), Ni(II) and Cu(II) complexes and their values were found in the range reported for a octahedral structure. The molecular parameters of the ligand and its Co(II), Ni(II), Cu(II) and Zn(II) complexes have been calculated. Protonation constants of Schiff base and stability constants of their binary metal complexes have been determined potentiometrically in 50% DMSO-water media at 25 °C and ionic strength 0.10 M sodium perchlorate.

  13. Identifying the chemical and structural irreversibility in LiNi0.8Co0.15Al0.05O2 - A model compound for classical layered intercalation

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Haodong; Liu, Hao; Seymour, Ieuan; Chermova, Natasha; Wiaderek, Kamila M.; Hy, Sunny; Chen, Yan; Zhang, Minghao; Borkiewicz, Olaf J.; Lapidus, Saul H.; Qiu, Bao; Xia, Yonggao; Liu, Zhaoping; Chupas, Peter J.; Chapman, Karena W.; Whittingham, M. Stanley; Grey, Clare P.; Meng, Y. Shirley

    2018-03-07

    In this work, we extracted 95% of the electrochemically available Li from LiNi0.8Co0.15Al0.05O2 (NCA) by galvanostatically charging the NCA/MCMB full cell to 4.7V. Joint powder X-ray and neutron diffraction (XRD&ND) studies were undertaken for NCA at highly charged states at the first cycle, and discharged states at different cycles. The results indicate that the bulk structure of NCA maintains the O3 structure up to the extraction of 0.90 Li per formula unit. In addition, we found that the transition metal layer becomes more disordered along the c-axis than along the a- and b- axes upon charging. This anisotropic disorder starts to develop no later than 4.3 V on charge and continues to grow until the end of charge. As Li is re-inserted during discharge, the structure that resembles the pristine NCA is recovered. The irreversible loss of Li and the migration of Ni to the Li layer have been quantified by the joint XRD and ND refinement and the results were further verified by solid state 7Li NMR and magnetic measurements. Our work clearly demonstrates that the NCA bulk retains a robust, single phase O3 structure throughout the wide delithiation range (up to 0.9 Li per formula unit of NCA) and is suitable for higher energy density usage with proper modifications.

  14. Effect of H{sub 2}S on the thermodynamic stability and electrochemical performance of Ni cermet-type of anodes for solid oxide fuel cells

    Energy Technology Data Exchange (ETDEWEB)

    Venkateswara Rao, M.

    2006-11-15

    For SOFCs to be main means of power generation, they should be able to exploit wide variety of fuels. Among Ni-cermets, Ni-YSZ is the state-of-the-art materials for SOFC-anode which is the fuel electrode. But sulphur impurity present in different gaseous fuels (e.g Biogas), depending on its concentration, is highly poisonous to the stability and electrochemical performance of the Ni catalyst in the cermet anodes. Thus in this study the microstructural stability of Ni-YSZ, Ni-CGO and Ni-LSGM cermets in H{sub 2}S-containing hydrogen gas is studied in the intermediate temperature range of SOFC operation. Thermodynamic modelling of Ni-S-O-H quaternary system was performed for the calculation of thermodynamic stability and sulphur-tolerance limit of Ni in the gaseous atmosphere made up of H, O and S. The effect of presence H{sub 2}S in fuel gas, in the concentrations well below the thermodynamic tolerance limit, on the electrochemical performance of the anodes is studied by using model Ni-patterned electrodes on YSZ and LSGM. Thermodynamic modelling of the Ni-S-O-H quaternary was performed by employing CALPHAD methodology. The modelling of Ni-S binary phase diagram was performed by using sublattice models for the non-stoichiometric phases. The optimised binaries of Ni-O, and Ni-H were taken from the literature. The Ni-O-S and Ni-O-H ternaries were extrapolated from the lower order binaries. In Ni-O-S ternary, NiSO{sub 4} is the only ternary compound present. The ternary compounds, Ni(OH){sub 2} and NiOOH in the Ni-O-H ternary were considered as stoichiometric line compounds. The model parameters of the ternary compounds were optimised using the experimental data. The Ni-S-O-H quaternary was calculated by extrapolation method as employed in the CALPHAD methodology. Inorder to understand the H{sub 2}-oxidation mechanism and the role played by the electrolyte in the reaction mechanism, symmetrical cells of Ni-patterned YSZ single crystals with different crystallographic

  15. A dor na criança com câncer: modelos de avaliação El dolor en niños con cáncer: modelos de evaluación Pain in children with cancer: evaluation models

    Directory of Open Access Journals (Sweden)

    Patrícia Torritesi

    1998-10-01

    Full Text Available O controle e o alívio da dor na assistência à criança com câncer tem sido objeto de preocupação da enfermagem na busca de intervenções que possam minimizar ou evitar problemas de ordem físico-emocional para estas crianças. A literatura da área médica, da psicologia e da enfermagem descrevem a dor através de aspectos fisiológicos, emocionais, comportamentais e ambientais, sendo divulgados vários modelos de escalas de avaliação e de controle da dor. Este estudo descreve alguns modelos de avaliação da dor em crianças e apresenta a adaptação do Modelo de Escala Analógica Visual de Faces de McGrath (1990, como instrumento a ser utilizado na assistência de enfermagem à criança com câncer. Embora a literatura utilizada neste estudo enfatize a avaliação e o controle da dor na criança com câncer, verificamos a viabilidade da aplicação deste modelo pela enfermagem em outras situações de dor.El control y alivio del dolor en la asistencia a niños con cáncer ha sido objeto de inquietud de la enfermería en busca de intervenciones que puedan minimizar o evitar problemas de orden físico-emocional para estos niños. La literatura de las áreas médica, psicología y enfermería describen el dolor a través de aspectos fisiológicos, emocionales, comportamentales y ambientales, siendo divulgados vários modelos de escalas de evaluación y control del dolor. Este estudio describe algunos modelos de evaluación del dolor en niños y presenta la adaptación del Modelo de Escala Analógica Visual de Facetas de McGrath (1990, como instrumento a ser utilizado en la asistencia de enfermería a niños con cáncer. Sin embargo la literatura utilizada en este estudio enfatice la avaluación y el control de el dolor en el niño con cáncer, verificamos la viabilidad de la aplicación de este modelo por el profesional de enfermería en otras situaciones del dolor.Control and alleviation of pain in the care to children with cancer are

  16. niños pre-escolares

    Directory of Open Access Journals (Sweden)

    Sandra León Muñoz

    2006-01-01

    Full Text Available Este estudio tuvo como objetivo caracterizar las producciones narrativas orales de niños de pre-escolar y relacionar estos desempeños con la lectura de imágenes. Se conformó una muestra de 9 niños entre 4 y 6 años que pertenecían a instituciones de educación formal. Se realizó un análisis de tarea de la historieta presentada y la aplicación de ésta fue de manera individual en el contexto familiar del niño. Los resultados mostraron que los niños identificaban la situación inicial de la narración, en la cual relacionaban personajes principales, actividades propias de ellos y del espacio donde sucedían sin embargo, a medida que se avanzaban en el procedimiento, se observó cómo se dificultaba para los niños la elaboración de las otras categorías que estructuran la narración como la complicación, la reacción, la resolución y la situación final. En relación con las estrategias cognitivas se observó que cuatro niños se encuentra en un nivel cognitivo bajo, cuatro se encuentra en un nivel cognitivo medio y un niño, en un nivel cognitivo alto. En cuanto a los procesos de lectura de imágenes se encontró que sólo dos niños utilizaron la referencia y dos niños usaron conectores temporales

  17. Electrochemical preparation and characteristics of Ni-Co-LaNi5 composite coatings as electrode materials for hydrogen evolution

    International Nuclear Information System (INIS)

    Wu Gang; Li Ning; Dai Changsong; Zhou Derui

    2004-01-01

    Electrocatalytic activity for the hydrogen evolution reaction on Ni-Co-LaNi 5 composite electrodes prepared by electrochemical codeposition technique was evaluated. The relationship between the current density for hydrogen evolution reaction and the amount of LaNi 5 particles in Ni-Co baths is like the well-known 'volcano plot'. The Surface morphology and microstructure of Ni-Co-LaNi 5 coatings were determined by means of scanning electron microscopy (SEM) and X-ray diffraction (XRD). The kinetic parameters were determined from electrochemical steady-state Tafel polarization and electrochemical impedance spectroscopy technology in 1 M NaOH solution. The values obtained for the apparent energies of activation are 32.48, 46.29 and 57.03 kJ mol -1 for the Ni-Co-LaNi 5 , Ni-Co and Ni electrodes, respectively. The hydrogen evolution reaction on Ni-Co-LaNi 5 proceeds via Volmer-Tafel reaction route with the mixed rate determining characteristics. The composite coating Ni-Co-LaNi 5 is catalytically more active than Ni and Ni-Co electrodes due to the increase in its real surface areas and the decrease in the apparent free energy of activation caused by the electrocatalytic synergistic effect of the Ni-Co alloys and the hydrogen storage intermetallic particles on the electrode surface

