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Sample records for des elements zr

  1. Crystal structure of high-Zr inclusions in an alloy containing U, Pu, Np, Am, Zr and rare-earth elements

    SciTech Connect

    Dawn E. Janney; James W. Madden; J. Rory Kennedy; Thomas P. O'Holleran

    2014-05-01

    Researchers commonly observe high-Zr inclusions in actinide-Zr alloys. As there is very little published data on the crystal structures of these inclusions, it has generally been assumed that the inclusions were impurity-stabilized a-Zr. However, new electron-diffraction data from two high-Zr inclusions in an alloy containing U, Pu, Np, Am, Zr, and rare-earth elements show that these inclusions are not a-Zr (which has a hexagonal structure) but instead have a face-centered cubic structure. This data is unique in that it combines single-crystal diffraction patterns and microchemical analyses from individual inclusions. More data on other high-Zr inclusions is clearly required. However, the present results suggest that caution is needed in assuming that all high-Zr inclusions in actinide-Zr alloys are a-Zr.

  2. Effects of zirconium element on the microstructure and deuterium retention of W–Zr/Sc2O3 composites

    PubMed Central

    Chen, Hongyu; Luo, Laima; Chen, Jingbo; Zan, Xiang; Zhu, Xiaoyong; Xu, Qiu; Luo, Guangnan; Chen, Junling; Wu, Yucheng

    2016-01-01

    Dense W and W–Zr composites reinforced with Sc2O3 particles were produced through powder metallurgy and subsequent spark plasma sintering (SPS) at 1700 °C and 58 MPa. Results showed that the W–1vol.%Zr/2vol.%Sc2O3 composites exhibited optimal performance with the best relative density of up to 98.93% and high Vickers microhardness of approximately 583 Hv. The thermal conductivity of W–Zr/Sc2O3 composites decreased initially and then increased as the Zr content increased. The moderate Zr alloying element could combine well with Sc2O3 particles and W grains and form a solid solution. However, excess Zr element leads to agglomeration in the grain boundaries. W–1vol.%Zr/2vol.%Sc2O3 composite had a good deuterium irradiation resistance very closing to pure tungsten compared with the other Zr element contents of composites. Under 500 K, D2 retention and release of them were similar to those of commercial tungsten, even lower between 400 K to 450 K. Pre-irradiation with 5 keV-He+ ions to a fluence of 1 × 1021 He+/m2 resulted in an increase in deuterium retention (deuterium was implanted after He+ irradiation), thereby shifting the desorption peak to a high temperature from 550 K to 650 K for the W–1vol.%Zr/2vol.%Sc2O3 composite. PMID:27597314

  3. Am phases in the matrix of a U–Pu–Zr alloy with Np, Am, and rare-earth elements

    SciTech Connect

    Janney, Dawn E.; Kennedy, J. Rory; Madden, James W.; O’Holleran, Thomas P.

    2015-01-01

    Phases and microstructures in the matrix of an as-cast U-Pu-Zr alloy with 3 wt% Am, 2% Np, and 8% rare-earth elements were characterized by scanning and transmission electron microscopy. The matrix consists primarily of two phases, both of which contain Am: ζ-(U, Np, Pu, Am) (~70 at% U, 5% Np, 14% Pu, 1% Am, and 10% Zr) and δ-(U, Np, Pu, Am)Zr2 (~25% U, 2% Np, 10-15% Pu, 1-2% Am, and 55-60 at% Zr). These phases are similar to those in U-Pu-Zr alloys, although the Zr content in ζ-(U, Np, Pu, Am) is higher than that in ζ-(U, Pu) and the Zr content in δ-(U, Np, Pu, Am)Zr2 is lower than that in δ-UZr2. Nanocrystalline actinide oxides with structures similar to UO2 occurred in some areas, but may have formed by reactions with the atmosphere during sample handling. Planar features consisting of a central zone of ζ-(U, Np, Pu, Am) bracketed by zones of δ-(U, Np, Pu, Am)Zr2 bound irregular polygons ranging in size from a few micrometers to a few tens of micrometers across. The rest of the matrix consists of elongated domains of ζ-(U, Np, Pu, Am) and δ-(U, Np, Pu, Am)Zr2. Each of these domains is a few tens of nanometers across and a few hundred nanometers long. The domains display strong preferred orientations involving areas a few hundred nanometers to a few micrometers across.

  4. Experimental evidence for mobility of Zr and other trace elements in soils

    NASA Astrophysics Data System (ADS)

    Hodson, Mark E.

    2002-03-01

    A Soxhlet extraction was carried out over a period of 27 d on a column comprising 3 cm of quartz overlain by 4 cm of soil from the B horizon and then 1 cm of soil from the A horizon of a granitic podzol. Major and trace elements were leached from the column and accumulated in a reservoir at the base of the column. Total loss of elements from the soil over the course of the experiment ranged from 0.002 to 1 wt% with major elements and the light and heavy rare earth elements (REE) showing the largest percentage losses. Zirconium (0.002%) and then Al (0.008%) showed the lowest percentage loss. The light REE were leached out of the soil preferentially to the mid REE. All elements showed accumulation, by a factor of 2 to 11, in the quartz layers at the base of the column, particularly in the upper first 1 cm of the quartz. Major elements were leached from the column at a rate of 0.02 to 0.59 μmol h -1 whereas Zr, Nd, Sm, Gd, Dy, Rb, and Sr were leached at the rate of 0.5 to 30 × 10 -6 μmol h -1. Concentrations of other REE in the reservoir increased over the duration of the experiment, but they were poorly correlated with time, so leaching rates were not calculated. Normalization of the major element leaching rates to take into account the constant flushing of water through the column, the average annual rainfall in the Allt a'Mharcaidh catchment in Scotland from where the soil was sampled, and the cross-sectional area of the soil in the column, together with the temperature of the soil in the column (70°C) compared with the average annual temperature of the Allt a'Mharcaidh catchment (5.7°C), gave major element release rates from the soil of 0.002 to 0.97 mEq m -2 yr -1 (depending on the choice of E a, the dissolution activation energy), which are generally less than those measured in the field of 0.1 to 40.9 mEq m -2 yr -1. Calculations showed that despite the redistribution and loss of Zr from the column, assumptions of Zr mobility would have had a negligible

  5. Characterization of multi-principal-element (TiZrNbHfTa)N and (TiZrNbHfTa)C coatings for biomedical applications.

    PubMed

    Braic, V; Balaceanu, M; Braic, M; Vladescu, A; Panseri, S; Russo, A

    2012-06-01

    Multi-principal-element (TiZrNbHfTa)N and (TiZrNbHfTa)C coatings were deposited on Ti6Al4V alloy by co-sputtering of Ti, Zr, Nb, Hf and Ta metallic targets in reactive atmosphere. The coatings were analyzed for elemental and phase compositions, crystalline structure, morphology, residual stress, hardness, friction performance, wear-corrosion resistance and cell viability. For all the films, only simple fcc solid solutions with (111) preferred orientations were found, with crystallite sizes in the range 7.2-13.5 nm. The coatings were subjected to compressive stress, with values ranging from 0.8 to 1.6 GPa. The carbide coating with the highest carbon content (carbon/metal ≈1.3) exhibited the highest hardness of about 31 GPa, the best friction behavior (μ = 0.12) and the highest wear resistance (wear rate K=0.2×10(-6)mm(3)N(-1)m(-1)), when testing in simulated body fluids (SBFs). Cell viability tests proved that the osteoblast cells were adherent to the coated substrates, and a very high percentage of live cells were observed on sample surfaces, after 72 h incubation time.

  6. Reducing the Ideal Shear Strengths of ZrB2 by High Efficient Alloying Elements (Ag, Au, Pd and Pt).

    PubMed

    Dai, Fu-Zhi; Zhou, Yanchun

    2017-02-24

    Activating the plasticity of ZrB2 is a promising approach to improve its key properties for applications in hypersonic vehicles, including high temperature strength and thermal shock resistance. The present work demonstrates that ideal shear strength of ZrB2, which is a good indicator of the critical stress for dislocation nucleation, can be significantly reduced by dissolving of appropriate alloying elements. Analyzing on the bonding nature of ZrB2 reveals that choosing alloying elements with low energy valence electrons will prevent electron transferring from alloying element to the electron deficient B-B π orbits, which will reduce the local stability of the region surrounding the alloying element. Under the criterion, elements with d electrons tending to be full-filled (Ag, Au, Pd and Pt, the full-filled state is associated with low energy level) are selected as promising candidates with their prominent efficiency in reducing ideal shear strengths verified by first-principles calculations. The results provide useful guidelines for further designs of ZrB2 based materials, especially for improving their mechanical properties.