  18. Enhanced debromination of decabrominated diphenyl ether in aqueous solution by attapulgite supported Fe/Ni bimetallic nanoparticles: kinetics and pathways

    Science.gov (United States)

    Liu, Zongtang; Gu, Chenggang; Bian, Yongrong; Jiang, Xin; Sun, Yufeng; Fei, Zhenghao; Dai, Jingtao

    2017-08-01

    In this study, Fe/Ni bimetallic nanoparticles were supported on the attapulgite (A-Fe/Ni) to enhance the degradation reactivity of decabrominated diphenyl ether (BDE209) in aqueous solution. The Fe/Ni nanoparticles were well distributed on the attapulgite surface with an average diameter of 20-40 nm. The removal percentage of BDE209 by A-Fe/Ni was 1.59 times higher than Fe/Ni nanoparticles alone because attapulgite could act as supporting material to disperse Fe/Ni nanoparticles and prevent Fe/Ni nanoparticles from aggregation. The degradation kinetics for BDE209 debromination by A-Fe/Ni could be well described by a pseudo-first-order model, and the debromination rate constant of BDE209 increased with increasing the dosage of A-Fe/Ni, water/THF ratio, and decreasing the initial BDE209 concentration and solution pH. The degradation products were identified using a third-order polynomial regression equation between the experimental and reference gas chromatography relative retention times. Stepwise debromination from n-bromo-DE to (n  -  1)-bromo-DE was a possible pathway with bromines being substituted sequentially by hydrogen. The preferred elimination of bromines of BDE209 by A-Fe/Ni followed the debromination preference of para-Br  >  meta-Br  >  ortho-Br. The results provide evidences for understanding the debromination mechanism of polybrominated diphenyl ether by clay-supported Fe/Ni nanoparticles.

  19. De niños e infancias

    OpenAIRE

    Camenen, Gersende; Liendo, Victoria

    2014-01-01

    A Sarmiento, el niño sabio, lo llevan de casa en casa como al prodigio del pueblo para oírlo leer en voz alta. Norah Lange, la niña excéntrica, grita desaforada en distintos idiomas y finge carcajadas enloquecidas desde el techo de su casa hasta gastar la voz. Reinaldo Arenas, el niño salvaje, escribe, como Celestino, poemas con un cuchillo en el tronco los árboles para que no amanezca. Borges, el traductor precoz, lee a los seis años el Quijote en inglés sin tener la menor sospecha de que el...

  20. New developments in Ni/Ti multilayers

    Energy Technology Data Exchange (ETDEWEB)

    Anderson, I.; Hoghoj, P. [Institut Max von Laue - Paul Langevin (ILL), 38 - Grenoble (France)

    1997-04-01

    It is now 20 years since super-mirrors were first used as a neutron optical element. Since then the field of multilayer neutron-optics has matured with multilayers finding their way to application in many neutron scattering instruments. However, there is still room for progress in terms of multilayer quality, performance and application. Along with work on multilayers for neutron polarisation Ni/Ti super-mirrors have been optimised. The state-of-the-art Ni/Ti super-mirror performance and the results obtained in two neutron-optics applications of Ni/Ti multilayers are presented. (author).

  1. Nickel Release, ROS Generation and Toxicity of Ni and NiO Micro- and Nanoparticles.

    Science.gov (United States)

    Latvala, Siiri; Hedberg, Jonas; Di Bucchianico, Sebastiano; Möller, Lennart; Odnevall Wallinder, Inger; Elihn, Karine; Karlsson, Hanna L

    2016-01-01

    Occupational exposure to airborne nickel is associated with an elevated risk for respiratory tract diseases including lung cancer. Therefore, the increased production of Ni-containing nanoparticles necessitates a thorough assessment of their physical, chemical, as well as toxicological properties. The aim of this study was to investigate and compare the characteristics of nickel metal (Ni) and nickel oxide (NiO) particles with a focus on Ni release, reactive oxygen species (ROS) generation, cellular uptake, cytotoxicity and genotoxicity. Four Ni-containing particles of both nano-size (Ni-n and NiO-n) and micron-size (Ni-m1 and Ni-m2) were tested. The released amount of Ni in solution was notably higher in artificial lysosomal fluid (e.g. 80-100 wt% for metallic Ni) than in cell medium after 24h (ca. 1-3 wt% for all particles). Each of the particles was taken up by the cells within 4 h and they remained in the cells to a high extent after 24 h post-incubation. Thus, the high dissolution in ALF appeared not to reflect the particle dissolution in the cells. Ni-m1 showed the most pronounced effect on cell viability after 48 h (alamar blue assay) whereas all particles showed increased cytotoxicity in the highest doses (20-40 μg cm2) when assessed by colony forming efficiency (CFE). Interestingly an increased CFE, suggesting higher proliferation, was observed for all particles in low doses (0.1 or 1 μg cm-2). Ni-m1 and NiO-n were the most potent in causing acellular ROS and DNA damage. However, no intracellular ROS was detected for any of the particles. Taken together, micron-sized Ni (Ni-m1) was more reactive and toxic compared to the nano-sized Ni. Furthermore, this study underlines that the low dose effect in terms of increased proliferation observed for all particles should be further investigated in future studies.

  2. Exchange bias variations of the seed and top NiFe layers in NiFe/FeMn/NiFe trilayer as a function of seed layer thickness

    International Nuclear Information System (INIS)

    Sankaranarayanan, V.K.; Yoon, S.M.; Kim, C.G.; Kim, C.O.

    2005-01-01

    Development of exchange bias at the seed and top NiFe layers in the NiFe (t nm)/FeMn(10 nm)/NiFe(5 nm) trilayer structure is investigated as a function of seed layer thickness, in the range of 2-20 nm. The seed NiFe layer shows maximum exchange bias at 4 nm seed layer thickness. The bias shows inverse thickness dependence with increasing thickness. The top NiFe layer on the other hand shows only half the bias of the seed layer which is retained even after the sharp fall in seed layer bias. The much smaller bias for the top NiFe layer is related to the difference in crystalline texture and spin orientations at the top FeMn/NiFe interface, in comparison to the bottom NiFe/FeMn interface which grows on a saturated NiFe layer with (1 1 1) orientation

  3. Synthesis of Supported NiPt Bimetallic Nanoparticles, Methods for Controlling the Surface Coverage of Ni Nanoparticles With Pt, Methods Of Making NiPt Multilayer Core-Shell Structures and Application of the Supported Catalysts for CO2 Reforming

    KAUST Repository

    Li, Lidong

    2015-06-25

    Embodiments of the present disclosure provide for supported Ni/Pt bimetallic nanoparticles, compositions including supported NiPt nanoparticles, methods of making supported NiPt nanoparticles, methods of using supported NiPt nanoparticles, and the like.

  4. Free-energies of the Ti-Ni, Fe-Ni and Mo-Ni alloys in relation to their behaviour under particle irradiation

    International Nuclear Information System (INIS)

    De Tendler, R.H.; Rodriguez, C.; Gallego, L.J.; Alonso, J.A.

    1996-01-01

    The metastable free-energy diagrams of the Ti-Ni, Fe-Ni and Mo-Ni systems were calculated at room temperature using a semiempirical theory based on thermodynamic considerations. Ti-Ni and Mo-Ni form equilibrium-ordered compounds that are destabilized by particle irradiation. Effectively, Ti 2 Ni, TiNi, MoNi and MoNi 3 amorphize after irradiation. In the present work, this experimental behaviour is understood by considering the modification of the free-energy diagrams after particle irradiation. Conversely, in the Fe-Ni system, a metastable f c c solid solution evolves under irradiation towards ordered FeNi. In this system, according to our calculation, the free-energy of the amorphous phase is much higher than the free-energy of any other competing phase, so the amorphous phase cannot be produced. Each selected alloy has an intermetallic compound (TiNi 3 , FeNi 3 and MoNi 4 ) which does not amorphize by particle irradiation and whose composition is close to the nickel-rich end of the phase diagram. According to the calculated free-energy diagrams, the reason for this impossibility of amorphization would be the competition of the terminal solid solution with the amorphous phase. (Author)

  5. Fault-related-folding structures and reflection seismic sections. Study by seismic modeling and balanced cross section; Danso ga kaizaisuru shukyoku kozo no keitai to jishin tansa danmen. 2. Seismic modeling oyobi balanced cross section ni yoru study

    Energy Technology Data Exchange (ETDEWEB)

    Tamagawa, T.; Matsuoka, T. [Japan Petroleum Exploration Corp., Tokyo (Japan); Tsukui, R. [Japan National Oil Corp., Tokyo (Japan). Technology Research Center

    1997-05-27

    It occasionally happens that there exists a part where reflection near the thrust is not clearly observed in a thrust zone seismic survey cross section. For the effective interpretation of such an occurrence, the use of geological structures as well as the reflected pattern is effective. When the velocity structures for a fold structure having a listric fault caused anticline (unidirectionally inclined with a backlimb, without a forelimb) and for a fault propagation fold are involved, a wrong interpretation may be made since they look alike in reflection wave pattern despite their difference in geological structure. In the concept of balanced cross section, a check is performed, when the stratum after deformation is recovered to the time of deposition, as to whether the geologic stratum area is conserved without excess or shortage. An excess or shortage occurs if there is an error in the model, and this shows that the fault surface or fold structure is not correctly reflected. Positive application of geological knowledge is required in the processing and interpreting of data from a seismic survey. 6 refs., 6 figs.

  6. Structural response analysis of very large floating structures in waves using one-dimensional finite element model; Ichijigen yugen yoso model ni yoru choogata futai no harochu kozo oto kaiseki

    Energy Technology Data Exchange (ETDEWEB)

    Fujikubo, M.; Yao, T.; Oida, H. [Hiroshima University, Hiroshima (Japan). Faculty of Engineering

    1996-12-31

    Formulation was made on a one-dimensional beam finite element which is effective in analyzing structural response of very large floating structures by modeling them on beams on an elastic foundation. This element allows strict solution of vibration response in the beams on the elastic foundation to be calculated efficiently for a case where mass and rigidity change in the longitudinal direction. This analysis method was used to analyze structural response of a large pontoon-type floating structure to investigate mass in the end part for the structural response and the effect of decay while passing the structure. With a pontoon-type floating structure, reduction in bends and bending stress in the end part of the floating structure is important in designing the structure. Reducing the mass in the end part is effective as a means to avoid resonance in these responses and reduce the responses. Increase in rigidity of a floating structure shifts the peak in quasi-static response to lower frequency side, and reduces response in resonance, hence it is advantageous for improving the response. Since incident waves decay while passing through the floating structure, response in the lower wave side decreases. The peak frequency in the quasi-static response also decreases at the end part of the structure in the upper wave side due to decay in wave force. 7 refs., 11 figs., 1 tab.

  7. Neutron powder diffraction study of the crystal and magnetic structures of BiNiO 3 at low temperature

    Science.gov (United States)

    Carlsson, Sandra J. E.; Azuma, Masaki; Shimakawa, Yuichi; Takano, Mikio; Hewat, Alan; Attfield, J. Paul

    2008-03-01

    The crystal and magnetic structures of the charge ordered perovskite BiNiO 3 have been studied at temperatures from 5 to 300 K using neutron diffraction. Rietveld analysis of the data shows that the structure remains triclinic (space group P1¯) throughout the whole temperature range. Bond-valence sum calculations based on the Bi-O and Ni-O bond distances confirm that the charge distribution is Bi 3+0.5Bi 5+0.5Ni 2+O 3 down to 5 K. The magnetic cell is identical to that of the triclinic superstructure and a G-type antiferromagnetic model gives a good fit to the magnetic intensities, with an ordered Ni 2+ moment of 1.76(3) μB at 5 K. However, BiNiO 3 is ferrimagnetic due to the inexact cancellation of opposing, inequivalent moments in the low symmetry cell.

  8. Precipitation of Ni4Ti3-variants in a polycrystalline Ni-rich NiTi shape memory alloy

    Czech Academy of Sciences Publication Activity Database

    Bojda, Ondřej; Eggeler, G.; Dlouhý, Antonín

    2005-01-01

    Roč. 53, č. 1 (2005), s. 99-104 ISSN 1359-6462 R&D Projects: GA ČR(CZ) GA106/05/0918 Institutional research plan: CEZ:AV0Z20410507 Keywords : NiTi shape memory alloys * Ni4Ti3 precipitation * Transmission electron microscopy Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.228, year: 2005

  9. Influence of Ni Solute segregation on the intrinsic growth stresses in Cu(Ni) thin films

    International Nuclear Information System (INIS)

    Kaub, T.M.; Felfer, P.; Cairney, J.M.; Thompson, G.B.

    2016-01-01

    Using intrinsic solute segregation in alloys, the compressive stress in a series of Cu(Ni) thin films has been studied. The highest compressive stress was noted in the 5 at.% Ni alloy, with increasing Ni concentration resulting in a subsequent reduction of stress. Atom probe tomography quantified Ni's Gibbsian interfacial excess in the grain boundaries and confirmed that once grain boundary saturation is achieved, the compressive stress was reduced. This letter provides experimental support in elucidating how interfacial segregation of excess adatoms contributes to the post-coalescence compressive stress generation mechanism in thin films. - Graphical abstract: Cu(Ni) film stress relationship with Ni additions. Atom probe characterization confirms solute enrichment in the boundaries, which was linked to stress response.

  10. Site occupancy of Fe in ternary Ni 75-x

    Indian Academy of Sciences (India)

    The results of a detailed structural and magnetic study clearly indicate that regardless of the thermal history of the samples, Fe has a strong preference for the Ni sites in Ni-poor (non-stoichiometric) Ni75Al25 alloys. Fe substitution has a profound effect on the nature of magnetism in Ni75Al25.

  11. Reduction of a Ni/Spinel Catalyst for Methane Reforming

    DEFF Research Database (Denmark)

    Kehres, Jan; Andreasen, Jens Wenzel; Fløystad, Jostein Bø

    2015-01-01

    microscopy (HRTEM) was performed on the fresh catalyst sample. The Ni particles in the fresh catalyst sample were observed to exhibit a Ni/NiO core/shell structure. A decrease of the Ni lattice parameter is observed during the reduction in a temperature interval from 413 – 453 K, which can be related...

  12. A Study on Characterization of Light-Induced Electroless Plated Ni Seed Layer and Silicide Formation for Solar Cell Application

    Science.gov (United States)

    Takaloo, Ashkan Vakilipour; Joo, Seung Ki; Es, Firat; Turan, Rasit; Lee, Doo Won

    2018-03-01

    Light-induced electroless plating (LIEP) is an easy and inexpensive method that has been widely used for seed layer deposition of Nickel/Copper (Ni/Cu)-based metallization in the solar cell. In this study, material characterization aspects of the Ni seed layer and Ni silicide formation at different bath conditions and annealing temperatures on the n-side of a silicon diode structure have been examined to achieve the optimum cell contacts. The effects of morphology and chemical composition of Ni film on its electrical conductivity were evaluated and described by a quantum mechanical model. It has been found that correlation exists between the theoretical and experimental conductivity of Ni film. Residual stress and phase transformation of Ni silicide as a function of annealing temperature were evaluated using Raman and XRD techniques. Finally, transmission line measurement (TLM) technique was employed to determine the contact resistance of Ni/Si stack after thermal treatment and to understand its correlation with the chemical-structural properties. Results indicated that low electrical resistive mono-silicide (NiSi) phase as low as 5 mΩ.cm2 was obtained.

  13. Electronic structure of graphene on Ni surfaces with different orientation

    International Nuclear Information System (INIS)

    Pudikov, D.A.; Zhizhin, E.V.; Rybkin, A.G.; Rybkina, A.A.; Zhukov, Y.M.; Vilkov, O. Yu.; Shikin, A.M.

    2016-01-01

    An experimental study of the graphene, synthesized by propylene cracking on Ni surfaces with different orientation: (100) and (111), using angle-resolved photoemission, has been performed. It has been shown that graphene on Ni(111) had a perfect lateral structure due to consistency of their lattices, whereas graphene/Ni(100) consisted of a lot of domains. For both systems electronic structure was quite similar and demonstrated a strong bonding of graphene to the underlying Ni surface. After Au intercalation the electronic structure of graphene in both systems was shifted to the Fermi level and became linear in the vicinity of the K point of the Brillouin zone. - Highlights: • Graphene on Ni(111) is well-ordered, whereas on Ni(100) – multi-domain. • Graphene on Ni(111) and Ni(100) is strongly bonded with substrate. • Intercalation of Au atoms restores the linearity in dispersion and makes graphene quasi-free on both Ni(100) and Ni(111).