  7. Reducing the Ideal Shear Strengths of ZrB2 by High Efficient Alloying Elements (Ag, Au, Pd and Pt)

    NASA Astrophysics Data System (ADS)

    Dai, Fu-Zhi; Zhou, Yanchun

    2017-02-01

    Activating the plasticity of ZrB2 is a promising approach to improve its key properties for applications in hypersonic vehicles, including high temperature strength and thermal shock resistance. The present work demonstrates that ideal shear strength of ZrB2, which is a good indicator of the critical stress for dislocation nucleation, can be significantly reduced by dissolving of appropriate alloying elements. Analyzing on the bonding nature of ZrB2 reveals that choosing alloying elements with low energy valence electrons will prevent electron transferring from alloying element to the electron deficient B-B π orbits, which will reduce the local stability of the region surrounding the alloying element. Under the criterion, elements with d electrons tending to be full-filled (Ag, Au, Pd and Pt, the full-filled state is associated with low energy level) are selected as promising candidates with their prominent efficiency in reducing ideal shear strengths verified by first-principles calculations. The results provide useful guidelines for further designs of ZrB2 based materials, especially for improving their mechanical properties.

  8. Reducing the Ideal Shear Strengths of ZrB2 by High Efficient Alloying Elements (Ag, Au, Pd and Pt)

    PubMed Central

    Dai, Fu-Zhi; Zhou, Yanchun

    2017-01-01

    Activating the plasticity of ZrB2 is a promising approach to improve its key properties for applications in hypersonic vehicles, including high temperature strength and thermal shock resistance. The present work demonstrates that ideal shear strength of ZrB2, which is a good indicator of the critical stress for dislocation nucleation, can be significantly reduced by dissolving of appropriate alloying elements. Analyzing on the bonding nature of ZrB2 reveals that choosing alloying elements with low energy valence electrons will prevent electron transferring from alloying element to the electron deficient B-B π orbits, which will reduce the local stability of the region surrounding the alloying element. Under the criterion, elements with d electrons tending to be full-filled (Ag, Au, Pd and Pt, the full-filled state is associated with low energy level) are selected as promising candidates with their prominent efficiency in reducing ideal shear strengths verified by first-principles calculations. The results provide useful guidelines for further designs of ZrB2 based materials, especially for improving their mechanical properties. PMID:28233838

  9. Postirradiation examinations of U-Pu-Zr fuel elements from subassemblies X419 and X419A

    SciTech Connect

    Pahl, R G; Beck, W N; Hofman, G L; Lahm, C E; Villarreal, R

    1986-10-01

    Initial postirradiation examination of IFR type U-Pu-Zr fuel elements from X419 and X419A are reported. Characterization of the fuel at three levels of burnup, 0.8 at.%, 1.9 at.%, and 2.7 at.% is presented. Fuel swelling, microstructure, chemical redistribution, and fission gas behavior is discussed. No evidence was found for any performance-limiting damage to the fuel elements at these burnups.

  10. Galactic Cosmic Ray Origins and OB Associations: Evidence from SuperTIGER Observations of Elements 26Fe through 40Zr

    NASA Astrophysics Data System (ADS)

    Murphy, R. P.; Sasaki, M.; Binns, W. R.; Brandt, T. J.; Hams, T.; Israel, M. H.; Labrador, A. W.; Link, J. T.; Mewaldt, R. A.; Mitchell, J. W.; Rauch, B. F.; Sakai, K.; Stone, E. C.; Waddington, C. J.; Walsh, N. E.; Ward, J. E.; Wiedenbeck, M. E.

    2016-11-01

    We report abundances of elements from 26Fe to 40Zr in the cosmic radiation measured by the SuperTIGER (Trans-Iron Galactic Element Recorder) instrument during 55 days of exposure on a long-duration balloon flight over Antarctica. These observations resolve elemental abundances in this charge range with single-element resolution and good statistics. These results support a model of cosmic ray origin in which the source material consists of a mixture of {19}-6+11% material from massive stars and ∼81% normal interstellar medium material with solar system abundances. The results also show a preferential acceleration of refractory elements (found in interstellar dust grains) by a factor of ∼4 over volatile elements (found in interstellar gas) ordered by atomic mass (A). Both the refractory and volatile elements show a mass-dependent enhancement with similar slopes.

  11. Influence of alloying elements Nb, Zr, Sn, and oxygen on structural stability and elastic properties of the Ti2448 alloy

    NASA Astrophysics Data System (ADS)

    Dai, J. H.; Song, Y.; Li, W.; Yang, R.; Vitos, L.

    2014-01-01

    The mechanisms of how alloying elements and oxygen influence the stability and elastic properties of binary Ti-X (X = Nb, Zr, or Sn) and Ti2448 (Ti-24Nb-4Zr-8Sn in wt.%) alloys are studied via first principles calculations. In addition to the fully disordered solid solution phase, we consider 44 quasirandom configurations to search for the possible distributions of the alloying elements in Ti2448. Our results show that all alloying elements considered here are good β-stabilizers for Ti, and the formation energies are greatly affected by their distributions. The site preference of oxygen and its concentration dependence in binary Ti alloys and in Ti2448 are also investigated. Oxygen prefers to occupy the octahedral site regardless of the concentrations of the alloys and strongly interacts with Ti and Nb in Ti-Nb. The elastic properties of Ti2448 alloy and the influence of oxygen on the elastic parameters are evaluated. The calculated polycrystalline Young's modulus of the Ti2448 alloy is very close to that of the human bone (10-40 GPa). We find that oxygen has a weak effect on the elastic moduli of Ti2448. The electronic structures are analyzed to reveal how the alloying elements and oxygen influence the stability of binary Ti-X and Ti2448 alloys.

  12. Methode des elements finis hybride appliquee aux vibrations des coques spheriques

    NASA Astrophysics Data System (ADS)

    Menaa, Mohamed

    The analysis of spherical shells filled with fluid and subjected to supersonic flow has been the subject of few research. Most of these studies treat the dynamic behaviour of empty shells. Few works have investigated spherical shells filled with fluid or subjected to supersonic flutter. In this thesis, we propose to develop a model to analyse the vibratory behaviour of both empty spherical shells and partially filled with fluid. This model is also applicable to study of the dynamic stability of spherical shells subjected to supersonic flow. The model developed is a combination of finite element method, thin shell theory, potential fluid theory and aerodynamic fluid theory. Different parameters are considered here in this study. In the first part of this study, free vibration analysis of spherical shell is carried out. The structural model is based on a combination of thin shell theory and the classical finite element method. Free vibration equations using the hybrid finite element formulation are derived and solved numerically. The results are validated using numerical and theoretical data available in the literature. The analysis is accomplished for spherical shells of different geometries, boundary conditions and radius to thickness ratios. This proposed hybrid finite element method can be used efficiently for design and analysis of spherical shells employed in high speed aircraft structures. In the second part of the present study, a hybrid finite element method is applied to investigate the free vibration of spherical shell filled with fluid. The structural model is based on a combination of thin shell theory and the classical finite element method. It is assumed that the fluid is incompressible and has no free-surface effect. Fluid is considered as a velocity potential variable at each node of the shell element where its motion is expressed in terms of nodal elastic displacement at the fluid-structure interface. Numerical simulation is done and vibration

  13. Compressive Strength Evaluation in Brazed ZrO2/Ti6Al4V Joints Using Finite Element Analysis

    NASA Astrophysics Data System (ADS)

    Sharma, Ashutosh; Kee, Se Ho; Jung, Flora; Heo, Yongku; Jung, Jae Pil

    2016-05-01

    This study aims to synthesize and evaluate the compressive strength of the ZrO2/Ti-6Al-4V joint brazed using an active metal filler Ag-Cu-Sn-Ti, and its application to dental implants assuring its reliability to resist the compressive failure in the actual oral environment. The brazing was performed at a temperature of 750 °C for 30 min in a vacuum furnace under 5 × 10-6 Torr atmosphere. The microstructure of the brazed joint showed the presence of an Ag-rich matrix and a Cu-rich phase, and Cu-Ti intermetallic compounds were observed along the Ti-6Al-4V bonded interface. The compressive strength of the brazed ZrO2/Ti-6Al-4V joint was measured by EN ISO 14801 standard test method. The measured compressive strength of the joint was ~1477 MPa—a value almost five times that of existing dental cements. Finite element analysis also confirmed the high von Mises stress values. The compressive strains in the samples were found concentrated near the Ti-6Al-4V position, matching with the position of the real fractured sample. These results suggest extremely significant compressive strength in ZrO2/Ti-6Al-4V joints using the Ag-Cu-Sn-Ti filler. It is believed that a highly reliable dental implant can be processed and designed using the results of this study.