  14. Directional Solidification and Mechanical Properties of NiAl-NiAlTa Alloys

    Science.gov (United States)

    Johnson, D. R.; Chen, X. F.; Oliver, B. F.; Noebe, R. D.; Whittenberger, J. D.

    1995-01-01

    Directional solidification of eutectic alloys is a promising technique for producing in-situ composite materials exhibiting a balance of properties. Consequently, the microstructure, creep strength and fracture toughness of directionally solidified NiAl-NiAlTa alloys were investigated. Directional solidification was performed by containerless processing techniques to minimize alloy contamination. The eutectic composition was found to be NiAl-15.5 at% Ta and well-aligned microstructures were produced at this composition. A near-eutectic alloy of NiAl-14.5Ta was also investigated. Directional solidification of the near-eutectic composition resulted in microstructures consisting of NiAl dendrites surrounded by aligned eutectic regions. The off-eutectic alloy exhibited promising compressive creep strengths compared to other NiAl-based intermetallics, while preliminary testing indicated that the eutectic alloy was competitive with Ni-base single crystal superalloys. 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.

  15. Polymer stabilized Ni-Ag and Ni-Fe alloy nanoclusters: Structural and magnetic properties

    Energy Technology Data Exchange (ETDEWEB)

    Kabir, L.; Mandal, A.R. [Department of Physics, Visva-Bharati, Santiniketan-731 235 (India); Mandal, S.K., E-mail: sk_mandal@hotmail.co [Department of Physics, Visva-Bharati, Santiniketan-731 235 (India)

    2010-04-15

    We report here the structural and magnetic behaviors of nickel-silver (Ni-Ag) and nickel-iron (Ni-Fe) nanoclusters stabilized with polymer (polypyrrole). High resolution transmission electron microscopy (HRTEM) indicates Ni-Ag nanoclusters to stabilize in core-shell configuration while that of Ni-Fe nanoclusters in a mixed type of geometry. Structural characterizations by X-ray diffraction (XRD) reveal the possibility of alloying in such bimetallic nanoclusters to some extent even at temperatures much lower than that of bulk alloying. Electron paramagnetic resonance (EPR) spectra clearly reveal two different absorption behaviors: one is ascribed to non-isolated Ni{sup 2+} clusters surrounded by either silver or iron giving rise to a broad signal, other (very narrow signal) being due to the isolated superparamagnetic Ni{sup 2+} clusters or bimetallic alloy nanoclusters. Results obtained for Ni-Ag and Ni-Fe nanoclusters have been further compared with the behavior exhibited by pure Ni nanoclusters in polypyrrole host. Temperature dependent studies (at 300 and 77 K) of EPR parameters, e.g. linewidth, g-value, line shape and signal intensity indicating the significant influence of surrounding paramagnetic silver or ferromagnetic iron within polymer host on the EPR spectra have been presented.

  16. Polymer stabilized Ni-Ag and Ni-Fe alloy nanoclusters: Structural and magnetic properties

    Science.gov (United States)

    Kabir, L.; Mandal, A. R.; Mandal, S. K.

    2010-04-01

    We report here the structural and magnetic behaviors of nickel-silver (Ni-Ag) and nickel-iron (Ni-Fe) nanoclusters stabilized with polymer (polypyrrole). High resolution transmission electron microscopy (HRTEM) indicates Ni-Ag nanoclusters to stabilize in core-shell configuration while that of Ni-Fe nanoclusters in a mixed type of geometry. Structural characterizations by X-ray diffraction (XRD) reveal the possibility of alloying in such bimetallic nanoclusters to some extent even at temperatures much lower than that of bulk alloying. Electron paramagnetic resonance (EPR) spectra clearly reveal two different absorption behaviors: one is ascribed to non-isolated Ni 2+ clusters surrounded by either silver or iron giving rise to a broad signal, other (very narrow signal) being due to the isolated superparamagnetic Ni 2+ clusters or bimetallic alloy nanoclusters. Results obtained for Ni-Ag and Ni-Fe nanoclusters have been further compared with the behavior exhibited by pure Ni nanoclusters in polypyrrole host. Temperature dependent studies (at 300 and 77 K) of EPR parameters, e.g. linewidth, g-value, line shape and signal intensity indicating the significant influence of surrounding paramagnetic silver or ferromagnetic iron within polymer host on the EPR spectra have been presented.

  17. Polymer stabilized Ni-Ag and Ni-Fe alloy nanoclusters: Structural and magnetic properties

    International Nuclear Information System (INIS)

    Kabir, L.; Mandal, A.R.; Mandal, S.K.

    2010-01-01

    We report here the structural and magnetic behaviors of nickel-silver (Ni-Ag) and nickel-iron (Ni-Fe) nanoclusters stabilized with polymer (polypyrrole). High resolution transmission electron microscopy (HRTEM) indicates Ni-Ag nanoclusters to stabilize in core-shell configuration while that of Ni-Fe nanoclusters in a mixed type of geometry. Structural characterizations by X-ray diffraction (XRD) reveal the possibility of alloying in such bimetallic nanoclusters to some extent even at temperatures much lower than that of bulk alloying. Electron paramagnetic resonance (EPR) spectra clearly reveal two different absorption behaviors: one is ascribed to non-isolated Ni 2+ clusters surrounded by either silver or iron giving rise to a broad signal, other (very narrow signal) being due to the isolated superparamagnetic Ni 2+ clusters or bimetallic alloy nanoclusters. Results obtained for Ni-Ag and Ni-Fe nanoclusters have been further compared with the behavior exhibited by pure Ni nanoclusters in polypyrrole host. Temperature dependent studies (at 300 and 77 K) of EPR parameters, e.g. linewidth, g-value, line shape and signal intensity indicating the significant influence of surrounding paramagnetic silver or ferromagnetic iron within polymer host on the EPR spectra have been presented.

  18. Composite Ni/NiO-Cr2O3 Catalyst for Alkaline Hydrogen Evolution Reaction

    OpenAIRE

    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. Th...

  19. Pressure dependence on the remanent magnetization of Fe-Ni alloys and Ni metal

    Science.gov (United States)

    Wei, Qingguo; Gilder, Stuart Alan; Maier, Bernd

    2014-10-01

    We measured the acquisition of magnetic remanence of iron-nickel alloys (Fe64Ni36, Fe58Ni42, and Fe50Ni50) and pure Ni under pressures up to 23 GPa at room temperature. Magnetization decreases markedly for Fe64Ni36 between 5 and 7 GPa yet remains ferromagnetic until at least 16 GPa. Magnetization rises by a factor of 2-3 for the other compositions during compression to the highest applied pressures. Immediately upon decompression, magnetic remanence increases for all Fe-Ni alloys while magnetic coercivity remains fairly constant at relatively low values (5-20 mT). The amount of magnetization gained upon complete decompression correlates with the maximum pressure experienced by the sample. Martensitic effects best explain the increase in remanence rather than grain-size reduction, as the creation of single domain sized grains would raise the coercivity. The magnetic remanence of low Ni Invar alloys increases faster with pressure than for other body-centered-cubic compositions due to the higher magnetostriction of the low Ni Invar metals. Thermal demagnetization spectra of Fe64Ni36 measured after pressure release broaden as a function of peak pressure, with a systematic decrease in Curie temperature. Irreversible strain accumulation from the martensitic transition likely explains the broadening of the Curie temperature spectra, consistent with our x-ray diffraction analyses.

  20. Niños y Violencia

    OpenAIRE

    International Child Development Centre

    1997-01-01

    Este Innocenti Digest explora la violencia de los niños y hacia los niños, usando el marco de la Convención de los Derechos del Niño de las Naciones Unidas. Se centra en la violencia interpersonal, tanto intrafamiliar como extrafamiliar. Se incluye el abuso sexual y la explotación ya que a pesar de no implicar obligatoriamente violencia o coerción, la mayor parte de la evidencia demuestra su efectos dañinos tanto físicos como psicológicos. También se discute la implicación de los niños en los...