  14. Effects of alloying elements on the formation of < c >-component loops in Zr alloy Excel under heavy ion irradiation.

    SciTech Connect

    Idrees, Yasir; Francis, Elisabeth M.; Yao, Zhongwen; Korinek, Andreas; Kirk, Marquis A.; Sattari, Mohammad; Preuss, Michael; Daymond, M. R.

    2015-05-14

    We report here the microstructural changes occurring in the zirconium alloy Excel (Zr-3.5 wt% Sn-0.8Nb-0.8Mo-0.2Fe) during heavy ion irradiation. In situ irradiation experiments were conducted at reactor operating temperatures on two Zr Excel alloy microstructures with different states of alloying elements, with the states achieved by different solution heat treatments. In the first case, the alloying elements were mostly concentrated in the beta (beta) phase, whereas, in the second case, large Zr-3(Mo,Nb,Fe)(4) secondary phase precipitates (SPPs) were grown in the alpha (alpha) phase by long term aging. The heavy ion induced damage and resultant compositional changes were examined using transmission electron microscopy (TEM) in combination with scanning transmission electron microscope (STEM)-energy dispersive x-ray spectroscopy (EDS) mapping. Significant differences were seen in microstructural evolution between the two different microstructures that were irradiated under similar conditions. Nucleation and growth of < c >-component loops and their dependence on the alloying elements are a major focus of the current investigation. It was observed that the < c >-component loops nucleate readily at 100, 300, and 400 degrees C after a threshold incubation dose (TID), which varies with irradiation temperature and the state of alloying elements. It was found that the TID for the formation of < c >-component loops increases with decrease in irradiation temperature. Alloying elements that are present in the form of SPPs increase the TID compared to when they are in the beta phase solid solution. Dose and temperature dependence of loop size and density are presented. Radiation induced redistribution and clustering of alloying elements (Sn, Mo, and Fe) have been observed and related to the formation of < c >-component loops. It has been shown that at the higher temperature tests, irradiation induced dissolution of precipitates occurs whereas irradiation induced

  15. Optimization of ultra-soft CoZrTa/SiO2/CoZrTa trilayer elements for integrated inductor structures

    NASA Astrophysics Data System (ADS)

    Cheng, Cheng; Davies, Ryan; Sturcken, Noah; Shepard, Kenneth; Bailey, William E.

    2013-05-01

    We show the optimization of magnetic properties of ferromagnetic (FM)/SiO2/FM trilayer structures as potential candidates for the magnetic core in toroidal integrated inductors, with FM materials Co91.5Zr4.0Ta4.5 (CZT) and Ni80Fe20 (Py). In the single-layer parent films, we found a monotonic reduction of easy-axis coercivity (Hc down to 0.17 Oe in CZT, 0.4 Oe in Py) with increasing dc magnetron sputtering voltage. In the trilayer rectangular structures, with induced easy-axis in the short lateral dimension, we found proof of dipolar coupling between the two FM layers from BH loop measurements in the CZT system, showing linear response with minimal hysteresis loss when the external field is applied in the long axis. Py elements did not show this optimized property. Further investigation of domain configurations using scanning transmission x-ray microscopy suggests an insufficient induced anisotropy in Py compared with the shape anisotropy to realize the antiparallel-coupled state.

  16. DOSAGE DES ELEMENTS EN TRACE DES CALCAIRES AU SERVICE DE L'ARCHEOLOGIE

    SciTech Connect

    BLANC,A.; HOLMES,L.; HARBOTTLE,G.

    1998-05-01

    Numerous quarries in the Lutetian limestone formations of the Paris Basin provided stone for the building and the decoration of monuments from antiquity to the present. To determine the origin of stone used for masonry and sculptures in these monuments, a team of geologists and archaeologists has investigated 300 quarries and collected 2,300 samples. Petrographic and paleontologic examination of thin sections allows geologists to distinguish Lutetian limestones from Jurassic and Cretaceous limestones. Geologists also seek to formulate hypotheses regarding the origin of Lutetian limestones used for building and sculpture in the Paris region. In the search for the sources of building and sculptural stone, the analytical methods of geologists are limited because often several quarries produce the same lithofacies. A new tool is now available, however, to attack questions of provenance raised by art historians. Because limestones from different sources have distinctive patterns of trace-element concentrations, compositional analysis by neutron activation allows them to compare building or sculptural stone from one monument with stone from quarries or other monuments. This analytical method subjects a powdered limestone sample to standard neutron activation analysis procedures at Brookhaven National Laboratory. With the help of computer programs, the compositional fingerprints of Lutetian limestones can be determined and stored in a database. The limestone database contains data for approximately 2,100 samples from monuments, sculptures and quarries. It is particularly rich in samples from the Paris Basin.

  17. Origin of the satellites Lα6 and Lα7 in the elements 40Zr to 50Sn

    NASA Astrophysics Data System (ADS)

    Kendurkar, Renuka; Shrivastava, B. D.

    2016-10-01

    The origin of the satellites Lα6 and Lα7 have been explained in the elements from 40Zr to 50Sn. The energies and the intensities of the various transitions corresponding to the L3Mx - MxM4,5 (where x = 1-5) transition array, which may give rise to these satellites, have been calculated theoretically. The transition energies have been calculated using the available Hartree-Fock-Slater data for K-LM and L-MM Auger transition energies. The intensities of the various transitions have been estimated by considering cross sections L1-L3MX for Coster- Kronig transitions as well as for M-shell shake-off process occurring simultaneous to a L3 hole creation. The total cross sections for initial two-hole states have been then distributed statistically amongst various allowed transitions from the initial states L3Mx to the final states MxM4,5. Each transition has been assumed to give rise to a Gaussian line and then the theoretical satellite spectrum has been computed by summing up these Gaussian lines. The calculated energies have been found to be comparable with the measured energies of the satellites Lα6 and Lα7. Consequently, the transitions which give rise to these satellites have been identified. The satellite Lag has been assigned the transition 3D2L3M3 - 3F3M3M5 and the satellite Lα7 the transition 3PqL3M3 - 3P1M3M5 in all the elements from 40Zr to 50Sn.

  18. The atomic-scale mechanism for the enhanced glass-forming-ability of a Cu-Zr based bulk metallic glass with minor element additions

    NASA Astrophysics Data System (ADS)

    Wang, Q.; Liu, C. T.; Yang, Y.; Liu, J. B.; Dong, Y. D.; Lu, J.

    2014-04-01

    It is known that the glass forming-ability (GFA) of bulk metallic glasses (BMGs) can be greatly enhanced via minor element additions. However, direct evidence has been lacking to reveal its structural origin despite different theories hitherto proposed. Through the high-resolution transmission-electron-microscopy (HRTEM) analysis, here we show that the content of local crystal-like orders increases significantly in a Cu-Zr-Al BMG after a 2-at% Y addition. Contrasting the previous studies, our current results indicate that the formation of crystal-like order at the atomic scale plays an important role in enhancing the GFA of the Cu-Zr-Al base BMG.

  19. Trace element composition of rutile and Zr-in-rutile thermometry in meta-ophiolitic rocks from the Kazdağ Massif, NW Turkey

    NASA Astrophysics Data System (ADS)

    Şengün, Fırat; Zack, Thomas

    2016-08-01

    In northwest Turkey, ophiolitic meta-gabbros are exposed on the Kazdağ Massif located in the southern part of the Biga Peninsula. Trace element composition of rutile and Zr-in-rutile temperatures were determined for meta-gabbros from the Kazdağ Massif. The Zr content of all rutiles range from 176 to 428 ppm and rutile grains usually have a homogeneous Zr distribution. The rutile grains from studied samples in the Kazdağ Massif are dominated by subchondritic Nb/Ta (11-19) and Zr/Hf ratios (20-33). Nb/Ta and Zr/Hf show positive correlation, which is probably produced by silicate fractionation. The Nb/Ta and Zr/Hf ratios increase with a decrease in Ta and Hf contents. The core of rutile grains are generally characterized by low Nb/Ta ratios of 17-18 whereas the rims exhibit relatively high Nb/Ta ratios of 19-23. Trace element analyses in rutile suggest that these rutile grains were grown from metamorphic fluids. The P-T conditions of meta-gabbros were estimated by both Fe-Mg exchange and Zr-in-rutile thermometers, as well as by the Grt-Hb-Plg-Q geothermobarometer. The temperature range of 639 to 662 °C calculated at 9 kbar using the Zr-in-rutile thermometer is comparable with temperature estimates of the Fe-Mg exchange thermometer, which records amphibolite-facies metamorphism of intermediate P-T conditions. The P-T conditions of meta-ophiolitic rocks suggest that they occur as a different separate higher-pressure tectonic slice in the Kazdağ metamorphic sequence. Amphibolite-facies metamorphism resulted from northward subduction of the İzmir-Ankara branch of the Neo-Tethyan Ocean under the Sakarya Zone. Metamorphism was followed by internal imbrication of the Kazdağ metamorphic sequence resulting from southerly directed compression during the collision.

  20. SEM in situ MiniCantilever Beam Bending of U-10Mo/Zr/Al Fuel Elements

    SciTech Connect

    Mook, William; Baldwin, Jon K.; Martinez, Ricardo M.; Mara, Nathan A.

    2014-06-16

    In this work, the fracture behavior of Al/Zr and Zr/dU-10Mo interfaces was measured via the minicantilever bend technique. The energy dissipation rates were found to be approximately 3.7-5 mj/mm2 and 5.9 mj/mm2 for each interface, respectively. It was found that in order to test the Zr/U-10Mo interface, location of the hinge of the cantilever was a key parameter. While this test could be adapted to hot cell use through careful alignment fixturing and measurement of crack lengths with an optical microscope (as opposed to SEM, which was used here out of convenience), machining of the cantilevers via MiniMill in such a way as to locate the interfaces at the cantilever hinge, as well as proper placement of a femtosecond laser notch will continue to be key challenges in a hot cell environment.

  1. A Method to Increase Current Density in a Mono Element Internal Tin Processed Superconductor Utilizing Zr Oxide to Refine Grain Size

    SciTech Connect

    Bruce A. Zeitlin, Eric Gregory

    2008-04-07

    The effect of Oxygen on (Nb1Zr)3Sn multifilament conductors manufactured by the Mono Element Internal Tin (MEIT) process was explored to improve the current density by refining the grain size. This followed work first done by General Electric on the Nb3Sn tape process. Techniques to fabricate the more difficult Nb1Zr composites are described and allowed fabrication of long lengths of .254 mm diameter wire from an 88.9 mm diameter billet. Oxygen was incorporated through the use of SnO2 mixed with tin powder and incorporated into the core. These were compared to samples with Ti+Sn and Cu+Sn cores. Heat treatments covered the range of 700 C to 1000 C. Current density vs. H, grain size, and reaction percentages are provided for the materials tested. The Oxygen gave superior results in the temperature range of 815-1000 C. It also stabilized the filament geometry of the array in comparison to the other additions at the higher temperatures. At 815 C a peak in layer Jc yielded values of 2537 A/mm2 at 12 T and 1353 A/mm2 at 15T, 8-22% and 30-73% greater respectively than 700 C values. Results with Oxygen at high temperature show the possibility of high speed continuous reaction of the composite versus the current batch or react in place methods. In general the Ti additions gave superior results at the lower reaction temperature. Future work is suggested to determine if the 815 C reaction temperature can lead to higher current density in high tin (Nb1Zr+Ox)3Sn conductors. A second technique incorporated oxygen directly into the Nb1Zr rods through heat treatment with Nb2O5 at 1100 C for 100 hours in vacuum prior to extrusion. The majority of the filaments reduced properly in the composite but some local variations in hardness led to breakage at smaller diameters.

  2. Mechanical Properties of Low-Density, Refractory Multi-Principal Element Alloys of the Cr-Nb-Ti-V-Zr System (Postprint)

    DTIC Science & Technology

    2014-04-01

    of high temperature properties, including reduced density, superior to existing Ni base superalloys or refractory alloys . Recently a high entropy ...CrMo0.5NbTa0.5TiZr [8,9]. The first three alloys are single phase with a BCC crystal structure, probably due to high entropy of mixing and similar atomic radii of...design strategies used to predict stable high entropy alloys suggest [10,11] that this is the result of adding an element, Cr, which has a much

  3. Influence of residual pressure and ion implantation on the structure, elemental composition, and properties of (TiZrAlYNb)N nitrides

    NASA Astrophysics Data System (ADS)

    Pogrebnjak, A. D.; Yakushchenko, I. V.; Sobol', O. V.; Beresnev, V. M.; Kupchishin, A. I.; Bondar, O. V.; Lisovenko, M. A.; Amekura, H.; Kono, K.; Oyoshi, K.; Takeda, Y.

    2015-08-01

    The nitrides of high-entropy alloys, (TiZrAlYNb)N, fabricated by cathodic vacuum arc evaporation are studied with electron microscopy, atomic force microscopy, laser scanning microscopy; energy-dispersive X-ray analysis, X-ray phase analysis, time-of-flight secondary-ion mass spectrometry; and hardness measurements. It is found that the deposition parameters influence the structure, surface morphology, element distribution, and mechanical properties. The structural—phase state of the coatings before and after the ion implantation of heavy negative gold ions Au- are compared.

  4. Ion irradiation induced element-enriched and depleted nanostructures in Zr-Al-Cu-Ni metallic glass

    SciTech Connect

    Chen, H. C.; Liu, R. D.; Yan, L. E-mail: zhouxingtai@sinap.ac.cn; Zhou, X. T. E-mail: zhouxingtai@sinap.ac.cn; Cao, G. Q.; Wang, G.

    2015-07-21

    The microstructural evolution of a Zr-Al-Cu-Ni metallic glass induced by irradiation with Ar ions was investigated. Under ion irradiation, the Cu- and Ni-enriched nanostructures (diameter of 30–50 nm) consisted of crystalline and amorphous structures were formed. Further, Cu- and Ni-depleted nanostructures with diameters of 5–20 nm were also observed. The formation of these nanostructures can be ascribed to the migration of Cu and Ni atoms in the irradiated metallic glass.

  5. First determination of s-process element abundances in pre-main sequence clusters. Y, Zr, La, and Ce in IC 2391, the Argus association, and IC 2602

    NASA Astrophysics Data System (ADS)

    D'Orazi, V.; De Silva, G. M.; Melo, C. F. H.

    2017-02-01

    Context. Several high-resolution spectroscopic studies have provided compelling observational evidence that open clusters display a decreasing trend of their barium abundances as a function of the cluster's age. Young clusters (ages ≲ 200 Myr) exhibit significant enhancement in the [Ba/Fe] ratios, at variance with solar-age clusters where the Ba content has been found to be [Ba/Fe] 0 dex. Different viable solutions have been suggested in the literature; nevertheless, a conclusive interpretation of such a peculiar trend has not been found. Interestingly, it is debated whether the other species produced with Ba via s-process reactions follow the same trend with age. Aims: Pre-main sequence clusters (≈10-50 Myr) show the most extreme behaviour in this respect: their [Ba/Fe] ratios can reach 0.65 dex, which is higher than the solar value by a factor of four. Crucially, there are no investigations of the other s-process species for these young stellar populations. In this paper we present the first determination of Y, Zr, La, and Ce in clusters IC 2391, IC 2602, and the Argus association. The main objective of our work is to ascertain whether these elements reveal the same enhancement as Ba. Methods: We have exploited high-resolution, high signal-to-noise spectra in order to derive abundances for Y, Zr, La, and Ce via spectral synthesis calculations. Our sample includes only stars with very similar atmospheric parameters so that internal errors due to star-to-star inhomogeneity are negligible. The chemical analysis was carried out in a strictly differential way, as done in all our previous investigations, to minimise the impact of systematic uncertainties. Results: Our results indicate that, at variance with Ba, all the other s-process species exhibit a solar scaled pattern; these clusters confirm a similar trend discovered in the slightly older local associations (e.g. AB Doradus, Carina-Near), where only Ba exhibit enhanced value with all other s-process species

  6. Theoretical predictions of properties and volatility of chlorides and oxychlorides of group-4 elements. I. Electronic structures and properties of MCl₄ and MOCl₂ (M = Ti, Zr, Hf, and Rf).

    PubMed

    Pershina, V; Borschevsky, A; Iliaš, M

    2014-08-14

    Relativistic, infinite order exact two-component, density functional theory electronic structure calculations were performed for MCl4 and MOCl2 of group-4 elements Ti, Zr, Hf, and element 104, Rf, with the aim to predict their behaviour in gas-phase chromatography experiments. RfCl4 and RfOCl2 were shown to be less stable than their lighter homologs in the group, tetrachlorides and oxychlorides of Zr and Hf, respectively. The oxychlorides turned out to be stable as a bent structure, though the stabilization energy with respect to the flat one (C(2v)) is very small. The trend in the formation of the tetrachlorides from the oxychlorides in group 4 is shown to be Zr < Hf < Rf, while the one in the formation of the oxychlorides from the chlorides is opposite. All the calculated properties are used to estimate adsorption energy of these species on various surfaces in order to interpret results of gas-phase chromatography experiments, as is shown in Paper II.