  1. Root morphology of Ni-treated plants

    International Nuclear Information System (INIS)

    Leskova, A.; Fargasova, A.; Giehl, R. F. H.; Wiren, N. von

    2015-01-01

    Plant roots are very important organs in terms of nutrient and water acquisition but they also serve as anchorages for the aboveground parts of the plants. The roots display extraordinary plasticity towards stress conditions as a result of integration of environmental cues into the developmental processes of the roots. Our aim was to investigate the root morphology of Arabidopsis thaliana plants exposed to a particular stress condition, excess Ni supply. We aimed to find out which cellular processes - cell division, elongation and differentiation are affected by Ni, thereby explaining the seen root phenotype. Our results reveal that a distinct sensitivity exists between roots of different order and interference with various cellular processes is responsible for the effects of Ni on roots. We also show that Ni-treated roots have several auxin-related phenotypes. (authors)

  2. Hydrotreatment of bio-oil over Ni-based catalyst.

    Science.gov (United States)

    Zhang, Xinghua; Wang, Tiejun; Ma, Longlong; Zhang, Qi; Jiang, Ting

    2013-01-01

    Inexpensive non-sulfided Ni-based catalysts were evaluated for hydrotreatments using phenol as model compound. HZSM-5, a zeolite with different ratio of Si/Al and γ-Al(2)O(3) were impregnated with Ni(NO(3))(2) · 6H(2)O and calcined at 450 °C. Conversion rates and product distribution for treatment of phenol at 160-240 °C in the presence of catalysts with nickel loads of 6, 10, 14 and 17 wt.% were determined. Phenol conversion was highest (91.8%) at 240 °C in the presence of HZSM-5(Si/Al = 38) loaded with 10% Ni. When hydrotreatment was carried out with bio-oil obtained from pyrolysis of pine sawdust under the optimal conditions determined for phenol, the pH of bio-oil increased from 2.27 to 4.07, and the hydrogen content increased from 6.28 to 7.01 wt.%. The decrease in acidity is desirable for the use of upgraded bio-oil. Copyright © 2012. Published by Elsevier Ltd.

  3. Endophytic bacteria improve phytoremediation of Ni and TCE co-contamination

    Energy Technology Data Exchange (ETDEWEB)

    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.

  4. Hydrogel covered bimetallic Co:Ni magnetic nano alloy for protein adsorption in biomedical application

    Science.gov (United States)

    Rajar, Kausar; Alveroglu, Esra

    2017-10-01

    In this study, polyacrylamide (PAAm) hydrogel covered CoNi magnetic nanoalloys with various Co/Ni molar ratio (from 1/4 to 4/1) were synthesized, characterized and used for adsorption of Bovine Serum Albumin (BSA). XRD, EDS, VSM, SEM, AFM, Automated Gas Sorption Analyzer and Fluorescence measurements were used for characterizations and adsorption studies. The results confirm that all the synthesized nanoalloys have soft ferromagnetic nature and particles size were determined to be in the range of 8.60-12.19 nm. Adsorption performances of magnetic nanoalloys were investigated on bovine serum albumin (BSA) as a model protein. The results showed that prepared CoNi:PAAm composites have multistage adsorption kinetics for BSA and increasing Ni content in the CoNi nanoalloys enhance the adsorption rate constant and the rate constant can be tuned between 0.003 s-1 and 0.009 s-1 and between 0.01 s-1 and 0.60 s-1 for the first order adsorption and the second order adsorption stages, respectively. These results show that CoNi:PAAm composites can open new pathways for preparing a special composite material which has specific adsorption kinetic for bio-separation technology.

  5. Assessing the impact of El Niño Modoki on seasonal precipitation in Colombia

    Science.gov (United States)

    Córdoba-Machado, Samir; Palomino-Lemus, Reiner; Gámiz-Fortis, Sonia Raquel; Castro-Díez, Yolanda; Esteban-Parra, María Jesús

    2015-01-01

    The influence of the tropical Pacific SST on precipitation in Colombia is examined using a 341 station dataset covering the period 1979-2009. Through a singular value decomposition the two main coupled variability modes show SST patterns clearly associated with canonical El Niño and El Niño Modoki, respectively, presenting great coupling strength with the corresponding seasonal precipitation modes in Colombia. The results reveal that, mainly in winter and summer, canonical El Niño and El Niño Modoki events are associated with a significant rainfall decrease over the northern, central, and western Colombia. The opposite effect occurs in some localities during spring, summer, and autumn. The southwestern region of Colombia exhibits an opposite behavior connected to canonical El Niño and El Niño Modoki events during years when both events do not coexist, showing different seasonal precipitation response to these different patterns. The results found establish the foundations for precipitation modeling in Colombia from the Pacific SST.

  6. On the diversity of moderate El Niño events evolution

    Science.gov (United States)

    Dewitte, Boris; Takahashi, Ken

    2016-04-01

    Moderate El Niño events are about six times more frequent than extreme El Niño events over the last six decades. Although the amplitude of Sea Surface Temperature (SST) along the equator at the peak phase of such events is comparable, there is a significant diversity in the development and decaying phases. Here we use observations and Reanalyses to investigate the processes associated to such diversity. It is first showed from observations that inter-event variability is largest in the far eastern Pacific in austral winter prior to the peak phase. Such variability can be understood in terms of the modulation of the Bjerknes feedback, resulting in two classes of evolution for moderate events: one encompassing the canonical El Niño events and the other one corresponding to the central Pacific El Niño events. It is also shown that there is a negative trend of the strength of air-sea interaction (covariability between wind and SST) in the eastern Pacific over the last 5 decades, which tends to favour central Pacific El Niño events in recent decades. CMIP5 models are analysed in order to document the sensitivity of moderate El Niño events evolution to mean state change.

  7. Fe-Cr-Ni system alloys

    International Nuclear Information System (INIS)

    Levin, F.L.

    1986-01-01

    Phase diagram of Fe-Cr-Ni system, which is the basic one for production of corrosion resistant alloys, is considered. Data on corrosion resistance of such alloys are correlated depending on a number of factors: quality and composition of modifying elements, corrosion medium, temperature, alloy structure, mechanical and thermal treatment. Grades of Fe-Ni-Cr alloys are presented, and fields of their application are pointed out

  8. Heteromorphic NiCo2S4/Ni3S2/Ni Foam as a Self-Standing Electrode for Hydrogen Evolution Reaction in Alkaline Solution.

    Science.gov (United States)

    Liu, Hui; Ma, Xiao; Rao, Yuan; Liu, Yang; Liu, Jialiang; Wang, Luyang; Wu, Mingbo

    2018-04-04

    Considerable works have been devoted on developing high-efficiency nonplatinum electrocatalysts for hydrogen evolution reaction (HER). Herein, 3D heteromorphic NiCo 2 S 4 /Ni 3 S 2 nanosheets network has been constructed on Ni foam (denoted as NiCo 2 S 4 /Ni 3 S 2 /NF) serving as a self-standing electrocatalyst through directly thermal sulfurization of a single-source NiCo-layered double hydroxide precursor. The resultant NiCo 2 S 4 /Ni 3 S 2 /NF electrode exhibits outstanding electrocatalytic HER performance with an extremely low onset overpotential of 15 mV and long-term durability in alkaline solution. Such enhanced HER performance can be credited to (1) the massive exposed active sites provided by mixed transition metal chalcogenides (NiCo 2 S 4 and Ni 3 S 2 ), (2) the strong interfacial interaction at NiCo 2 S 4 /Ni 3 S 2 heterojunction interfaces with the strengthened H binding, and (3) the porous highly conductive Ni foam substrate with accelerated electron transfer. This work opens up a new direction to fabricate effective and non-noble-metal electrodes for water splitting and hydrogen generation.

  9. Immiscibility in the NiFe2O4-NiCr2O4 Spinel Binary

    Energy Technology Data Exchange (ETDEWEB)

    S Ziemniak

    2004-08-13

    The solid solution behavior of the Ni(Fe{sub 1-n}Cr{sub n}){sub 2}O{sub 4} spinel binary is investigated in the temperature range 400-1200 C. Non-ideal solution behavior, as exhibited by non-linear changes in lattice parameter with changes in n, is observed in a series of single-phase solids air-cooled from 1200 C. Air-annealing for one year at 600 C resulted in partial phase separation in a spinel binary having n = 0.5. Spinel crystals grown from NiO, Fe{sub 2}O{sub 3} and Cr{sub 2}O{sub 3} reactants, mixed to give NiCrFeO{sub 4}, by Ostwald ripening in a molten salt solvent, exhibited single phase stability down to about 750 C (the estimated consolute solution temperature, T{sub cs}). A solvus exists below T{sub cs}. The solvus becomes increasingly asymmetric at lower temperatures and extrapolates to n values of 0.2 and 0.7 at 300 C. The extrapolated solvus is shown to be consistent with that predicted using a primitive regular solution model in which free energies of mixing are determined entirely from changes in configurational entropy at room temperature.