  7. Theoretical predictions of properties and volatility of chlorides and oxychlorides of group-4 elements. I. Electronic structures and properties of MCl{sub 4} and MOCl{sub 2} (M = Ti, Zr, Hf, and Rf)

    SciTech Connect

    Pershina, V.; Borschevsky, A.; Iliaš, M.

    2014-08-14

    Relativistic, infinite order exact two-component, density functional theory electronic structure calculations were performed for MCl{sub 4} and MOCl{sub 2} of group-4 elements Ti, Zr, Hf, and element 104, Rf, with the aim to predict their behaviour in gas-phase chromatography experiments. RfCl{sub 4} and RfOCl{sub 2} were shown to be less stable than their lighter homologs in the group, tetrachlorides and oxychlorides of Zr and Hf, respectively. The oxychlorides turned out to be stable as a bent structure, though the stabilization energy with respect to the flat one (C{sub 2v}) is very small. The trend in the formation of the tetrachlorides from the oxychlorides in group 4 is shown to be Zr < Hf < Rf, while the one in the formation of the oxychlorides from the chlorides is opposite. All the calculated properties are used to estimate adsorption energy of these species on various surfaces in order to interpret results of gas-phase chromatography experiments, as is shown in Paper II.

  8. Properties of ZrB2 Thin Films Grown by E-Beam Evaporation

    NASA Astrophysics Data System (ADS)

    Lad, Robert; Stewart, David; Sell, Julia; Bernhardt, George; Frankel, David; University of Maine Team

    2014-03-01

    Zirconium diboride (ZrB2) is a candidate material for many high temperature applications because it has a high melting point, high hardness, thermal shock resistance, and metallic conductivity. However, very little work has been reported concerning growth of ZrB2 thin films and high temperature oxidation behavior. In this study, ZrB2 films with nominal thickness of 200 nm have been deposited using electron-beam evaporation of either ZrB2 pellets or elemental B and Zr sources. The ZrB2 source yields a film that has a 1:1 Zr:B average composition as measured by X-ray photoelectron spectroscopy, consisting of ZrB2 precipitates within an amorphous Zr matrix as determined by X-ray diffraction. Use of elemental B and Zr sources allows precise control of film growth over a range of stoichiometries and yields ZrB2 films with much lower oxygen contamination. After annealing ZrB2 films to 1200°C in air, oxidation leads to a loss of B and formation of a textured monoclinic ZrO2 phase. Several strategies, including deposition of a thin Al2O3 capping layer over the ZrB2 film are being pursued in an attempt to stabilize the electrically conductive ZrB2 phase at high temperature, where it can be used for high temperature electronic devices in harsh environments. Supported by NSF grant # 1309983.

  9. Transient electromagnetic modeling of the ZR accelerator water convolute and stack.

    SciTech Connect

    Lehr, Jane Marie; Elizondo-Decanini, Juan Manuel; Turner, C. David; Coats, Rebecca Sue; Bohnhoff, William J.; Pointon, Timothy David; Pasik, Michael Francis; Johnson, William Arthur; Savage, Mark Edward

    2005-06-01

    The ZR accelerator is a refurbishment of Sandia National Laboratories Z accelerator [1]. The ZR accelerator components were designed using electrostatic and circuit modeling tools. Transient electromagnetic modeling has played a complementary role in the analysis of ZR components [2]. In this paper we describe a 3D transient electromagnetic analysis of the ZR water convolute and stack using edge-based finite element techniques.

  10. Etude des Abondances de MG et de fe dans la Composante Stellaire des Disques des Galaxies Spirales

    NASA Astrophysics Data System (ADS)

    Beauchamp, Dominique

    Je presente ici une technique d'observation par imagerie des disques stellaires des galaxies spirales. Je tente, a l'aide d'un modele evolutif multiphase, de determiner les abondances de fer et de magnesium dans les disques. Dans ce but, je mesure les indices Mg2 et Fe5270 du systeme de Lick. Ces elements representent un choix judicieux d'indicateurs car ils sont formes par des supernovae de deux types differents ayant des durees de vie differentes. Le rapport d'abondances de ces deux elements est un indicateur du taux de formation des populations stellaires. Je decris, en premier lieu, les observations, la technique de mesure, ainsi que son application. J'analyse ensuite les indices mesures. A partir du modele multiphase, j'explore differents parametres physiques des spirales comme le taux de formation stellaire, l'evolution des abondances, les effets possibles de la presence de la barre, etc.

  11. Exploration of R2XM2 (R=Sc, Y, Ti, Zr, Hf, rare earth; X=main group element; M=transition metal, Si, Ge): Structural Motifs, the novel Compound Gd2AlGe2 and Analysis of the U3Si2 and Zr3Al2 Structure Types

    SciTech Connect

    McWhorter, Sean William

    2006-01-01

    In the process of exploring and understanding the influence of crystal structure on the system of compounds with the composition Gd5(SixGe1-x)4 several new compounds were synthesized with different crystal structures, but similar structural features. In Gd5(SixGe1-x)4, the main feature of interest is the magnetocaloric effect (MCE), which allows the material to be useful in magnetic refrigeration applications. The MCE is based on the magnetic interactions of the Gd atoms in the crystal structure, which varies with x (the amount of Si in the compound). The crystal structure of Gd5(SixGe1-x)4 can be thought of as being formed from two 32434 nets of Gd atoms, with additional Gd atoms in the cubic voids and Si/Ge atoms in the trigonal prismatic voids. Attempts were made to substitute nonmagnetic atoms for magnetic Gd using In, Mg and Al. Gd2MgGe2 and Gd2InGe2 both possess the same 32434 nets of Gd atoms as Gd5(SixGe1-x)4, but these nets are connected differently, forming the Mo2FeB2 crystal structure. A search of the literature revealed that compounds with the composition R2XM2 (R=Sc, Y, Ti, Zr, Hf, rare earth; X=main group element; M=transition metal, Si, Ge) crystallize in one of four crystal structures: the Mo2FeB2, Zr3Al2, Mn2AlB2 and W2CoB2 crystal structures. These crystal structures are described, and the relationships between them are highlighted. Gd2AlGe2 forms an entirely new crystal structure, and the details of its synthesis and characterization are given. Electronic structure calculations are performed to understand the nature of bonding in this compound and how

  12. Trace element distribution coefficients in alkaline series. [Titanites; bitite

    SciTech Connect

    Lemarchand, F.; Villemant, B.; Calas, G.

    1987-05-01

    Mineral/groundmass partition coefficients for U, Th, Zr, Hf, Ta, Rb, REE, Co and Sc have been systematically measured in olivine, clinopyroxene, amphibole, biotite, Ti-magnetites, titanite, zircon and feldspars, in basaltic to trachytic lavas from alkaline series (Velay, Chaine des Puys: Massif Central, France and Fayal: Azores). Average partition coefficients are defined within the experimental uncertainty for limited compositional ranges (basalt-hawaiite, mugearites, benmoreite-trachyte), and are useful for trace element modelling. The new results for U, Th, Ta, Zr and Hf partition coefficients show contrasting behaviour. They can thus be used as ''key elements'' for identifying fractionating mineral phases in differentiation processes (e.g. Ta and Th for amphibole and mica). Partition coefficient may be calculated using the two-lattice model suggested by NIELSEN (1985). Such values show a considerably reduced chemical dependence in natural systems, relative to weight per cent D values. The residual variations may be accounted for by temperature or volatile influence. This calculation greatly enhances modelling possibilities using trace elements for comparing differentiation series as well as for predicting the behaviour of elements during magmatic differentiation.

  13. Performance of U-Pu-Zr fuel cast into zirconium molds

    SciTech Connect

    Crawford, D.C.; Lahm, C.E. ); Tsai, H. )

    1992-10-01

    U-3Zr and U-20.5Pu-3Zr were injection cast into Zr tubes, or sheaths, rather than into quartz molds and clad in 316SS. These elements and standard-cast U-l0Zr and U-IgPu-l0Zr elements were irradiated in EBR-II to 2 at.% and removed for interim examination. Measurements of axial growth at indicate that the Zr-sheathed elements exhibited significantly less axial elongation than the standard-cast elements (1.3 to 1.8% versus 4.9 to 8.1%). Fuel material extruded through the ends of the Zr sheaths. allowing the low-Zr fuel to contact the cladding in some cases. Transverse metallographic sections reveal cracks in the Zr sheath through which fuel extruded and contacted cladding. The sheath is not a sufficient barrier between fuel and cladding to reduce FCCI. and any adverse effects due to increased FCCI will be evident as the elements attain higher burnup.

  14. Theoretical predictions of properties and volatility of chlorides and oxychlorides of group-4 elements. II. Adsorption of tetrachlorides and oxydichlorides of Zr, Hf, and Rf on neutral and modified surfaces.