  10. Mixtures of Cu, Ni, and Zn act mostly noninteractively on Pseudokirchneriella subcapitata growth in natural waters.

    Science.gov (United States)

    Van Regenmortel, Tina; De Schamphelaere, Karel A C

    2018-02-01

    Freshwater biota are usually exposed to mixtures of different metals in the environment, which raises concern because risk-assessment procedures for metals are still mainly based on single-metal toxicity. Because microalgae are primary producers and therefore at the base of the food web, it is of utmost importance to understand the effects of metal mixtures on these organisms. Most studies that have investigated the combined interactive effects of mixtures on microalgae performed tests in only one specific water. The objective of the present study was to test if combined effects of mixtures to Pseudokirchneriella subcapitata were the same or different across natural waters showing diverse water-chemistry characteristics. This was done by performing experiments with ternary Cu-Ni-Zn mixtures in 3 natural waters and with binary Cu-Ni mixtures in 5 natural waters. We showed that the ternary mixture acted noninteractively on algal growth, except in one water in which the mixture acted antagonistically. We suggest that a low-cationic competition situation in the latter water could be the reason for the antagonistic interaction between the metals. On the other hand, the binary mixture acted noninteractively on algal growth in all tested waters. We showed that both the concentration addition and independent action models can serve as accurate models for toxicity of ternary Cu-Ni-Zn and binary Cu-Ni mixtures to P. subcapitata in most cases and as protective models in all cases. In addition, we developed a metal mixture bioavailability model, by combining the independent action model and the single-metal bioavailability models, that can be used to predict Cu-Ni-Zn and Cu-Ni toxicity to P. subcapitata as a function of metal concentration and water characteristics. Environ Toxicol Chem 2018;37:587-598. © 2017 SETAC. © 2017 SETAC.

  11. Heavy metal environmental impact. Nickel (Ni); Impatto ambientale da metalli pesanti. Il Nichel (Ni)

    Energy Technology Data Exchange (ETDEWEB)

    Bressa, G. [Padua Univ. Padua (Italy). Dipt. di Farmacologia, Lab. di Tossicologia

    2001-02-01

    Nickel (Ni) is a heavy metal in over 3.000 different alloys used to produce kitchen utensils, batteries, coins, etc.. Human extractive and industrial activities are therefore a cause for environmental dispersion of this metal into the biosphere. This shows how in urban areas car traffic and house-heating are the main sources of nickel pollution. Nickel is relatively non-toxic, such as iron, cobalt, copper and zinc; nevertheless prolonged inhalation of dust containing such compounds as Ni O or NiCl{sub 2} concurs in the outbreak of respiratory pathologies. The carcinogenic effect of such compounds as Ni S, Ni O and Ni(CO){sub 4} has been confirmed by experiments on laboratory animals. Ni potentially toxic concentrations, and as a consequence of potential environmental impact, are to be mainly found in populated areas where the main sources are represented by industries and landfills. [Italian] Il nichel (Ni) e' un metallo presente in oltre 3.000 differenti leghe che vengono utilizzate per la produzione di utensili da cucina, batterie, monete, ecc.. Le attivita' estrattive ed industriali dell'uomo sono quindi causa di una dispersione del metallo nella biosfera. Sono stati riscontrati elevati tassi di Ni nell'atmosfera di aree urbane. Cio' sta a dimostrare che nelle aree urbane il traffico automobilistico e il riscaldamento domestico sono le fonti principali di inquinamento da tale metallo. Il nichel e' relativamente atossico, analogamente a ferro, cobalto, rame e zinco, tuttavia l'inalazione protratta di polveri contenenti composti come il NiO o il NiCl{sub 2} contribuisce al manifestarsi di patologie dell'apparato respiratorio. E' stato confermato sperimentalmente su animali da laboratorio l'effetto cancerogeno di alcuni composti quali NiS, NiO e Ni(CO){sub 4}. Concentrazioni potenzialmente tossiche di Ni, e quindi di probabile impatto ambientale, sono maggiormente da ricercare nelle zone antropizzate dove le fonti

  12. Moessbauer analysis and magnetic properties of Invar Fe-Ni-C and Fe-Ni-Mn-C alloys

    International Nuclear Information System (INIS)

    Nadutov, V. M.; Svystunov, Ye. O.; Kosintsev, S. G.; Tatarenko, V. A.

    2006-01-01

    The saturation magnetization and the hyperfine magnetic field of different f.c.c. Fe-Ni based alloys containing nearby 29 at .% Ni were studied as a function of temperature and for different Carbon and Manganese contents. We have observed abnormal behaviors that are explained in terms of mixed exchange interactions between atomic spins: J NiNi (r i ) FeFe (r i ) > 0, J NiFe (r i ) < 0.

  13. Superior effect of Ni-substitution on the hydrogenation kinetics of Mg{sub 6}Pd{sub 1−x}TM{sub x} (TM = Ag, Cu, Ni) pseudo-binary compounds

    Energy Technology Data Exchange (ETDEWEB)

    Ponthieu, M. [MIRE-Group, Laboratorio de Física de Materiales de Interés Energético, Dpto Física de Materiales, Facultad de Ciencias, Universidad Autónoma de Madrid, 28049 Madrid (Spain); ICMPE/CNRS-UPEC, UMR 7182, 2-8 rue Henri Dunant, 94320 Thiais (France); Fernández, J.F., E-mail: josefrancisco.fernandez@uam.es [MIRE-Group, Laboratorio de Física de Materiales de Interés Energético, Dpto Física de Materiales, Facultad de Ciencias, Universidad Autónoma de Madrid, 28049 Madrid (Spain); Cuevas, F. [ICMPE/CNRS-UPEC, UMR 7182, 2-8 rue Henri Dunant, 94320 Thiais (France); Laversenne, L. [Institut Néel, CNRS, Grenoble (France); Bodega, J.; Ares, J.R.; Sánchez, C. [MIRE-Group, Laboratorio de Física de Materiales de Interés Energético, Dpto Física de Materiales, Facultad de Ciencias, Universidad Autónoma de Madrid, 28049 Madrid (Spain)

    2015-10-05

    Highlights: • Kinetics of (de)hydrogenation of Mg{sub 6}(Pd,TM) TM = Ag, Cu and Ni compared. • Faster hydrogenation kinetics for the Ni compound. • Faster H-desorption for the Ni compound due to MgH{sub 2}/Mg{sub 2}NiH{sub 4} synergy. - Abstract: In this investigation, the H-sorption kinetics of Mg{sub 6}Pd and Mg{sub 6}Pd{sub 1−x}TM{sub x} (TM = Ag, Cu, Ni) pseudo-binary compounds at the TM solubility limit have been studied by isothermal hydrogen absorption, thermal desorption spectroscopy and in situ neutron diffraction. Among all studied compounds, the fastest absorption kinetics takes place for the Ni-substituted one. The fit of the absorption curves to established model equations for solid–gas reaction shows that hydrogenation is controlled by diffusion. As for desorption, the peak temperature for the Ni-substituted compound is 90 K below that of MgH{sub 2}/Mg system and is characterised by a low activation energy of 68 kJ/molH{sub 2}. To better understand these results, neutron diffraction experiments during in situ thermal desorption of deuterated Mg{sub 6}Pd and Mg{sub 6}Pd{sub 0.25}Ni{sub 0.75} compounds were carried out. These experiments demonstrate a synergetic effect between MgH{sub 2} and Mg{sub 2}NiH{sub 4} hydrides as responsible for the remarkable kinetics of the Ni-containing compound.

  14. In situ Ni-doping during cathodic electrodeposition of hematite for excellent photoelectrochemical performance of nanostructured nickel oxide-hematite p-n junction photoanode

    International Nuclear Information System (INIS)

    Phuan, Yi Wen; Ibrahim, Elyas; Chong, Meng Nan; Zhu, Tao; Lee, Byeong-Kyu; Ocon, Joey D.; Chan, Eng Seng

    2017-01-01

    Highlights: • NiO-hematite p-n junction photoanodes were fabricated via an in situ Ni-doping. • The fundamental mechanism of Ni 2+ ions involved was elucidated. • The optimum Ni dopant was 25 M% for the highest photocurrent density. • It exhibited an excellent photoelectrochemical performance of 7-folds enhancement. - Abstract: Nanostructured nickel oxide-hematite (NiO/α-Fe 2 O 3 ) p-n junction photoanodes synthesized from in situ doping of nickel (Ni) during cathodic electrodeposition of hematite were successfully demonstrated. A postulation model was proposed to explain the fundamental mechanism of Ni 2+ ions involved, and the eventual formation of NiO on the subsurface region of hematite that enhanced the potential photoelectrochemical water oxidation process. Through this study, it was found that the measured photocurrent densities of the Ni-doped hematite photoanodes were highly dependent on the concentrations of Ni dopant used. The optimum Ni dopant at 25 M% demonstrated an excellent photoelectrochemical performance of 7-folds enhancement as compared to bare hematite photoanode. This was attributed to the increased electron donor density through the p-n junction and thus lowering the energetic barrier for water oxidation activity at the optimum Ni dopant concentration. Concurrently, the in situ Ni-doping of hematite has also lowered the photogenerated charge carrier transfer resistance as measured using the electrochemical impedance spectroscopy. It is expected that the fundamental understanding gained through this study is helpful for the rational design and construction of highly efficient photoanodes for application in photoelectrochemical process.