    PubMed

    Pershina, V; Borschevsky, A; Iliaš, M; Türler, A

    2014-08-14

    With the aim to interpret results of gas-phase chromatography experiments on volatility of group-4 tetrachlorides and oxychlorides including those of Rf, adsorption enthalpies of these species on neutral, and modified quartz surfaces were estimated on the basis of relativistic, two-component Density Functional Theory calculations of MCl4, MOCl2, MCl6(-), and MOCl4(2) with the use of adsorption models. Several mechanisms of adsorption were considered. In the case of physisorption of MCl4, the trend in the adsorption energy in the group should be Zr > Hf > Rf, so that the volatility should change in the opposite direction. The latter trend complies with the one in the sublimation enthalpies, ΔH(sub), of the Zr and Hf tetrachlorides, i.e., Zr < Hf. On the basis of a correlation between these quantities, ΔH(sub)(RfCl4) was predicted as 104.2 kJ/mol. The energy of physisorption of MOCl2 on quartz should increase in the group, Zr < Hf < Rf, as defined by increasing dipole moments of these molecules along the series. In the case of adsorption of MCl4 on quartz by chemical forces, formation of the MOCl2 or MOCl4(2-) complexes on the surface can take place, so that the sequence in the adsorption energy should be Zr > Hf > Rf, as defined by the complex formation energies. In the case of adsorption of MCl4 on a chlorinated quartz surface, formation of the MCl6(2-) surface complexes can occur, so that the trend in the adsorption strength should be Zr ≤ Hf < Rf. All the predicted sequences, showing a smooth change of the adsorption energy in the group, are in disagreement with the reversed trend Zr ≈ Rf < Hf, observed in the "one-atom-at-a-time" gas-phase chromatography experiments. Thus, currently no theoretical explanation can be found for the experimental observations.

  15. Studies regarding the homogeneity range of the zirconium phosphide telluride Zr 2+δPTe 2

    NASA Astrophysics Data System (ADS)

    Tschulik, Kristina; Hoffmann, Stefan; Fokwa, Boniface P. T.; Gilleßen, Michael; Schmidt, Peer

    2010-12-01

    The phosphide tellurides Zr 2+ δPTe 2 (0 ≤ δ ≤ 1) can be synthesized from the elements in a solid state reaction or by thermal decomposition of Z. Zr 2PTe 2 decomposes under release of Te 2(g) + P 4(g) forming the homogeneity range Zr 2+ δPTe 2. The growth of single crystals of Zr 2+δPTe 2 succeeded by chemical vapour transport using iodine as transport agent from 830 °C in direction of higher temperatures up to 900 °C. Zr 2+ δPTe 2 crystallizes in the rhombohedral space group R3¯m (no. 166) with lattice parameters a = 383(1)…386(1) pm and c = 2935(4)…2970(4) pm for δ = 0…1, respectively. Single crystal data have been determined for Zr 2.40(2)PTe 2 with lattice parameters a = 385.24(4) pm and c = 2967.8(4) pm. The electronic structure and chemical bonding in Zr 2+ δPTe 2 was investigated by the linear muffin-tin orbital (LMTO) method. Both Zr 2PTe 2 and Zr 3PTe 2 show non-vanishing DOS values at the Fermi level ( EF) indicating metallic character. According to COHP bonding analyses, mainly the heteroatomic Zr-P and Zr-Te bonds are responsible for the structural stability of Zr 3PTe 2. The new Zr2-Te bond, which is not present in Zr 2PTe 2, is stronger than Zr1-Te and is thought to be responsible for the stability of phases having Zr in excess.

  16. Thermal Analysis of the Effect of Oxygen Contamination on Undercooling of Zr-Al-Ni-Cu, Cu-Zr-Ti, and Cu-Ni-Zr-Ti Metallic Glasses (Preprint)

    DTIC Science & Technology

    2009-04-01

    been done on systems other than Zr65Al7.5(Cu17.5Ni10). Zr55Al10(Cu30Ni5) was found to be less sensitive to oxygen content than Zr65Al7.5(Cu17.5Ni10...Zr11Ti34 by arc-melting each of the pure elements under a titanium - gettered atmosphere. Starting materials used were: Al pellets, 99.999%; Cu shot...produce 2-6 g alloyed ingots of each composition. Each ingot was flipped typically 4-5 times in a titanium -gettered, high-purity argon atmosphere

  17. Etude des effets du martelage repetitif sur les contraintes residuelles

    NASA Astrophysics Data System (ADS)

    Hacini, Lyes

    L'assemblage par soudage peut engendrer des contraintes residuelles. Ces contraintes provoquent des fissurations prematurees et un raccourcissement de la duree de vie des composants. Dans ce contexte, le martelage robotise est utilise pour relaxer ces contraintes residuelles. Trois volets sont presentes: le premier est l'evaluation des effets des impacts unitaires repetes sur le champ de contraintes developpe dans des plaques d'acier inoxydable austenitique 304L vierges ou contenant des contraintes residuelles initiales. Dans la deuxieme partie de ce projet, le martelage est applique grace au robot SCOMPI. Les contraintes residuelles induites et relaxees par martelage sont ensuite mesurees par la methode des contours, qui a ete adaptee a cet effet. Dans la troisieme partie, le martelage est modelise par la methode des elements finis. Un modele axisymetrique developpe grace au logiciel ANSYS permet de simuler des impacts repetes d'un marteau elastique sur une plaque ayant un comportement elastoplastique.

  18. Absorption/desorption of hydrogen isotopes and isotopic waters by Zr-alloy getters

    SciTech Connect

    Ichimura, K.; Matsuyama, M.; Watanabe, K.; Takeuchi, T.

    1988-07-01

    Zr-alloy getters have been applied to tritium handling and vacuum conditioning for fusion devices. Some of their properties, however, should be improved to apply them in future devices. From this viewpoint, we have studied the effects of alloying on the getter properties of Zr alloys. We found that the activation energy of absorption and desorption of hydrogen varied considerably with alloying. The activation energy for hydrogen absorption was 0.74 for Zr/sub 61/Al/sub 39/, 0.01 for Zr/sub 57/V/sub 36/Fe/sub 7/, 0.63 for Zr/sub 67/Ni/sub 33/, and 2.8 kcal/mol for Zr/sub 85/Ni/sub 15/, whereas that for Zr was 2.6 kcal/mol. The heat of hydrogen absorption was 27.8 kcal/mol for Zr: it changed with alloying as 32.0--33.4 (Zr/sub 61/Al/sub 39/), 27.8--28.4 (Zr/sub 57/V/sub 36/Fe/sub 7/), 29.0 (Zr/sub 67/Ni/sub 33/), and 28.0 (Zr/sub 85/Ni/sub 15/). In addition, the ratio of the pumping speed of water vapor to that of hydrogen at room temperature varied with alloying element: for example, 1/40 for Zr/sub 57/V/sub 36/Fe/sub 7/ and 1/4 for Zr/sub 67/Ni/sub 33/. The alloying effects mentioned above are considered due to modification of the electronic and/or geometric structure of Zr with alloying.

  19. Superconducting property of Zr-Co-Al-Nb metallic glasses

    NASA Astrophysics Data System (ADS)

    Okai, D.; Nagai, R.; Motoyama, G.; Kimura, H. M.; Inoue, A.

    2011-11-01

    The superconducting property of Zr55Co(30-x)Al15Nbx (x = 0-20 at.%) metallic glasses fabricated by rapid solidification was investigated. The Zr55Co(30-x)Al15Nbx (x = 5-20 at.%) metallic glasses with a mixture structure of amorphous and nanocrystal phases exhibited superconductivity of Tc,on = 1.8-2.6 K. The maximum Tc,on = 2.6 K was obtained for the Zr55Co10Al15Nb20 metallic glass. This was attributable to the superconducting property of nanocrystalline particles contained in the Zr55Co10Al15Nb20 alloy. The increase of Nb element in the Zr55Co(30-x)Al15Nbx alloy led to the increase of Tc,on and the decrease of glass transition temperature. The glass transition temperature was between 704 and 749 K for the Zr55Co(30-x)Al15Nbx (x = 0-20 at.%) alloys. The temperature interval of supercooled liquid state was between 51 and 68 K for the Zr55Co(30-x)Al15Nbx (x = 0-20 at.%) alloys.

  20. NEUTRONIC REACTOR FUEL ELEMENT

    DOEpatents

    Shackleford, M.H.

    1958-12-16

    A fuel element possessing good stability and heat conducting properties is described. The fuel element comprises an outer tube formed of material selected from the group consisting of stainhess steel, V, Ti. Mo. or Zr, a fuel tube concentrically fitting within the outer tube and containing an oxide of an isotope selected from the group consisting of U/sup 235/, U/sup 233/, and Pu/sup 239/, and a hollow, porous core concentrically fitting within the fuel tube and formed of an oxide of an element selected from the group consisting of Mg, Be, and Zr.