  15. In situ Ni-doping during cathodic electrodeposition of hematite for excellent photoelectrochemical performance of nanostructured nickel oxide-hematite p-n junction photoanode

    Energy Technology Data Exchange (ETDEWEB)

    Phuan, Yi Wen, E-mail: phuan.yi.wen@monash.edu [School of Engineering, Chemical Engineering Discipline, Monash University Malaysia, Jalan Lagoon Selatan, Bandar Sunway, Selangor DE 47500 (Malaysia); Ibrahim, Elyas, E-mail: meibr2@student.monash.edu [School of Engineering, Chemical Engineering Discipline, Monash University Malaysia, Jalan Lagoon Selatan, Bandar Sunway, Selangor DE 47500 (Malaysia); Chong, Meng Nan, E-mail: Chong.Meng.Nan@monash.edu [School of Engineering, Chemical Engineering Discipline, Monash University Malaysia, Jalan Lagoon Selatan, Bandar Sunway, Selangor DE 47500 (Malaysia); Sustainable Water Alliance, Advanced Engineering Platform, Monash University Malaysia, Jalan Lagoon Selatan, Bandar Sunway, Selangor DE 47500 (Malaysia); Zhu, Tao, E-mail: zhu.tao@monash.edu [School of Engineering, Chemical Engineering Discipline, Monash University Malaysia, Jalan Lagoon Selatan, Bandar Sunway, Selangor DE 47500 (Malaysia); Lee, Byeong-Kyu, E-mail: bklee@ulsan.ac.kr [Department of Civil and Environmental Engineering, University of Ulsan, Nam-gu, Daehakro 93, Ulsan 680-749 (Korea, Republic of); Ocon, Joey D., E-mail: jdocon@up.edu.ph [Laboratory of Electrochemical Engineering (LEE), Department of Chemical Engineering, University of the Philippines Diliman, Quezon City 1101 (Philippines); Chan, Eng Seng, E-mail: chan.eng.seng@monash.edu [School of Engineering, Chemical Engineering Discipline, Monash University Malaysia, Jalan Lagoon Selatan, Bandar Sunway, Selangor DE 47500 (Malaysia)

    2017-01-15

    Highlights: • NiO-hematite p-n junction photoanodes were fabricated via an in situ Ni-doping. • The fundamental mechanism of Ni{sup 2+} ions involved was elucidated. • The optimum Ni dopant was 25 M% for the highest photocurrent density. • It exhibited an excellent photoelectrochemical performance of 7-folds enhancement. - Abstract: Nanostructured nickel oxide-hematite (NiO/α-Fe{sub 2}O{sub 3}) p-n junction photoanodes synthesized from in situ doping of nickel (Ni) during cathodic electrodeposition of hematite were successfully demonstrated. A postulation model was proposed to explain the fundamental mechanism of Ni{sup 2+} ions involved, and the eventual formation of NiO on the subsurface region of hematite that enhanced the potential photoelectrochemical water oxidation process. Through this study, it was found that the measured photocurrent densities of the Ni-doped hematite photoanodes were highly dependent on the concentrations of Ni dopant used. The optimum Ni dopant at 25 M% demonstrated an excellent photoelectrochemical performance of 7-folds enhancement as compared to bare hematite photoanode. This was attributed to the increased electron donor density through the p-n junction and thus lowering the energetic barrier for water oxidation activity at the optimum Ni dopant concentration. Concurrently, the in situ Ni-doping of hematite has also lowered the photogenerated charge carrier transfer resistance as measured using the electrochemical impedance spectroscopy. It is expected that the fundamental understanding gained through this study is helpful for the rational design and construction of highly efficient photoanodes for application in photoelectrochemical process.

  16. Thermodynamic quantities and defect equilibrium in La2-xSrxNiO4+δ

    International Nuclear Information System (INIS)

    Nakamura, Takashi; Yashiro, Keiji; Sato, Kazuhisa; Mizusaki, Junichiro

    2009-01-01

    In order to elucidate the relation between thermodynamic quantities, the defect structure, and the defect equilibrium in La 2-x Sr x NiO 4+δ , statistical thermodynamic calculation is carried out and calculated results are compared to those obtained from experimental data. Partial molar enthalpy of oxygen and partial molar entropy of oxygen are obtained from δ-P(O 2 )-T relation by using Gibbs-Helmholtz equation. Statistical thermodynamic model is derived from defect equilibrium models proposed before by authors, localized electron model and delocalized electron model which could well explain the variation of oxygen content of La 2-x Sr x NiO 4+δ . Although assumed defect species and their equilibrium are different, the results of thermodynamic calculation by localized electron model and delocalized electron model show minor difference. Calculated results by the both models agree with the thermodynamic quantities obtained from oxygen nonstoichiometry of La 2-x Sr x NiO 4+δ . - Graphical abstract: In order to elucidate the relation between thermodynamic quantities, the defect structure, and the defect equilibrium in La 2-x Sr x NiO 4+δ , statistics thermodynamic calculation is carried out and calculated results are compared to those obtained from experimental data.

  17. Electrical conductivity of Ni–YSZ composites: Degradation due to Ni particle growth

    DEFF Research Database (Denmark)

    Pihlatie, Mikko; Kaiser, Andreas; Mogensen, Mogens Bjerg

    2011-01-01

    of steam did have an accelerating effect on the conductivity loss. Scanning Electron Microscopy of cermets reduced in different conditions showed increasing particle size and loss of metal-to-metal percolation in the samples reduced at higher temperatures. The short-term changes in conductivity were...... modelled using two different semi-empirical approaches. Thermodynamic calculations were carried out to assess the vaporisation of Ni in the conditions tested. The rate and mechanisms of conductivity degradation due to Ni particle growth are discussed in light of the measurements, modelling and literature...

  18. Strangeness production in Ni+Ni collisions at 1.93 AGeV; Production d'etrangete dans les collisions Ni+Ni a 1.93 AGeV

    Energy Technology Data Exchange (ETDEWEB)

    Lopez, X

    2004-12-15

    This work deals with the production of strange particles in Ni + Ni collisions at 1.93 A GeV detected with the Fopi (four pi) detector at the heavy ion synchrotron SIS (GSI - Germany). We have limited our investigation to the study of {lambda} and {xi} hyperons. The first chapter presents the models used to describe ultra-relativistic heavy ions collisions. In the second chapter we present the main experimental results concerning the production and transport of strange particles in an energy domain ranging from SIS to RHIC (relativistic heavy ion collider) energies. The third chapter is dedicated to the specificities of the Fopi detector. The fourth chapter deals with the production of {lambda} particles in Ni + Ni collisions. An analysis method based on neuron network has been used in parallel with a more classical method. The production rate and temperature of {lambda} have been deduced from both methods. The neuron network method gives a statistical gain and allows a better identification of particles with low transverse impulses. The fifth chapter is dedicated to the detection of the doubly strange {xi}{sup -} particle. A detailed study about the stability of the signal is presented. In the last chapter all our experimental results are confronted with theoretical predictions. The UrQMD model that uses a hard equation of state, can simulate satisfactorily the production rates of {lambda} and K{sup +} as well as their dependency on collision centrality despite the fact that this model does not use a potential linked to the medium density. The comparison between experimental results and predictions given by the IQMD model (that is based on a soft equation of state) is better when the version of the model that does not take into account the effects of the media is used. We see that the choices for the nuclear matter compressibility, for the particles involved in Kaon and {lambda} creation process, or for the interaction potential with dense medium, appear to be

  19. Thermodynamic assessment of the Cu–Fe–Ni system

    International Nuclear Information System (INIS)

    Dreval, Liya A.; Turchanin, Mikhail A.; Agraval, Pavel G.