  1. Theoretical predictions of properties and volatility of chlorides and oxychlorides of group-4 elements. II. Adsorption of tetrachlorides and oxydichlorides of Zr, Hf, and Rf on neutral and modified surfaces

    SciTech Connect

    Pershina, V.; Borschevsky, A.; Iliaš, M.; Türler, A.

    2014-08-14

    With the aim to interpret results of gas-phase chromatography experiments on volatility of group-4 tetrachlorides and oxychlorides including those of Rf, adsorption enthalpies of these species on neutral, and modified quartz surfaces were estimated on the basis of relativistic, two-component Density Functional Theory calculations of MCl{sub 4}, MOCl{sub 2}, MCl{sub 6}{sup −}, and MOCl{sub 4}{sup 2} with the use of adsorption models. Several mechanisms of adsorption were considered. In the case of physisorption of MCl{sub 4}, the trend in the adsorption energy in the group should be Zr > Hf > Rf, so that the volatility should change in the opposite direction. The latter trend complies with the one in the sublimation enthalpies, ΔH{sub sub}, of the Zr and Hf tetrachlorides, i.e., Zr < Hf. On the basis of a correlation between these quantities, ΔH{sub sub}(RfCl{sub 4}) was predicted as 104.2 kJ/mol. The energy of physisorption of MOCl{sub 2} on quartz should increase in the group, Zr < Hf < Rf, as defined by increasing dipole moments of these molecules along the series. In the case of adsorption of MCl{sub 4} on quartz by chemical forces, formation of the MOCl{sub 2} or MOCl{sub 4}{sup 2−} complexes on the surface can take place, so that the sequence in the adsorption energy should be Zr > Hf > Rf, as defined by the complex formation energies. In the case of adsorption of MCl{sub 4} on a chlorinated quartz surface, formation of the MCl{sub 6}{sup 2−} surface complexes can occur, so that the trend in the adsorption strength should be Zr ≤ Hf < Rf. All the predicted sequences, showing a smooth change of the adsorption energy in the group, are in disagreement with the reversed trend Zr ≈ Rf < Hf, observed in the “one-atom-at-a-time” gas-phase chromatography experiments. Thus, currently no theoretical explanation can be found for the experimental observations.

  2. Phase-field simulation of the stability of reaction phases at UO2/β-Zr interface

    NASA Astrophysics Data System (ADS)

    Nishida, Yuki; Tsukada, Yuhki; Koyama, Toshiyuki; Kurata, Masaki

    2015-11-01

    The stability of reaction phases at the UO2/Zr (β-Zr) interface in the O-U-Zr system was simulated by a newly constructed multi-phase-field model. At the UO2/Zr (β-Zr) interface, we assumed a liquid phase and an α-Zr (Hcp) phase. The phase growths and atomic diffusions of the constituent elements were simultaneously calculated in one-dimensional simulations. During isothermal aging at 1500 °C and 1600 °C, the thicknesses of both reaction phases increased. As O diffused much faster than U, O concentration increased immediately in the α-Zr (Hcp) phase. On account of its high O concentration, the α-Zr (Hcp) phase rapidly expanded toward the β-Zr (Bcc) side, blocking the diffusion of U from the liquid phase to the β-Zr (Bcc) phase. The stability of the liquid phase was influenced by the U concentration in the liquid phase and was correlated to the growth of the α-Zr (Hcp) phase that was accelerated by the diffusion of O from UO2 to the α-Zr (Hcp) phase.

  3. Des Moines.

    ERIC Educational Resources Information Center

    Gore, Deborah, Ed.

    1988-01-01

    This document, intended for elementary students, contains articles and activities designed to acquaint young people with the history of Des Moines, Iowa. The articles are short, and new or difficult words are highlighted and defined for young readers. "The Raccoon River Indian Agency" discusses the archeological exploration of the indian…

  4. Atomic interaction mechanism for designing the interface of W/Zr-based bulk metallic glass composites

    NASA Astrophysics Data System (ADS)

    Li, Z. K.; Fu, H. M.; Sha, P. F.; Zhu, Z. W.; Wang, A. M.; Li, H.; Zhang, H. W.; Zhang, H. F.; Hu, Z. Q.

    2015-03-01

    The interaction between active element Zr and W damages the W fibers and the interface and decreases the mechanical properties, especially the tensile strength of the W fibers reinforced Zr-based bulk metallic glass composites (BMGCs). From the viewpoint of atomic interaction, the W-Zr interaction can be restrained by adding minor elements that have stronger interaction with W into the alloy. The calculation about atomic interaction energy indicates that Ta and Nb preferred to segregate on the W substrate surface. Sessile drop experiment proves the prediction and corresponding in-situ coating appears at the interface. Besides, the atomic interaction mechanism was proven to be effective in many other systems by the sessile drop technique. Considering the interfacial morphology, Nb was added into the alloy to fabricate W/Zr-based BMGCs. As expected, the Nb addition effectively suppressed the W-Zr reaction and damage to W fibers. Both the compressive and tensile properties are improved obviously.

  5. Atomic interaction mechanism for designing the interface of W/Zr-based bulk metallic glass composites.

    PubMed

    Li, Z K; Fu, H M; Sha, P F; Zhu, Z W; Wang, A M; Li, H; Zhang, H W; Zhang, H F; Hu, Z Q

    2015-03-11

    The interaction between active element Zr and W damages the W fibers and the interface and decreases the mechanical properties, especially the tensile strength of the W fibers reinforced Zr-based bulk metallic glass composites (BMGCs). From the viewpoint of atomic interaction, the W-Zr interaction can be restrained by adding minor elements that have stronger interaction with W into the alloy. The calculation about atomic interaction energy indicates that Ta and Nb preferred to segregate on the W substrate surface. Sessile drop experiment proves the prediction and corresponding in-situ coating appears at the interface. Besides, the atomic interaction mechanism was proven to be effective in many other systems by the sessile drop technique. Considering the interfacial morphology, Nb was added into the alloy to fabricate W/Zr-based BMGCs. As expected, the Nb addition effectively suppressed the W-Zr reaction and damage to W fibers. Both the compressive and tensile properties are improved obviously.

  6. Superior unipolar resistive switching in stacked ZrOx/ZrO2/ZrOx structure

    NASA Astrophysics Data System (ADS)

    Lin, Cheng-Li; Lin, Tse-Yu

    2016-03-01

    This study investigates the performance of unipolar-switched ZrO2 RRAM, using an oxygen-deficient and amorphous ZrOx capping in a sandwich stack Al/ZrOx/ZrO2/ZrOx/Al structure. Superior high and low resistance switching and a resistance ratio (HRS/LRS) greater than 10 showed excellent dc endurance of 7378 switching cycles and 3.8 × 104 cycles in pulse switching measurements. Recovery behavior, observed in the I-V curve for the SET process (or HRS), led to HRS fluctuations and instability. A new resistance switching model for the stacked ZrO2 RRAM is proposed in this paper. In this model, oxygen-deficient and amorphous ZrOx film, capped on polycrystalline ZrO2 film, plays a key role and acts as an oxygen reservoir in making the oxygen ions redox easily for the SET process and in facilitating re-oxidation for the RESET process, resulting in excellent endurance. By improving the stability and recovery phenomena, engineering parameters of the current control may play a critical role during switching, and they can be correlated to the film's thickness and the oxygen content of the amorphous ZrOx film.

  7. Superconductivity in ZrCuxTe2

    NASA Astrophysics Data System (ADS)

    Baptista, Naiara; Grant, Ted; Renosto, Sergio; Fisck, Zack; Jefferson Machado, Antonio

    2012-02-01

    Layered transition metal dichalcogenides of the type MX2 (M is transition metal, X = S, Se, Te) have been studied for their electronic properties due to low dimensionality. In these materials each layer correspond to the hexagonal transition metal intercalated by two similar chalcogen sheets. In ZrTe2 the prototype structure is CdI2. The interaction of layers is weak as van der Walls bonding between chalcogen element (X). In general charge density wave and superconductivity coexist in these of materials. Indeed, various compounds of this material class exhibits this coexistence such as 2H-TaS2, 2H-NbS2 etc. Some results reported in literature about the electrical properties of ZrTe2 show that this material presents metallic behavior at a temperature interval from 4.0 K to 300 K. Thus, in this work we present results about intercalation of Cu in the ZrTe2 compound. The results suggest that the intercalation of Cu is able to induce superconductivity in this compound. The superconducting critical temperature close to 10.2 K is revealed through of magnetization and resistivity measurements. The x-ray result reveals a new compound, originating from Cu intercalation and crystallizes in the LiCrS2 prototype structure.