    2014-01-01

    Highlights: • The thermodynamic description of the Cu–Fe–Ni system has been updated. • The new experimental data have been used to refine thermodynamic model of the system. • The four-sublattice model has been adopted to predict the equilibria involving the ordered L1 2 phase. • A significant improvement in comparison with the previous assessments has been achieved. • The liquidus and solidus projections have been presented. -- Abstract: The thermodynamic description of the Cu–Fe–Ni system has been updated considering the newly available experimental data, as well as compatibility of the present modeling with those used for the Cu and Fe systems. All of the experimental data available in the literature have been critically reviewed, and the inconsistent information has been excluded. The thermodynamic parameters have been evaluated in order to properly describe the thermodynamic properties of the liquid phase and miscibility gap in the solid state. A significant improvement in comparison with the previous thermodynamic descriptions has been achieved. Additionally, for the ordered L1 2 phase the four-sublattice model has been adopted to predict the ternary phase equilibria involving this phase. A set of thermodynamic parameters for the phases is given

  20. Single-crystalline Ni2Ge/Ge/Ni2Ge nanowire heterostructure transistors.

    Science.gov (United States)

    Tang, Jianshi; Wang, Chiu-Yen; Xiu, Faxian; Hong, Augustin J; Chen, Shengyu; Wang, Minsheng; Zeng, Caifu; Yang, Hong-Jie; Tuan, Hsing-Yu; Tsai, Cho-Jen; Chen, Lih Juann; Wang, Kang L

    2010-12-17

    In this study, we report on the formation of a single-crystalline Ni(2)Ge/Ge/Ni(2)Ge nanowire heterostructure and its field effect characteristics by controlled reaction between a supercritical fluid-liquid-solid (SFLS) synthesized Ge nanowire and Ni metal contacts. Scanning electron microscopy (SEM) and transmission electron microscopy (TEM) studies reveal a wide temperature range to convert the Ge nanowire to single-crystalline Ni(2)Ge by a thermal diffusion process. The maximum current density of the fully germanide Ni(2)Ge nanowires exceeds 3.5 × 10(7) A cm(-2), and the resistivity is about 88 μΩ cm. The in situ reaction examined by TEM shows atomically sharp interfaces for the Ni(2)Ge/Ge/Ni(2)Ge heterostructure. The interface epitaxial relationships are determined to be [Formula: see text] and [Formula: see text]. Back-gate field effect transistors (FETs) were also fabricated using this low resistivity Ni(2)Ge as source/drain contacts. Electrical measurements show a good p-type FET behavior with an on/off ratio over 10(3) and a one order of magnitude improvement in hole mobility from that of SFLS-synthesized Ge nanowire.

  1. Synthesis and magnetic properties of multilayer Ni/Cu and NiFe/Cu ...

    Indian Academy of Sciences (India)

    (EV5 VSM, ADE Technologies) and MFM (D3100, Digital Instrument) were used to characterize the magnetic properties of these nanowires. 3. Discussion. The bamboo-like structure of Ni/Cu nanowires is shown in figure 1. From the. TEM micrograph the thickness of Ni layer and Cu layer are 400 nm and 50 nm, respectively.

  2. Eutectic superalloys strengthened by delta Ni3Cb lamellae, and gamma prime, Ni3Al precipitates.

    Science.gov (United States)

    Lemkey, F. D.; Thompson, E. R.

    1972-01-01

    Bivariant eutectic alloys, located on a liquidus surface within the Ni-Cb-Cr-Al quaternary, were identified which permitted the production of aligned delta Ni3Cb lamellae within a nichrome matrix containing the fcc precipitate gamma prime Ni3Al. The volume fraction of delta and gamma prime could be varied significantly by compositional changes. After directional solidification certain alloys possessed improved ductility and corrosion resistance with respect to the Ni3Al-Ni3Cb eutectic, while their values of tensile and creep strength approached or exceeded those for the Ni3Al-Ni3Cb pseudobinary system. The mechanical properties of the directionally solidified alloy, Ni-19.7 wt % Cb-6.0 wt % Cr-2.5 wt % Al, were evaluated. Its longitudinal strength in tension and creep was found to be superior to all advanced nickel base superalloys. It is thus demonstrated that useful properties for gas turbine airfoil applications can be achieved by reinforcing a strong and tough gamma nichrome matrix containing precipitated gamma prime by a strong lamellar intermetallic compound having greater strength at elevated temperature.

  3. Enhanced Electrocatalytic Activity for Water Splitting on NiO/Ni/Carbon Fiber Paper

    Directory of Open Access Journals (Sweden)

    Ruoyu Zhang

    2016-12-01

    Full Text Available Large-scale growth of low-cost, efficient, and durable non-noble metal-based electrocatalysts for water splitting is crucial for future renewable energy systems. Atomic layer deposition (ALD provides a promising route for depositing uniform thin coatings of electrocatalysts, which are useful in many technologies, including the splitting of water. In this communication, we report the growth of a NiO/Ni catalyst directly on carbon fiber paper by atomic layer deposition and report subsequent reduction and oxidation annealing treatments. The 10–20 nm NiO/Ni nanoparticle catalysts can reach a current density of 10 mA·cm−2 at an overpotential of 189 mV for hydrogen evolution reactions and 257 mV for oxygen evolution reactions with high stability. We further successfully achieved a water splitting current density of 10 mA·cm−2 at 1.78 V using a typical NiO/Ni coated carbon fiber paper two-electrode setup. The results suggest that nanoparticulate NiO/Ni is an active, stable, and noble-metal-free electrocatalyst, which facilitates a method for future water splitting applications.

  4. Adherencia al tratamiento en niñas y niños con VIH

    Directory of Open Access Journals (Sweden)

    Ana María Ruiz Navia

    2009-01-01

    Full Text Available Este artículo describe y determina el grado de adherencia al tratamiento en niños y niñas con VIH/ SIDA teniendo en cuenta los comportamientos y las variables asociadas a ésta. La muestra estuvo conformada por 1 niño y 5 niñas, diagnosticados con VIH, y su respectivo cuidador primario, quienes respondieron a la entrevista semiestructurada de evaluación de adherencia para niños y niñas con VIH/ SIDA ad hoc y a la entrevista semiestructurada de evaluación de adherencia para niños y niñas con VIH/SIDA versión cuidador primario ad hoc, respectivamente. Los resultados muestran la presencia de conductas de adherencia en los participantes del estudio, evidenciando la influencia de una serie de variables determinantes para este comportamiento. Cinco de los participantes cumplieron más del 95% de adherencia, mientras que uno se ubicó por debajo de este porcentaje. Como aspectos centrales se destacan la influencia de los estados emocionales en la toma del medicamento y la importancia del rol del cuidador primario en la adherencia.

  5. The Defining Characteristics of ENSO Extremes and the Strong 2015/2016 El Niño

    Science.gov (United States)

    Santoso, Agus; Mcphaden, Michael J.; Cai, Wenju

    2017-12-01

    The year 2015 was special for climate scientists, particularly for the El Niño Southern Oscillation (ENSO) research community, as a major El Niño finally materialized after a long pause since the 1997/1998 extreme El Niño. It was scientifically exciting since, due to the short observational record, our knowledge of an extreme El Niño has been based only on the 1982/1983 and 1997/1998 events. The 2015/2016 El Niño was marked by many environmental disasters that are consistent with what is expected for an extreme El Niño. Considering the dramatic impacts of extreme El Niño, and the risk of a potential increase in frequency of ENSO extremes under greenhouse warming, it is timely to evaluate how the recent event fits into our understanding of ENSO extremes. Here we provide a review of ENSO, its nature and dynamics, and through analysis of various observed key variables, we outline the processes that characterize its extremes. The 2015/2016 El Niño brings a useful perspective into the state of understanding of these events and highlights areas for future research. While the 2015/2016 El Niño is characteristically distinct from the 1982/1983 and 1997/1998 events, it still can be considered as the first extreme El Niño of the 21st century. Its extremity can be attributed in part to unusually warm condition in 2014 and to long-term background warming. In effect, this study provides a list of physically meaningful indices that are straightforward to compute for identifying and tracking extreme ENSO events in observations and climate models.

  6. Monte Carlo Simulations of Segregation in Pt-Ni Catalyst Nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Guofeng; Van Hove, Michel A.; Ross, Philip N.; Baskes, M.I.

    2004-04-01

    We have investigated the segregation of Pt atoms in the surfaces of Pt-Ni nanoparticles, using Modified Embedded Atom Model potentials and the Monte Carlo method. The nanoparticles are assumed to have disordered fcc configurations at two fixed overall concentrations (50 at. percent Pt and 75 at. percent Pt). We use four kinds of nanoparticle shapes [cube, tetrahedron, octahedron, and cubo-octahedron] terminated by {l_b