  8. Potential of ZrO clusters as replacement Pd catalyst

    SciTech Connect

    Behera, Swayamprabha; King, Nicholas; Jena, Puru; Samanta, Devleena

    2014-07-21

    Atomic clusters with specific size and composition and mimicking the chemistry of elements in the periodic table are commonly known as superatoms. It has been suggested that superatoms could be used to replace elements that are either scarce or expensive. Based on a photoelectron spectroscopy experiment of negatively charged ions, Castleman and co-workers [Proc. Natl. Acad. Sci. U.S.A. 107, 975 (2010)] have recently shown that atoms of Ni, Pd, and Pt which are well known for their catalytic properties, have the same electronic structure as their counterpart isovalent diatomic species, TiO, ZrO, and WC, respectively. Based on this similarity they have suggested that ZrO, for example, could be a replacement catalyst for Pd. Since catalysts are seldom single isolated atoms, one has to demonstrate that clusters of ZrO also have the same electronic structure as same sized Pd clusters. To examine if this is indeed the case, we have calculated the geometries, electronic structure, electron affinity, ionization potential, and hardness of Pd{sub n} and (ZrO){sub n} clusters (n = 1-5). We further studied the reaction of these clusters in neutral and charged forms with H{sub 2}, O{sub 2}, and CO and found it to be qualitatively different in most cases. These results obtained using density functional theory with hybrid B3LYP functional do not support the view that ZrO clusters can replace Pd as a catalyst.

  9. Potential of ZrO clusters as replacement Pd catalyst.

    PubMed

    Behera, Swayamprabha; King, Nicholas; Samanta, Devleena; Jena, Puru

    2014-07-21

    Atomic clusters with specific size and composition and mimicking the chemistry of elements in the periodic table are commonly known as superatoms. It has been suggested that superatoms could be used to replace elements that are either scarce or expensive. Based on a photoelectron spectroscopy experiment of negatively charged ions, Castleman and co-workers [Proc. Natl. Acad. Sci. U.S.A. 107, 975 (2010)] have recently shown that atoms of Ni, Pd, and Pt which are well known for their catalytic properties, have the same electronic structure as their counterpart isovalent diatomic species, TiO, ZrO, and WC, respectively. Based on this similarity they have suggested that ZrO, for example, could be a replacement catalyst for Pd. Since catalysts are seldom single isolated atoms, one has to demonstrate that clusters of ZrO also have the same electronic structure as same sized Pd clusters. To examine if this is indeed the case, we have calculated the geometries, electronic structure, electron affinity, ionization potential, and hardness of Pdn and (ZrO)n clusters (n = 1-5). We further studied the reaction of these clusters in neutral and charged forms with H2, O2, and CO and found it to be qualitatively different in most cases. These results obtained using density functional theory with hybrid B3LYP functional do not support the view that ZrO clusters can replace Pd as a catalyst.

  10. Phase Relations and Elemental Distribution Among Co-Existing Phases in the Ceramics of the Pseudobinary System CaZrTi{sub 2}O{sub 7}-LnAlO{sub 3} (Ln= Nd, Sm)

    SciTech Connect

    Mikhailenko, Natalia; Stefanovsky, Sergey

    2007-07-01

    In the ceramics in series (1-x) CaZrTi{sub 2}O{sub 7} - x NdAlO{sub 3} and (1-x) CaZrTi{sub 2}O{sub 7} - x SmAlO{sub 3} (x = 0.25, 0.5 and 0.75) produced by cold pressing and sintering at 1400, 1450 and 1500 deg. C zirconolite was found to be a major phase, perovskite was an extra phase and traces of residual baddeleyite occurred. At x = 0.75 the perovskite was major phase and zirconolite and cubic oxide of fianite or tazheranite type were extra phases. Major Nd and Sm host phase at x = 0.25 was found to be zirconolite (about 65% of total Nd{sub 2}O{sub 3} and 74% of total Sm{sub 2}O{sub 3}). With the x value increasing perovskite becomes major host phase for Nd and Sm accumulating of up to about 92% of total Nd and about 72% of total Sm. As follows from SEM/EDS data Nd and Sm contents in the zirconolite may reach {approx}1 formula unit (fu). (authors)

  11. Phase Relations and Elemental Distributions in the Ceramics of the Pseudo-Binary Systems CaZrTi{sub 2}O{sub 7} - LnAlO{sub 3} (Ln = Eu, Gd)

    SciTech Connect

    Mikhailenko, N.S.; Stefanovsky, S.V.; Ochkin, A.V.; Lapina, M.I.

    2007-07-01

    Zirconolite and perovskite were found to be major and minor phases respectively in the ceramics of the series (1-x) CaZrTi2O{sub 7} - x EuAlO{sub 3} and (1-x) CaZrTi{sub 2}O{sub 7} - x GdAlO{sub 3} (x = 0.25; 0.5; 0.75) produced by cold pressing and sintering at 1400, 1450 and 1500 deg. C. Zirconolite and cubic fianite-type oxide (in the Eu-bearing ceramics) were extra phases. At x = 0.25 major host phase for Eu and Gd is zirconolite accumulating of up to 90% of total Eu and Gd. With increase x value to 0.5 zirconolite remains major host phase for both Eu and Gd and accommodates almost 70% of total Eu{sub 2}O{sub 3} and about 60% of total Gd{sub 2}O{sub 3}. Perovskite becomes major phase for both Eu{sub 2}O{sub 3} and Gd{sub 2}O{sub 3} at x = 0.75 accumulating of about 66% of total Gd{sub 2}O{sub 3}. As follows from SEM/EDS data Eu and Gd contents in the zirconolite may exceed {approx}1 formula units, therefore, zirconolite ceramics may be effective matrices for actinide fraction of HLW where Am and Cm are dominant because their crystal chemical behavior is similar to behavior of Gd. (authors)

  12. Screening on binary Zr-1X (X = Ti, Nb, Mo, Cu, Au, Pd, Ag, Ru, Hf and Bi) alloys with good in vitro cytocompatibility and magnetic resonance imaging compatibility.

    PubMed

    Zhou, F Y; Qiu, K J; Li, H F; Huang, T; Wang, B L; Li, L; Zheng, Y F

    2013-12-01

    In this study, the microstructures, mechanical properties, corrosion behaviors, in vitro cytocompatibility and magnetic susceptibility of Zr-1X alloys with various alloying elements, including Ti, Nb, Mo, Cu, Au, Pd, Ag, Ru, Hf and Bi, were systematically investigated to explore their potential use in biomedical applications. The experimental results indicated that annealed Zr-1X alloys consisted entirely or primarily of α phase. The alloying elements significantly increased the strength and hardness of pure Zr and had a relatively slight influence on elastic modulus. Ru was the most effective enhancing element and Zr-1Ru alloy had the largest elongation. The results of electrochemical corrosion indicated that adding various elements to Zr improved its corrosion resistance, as indicated by the reduced corrosion current density. The extracts of the studied Zr-1X alloys produced no significant deleterious effects on osteoblast-like cells (MG 63), indicating good in vitro cytocompatibility. All except for Zr-1Ag alloy showed decreased magnetic susceptibility compared to pure Zr, and Zr-1Ru alloy had the lowest magnetic susceptibility value, being comparable to that of α' phase Zr-Mo alloy and Zr-Nb alloy and far lower than that of Co-Cr alloy and Ti-6Al-4V alloy. Among the experimental Zr-1X alloys, Zr-1Ru alloy possessing high strength coupled with good ductility, good in vitro cytocompatibility and low magnetic susceptibility may be a good candidate alloy for medical devices within a magnetic resonance imaging environment.

  13. Phase Relations and Elemental Distribution among Co-Existing Phases in the Ceramics of the Pseudobinary System CaZrTi{sub 2}O{sub 7}-CeAlO{sub 3}

    SciTech Connect

    Mikhailenko, N.S.; Stefanovsky, S.V.; Lapina, M.I.

    2006-07-01

    Ceramics formally related to a pseudo-binary system CaZrTi{sub 2}O{sub 7}-CeAlO{sub 3} being important for design of matrices for immobilization of a rare-earth - actinide fraction of high level waste were synthesized by cold pressing and sintering at temperatures of 1400, 1450 and 1500 deg. C. It has been shown that the target zirconolite and perovskite structure phases as well as cerium and zirconium dioxide based cubic phases were formed. Content of the latter phases in the ceramics increases significantly with increase of sintering temperature to 1500 deg. C and they are capable to accumulate up to 77% CeO{sub 2} of total amount introduced. (authors)

  14. Internal oxidation of laminated ternary Ru-Ta-Zr coatings

    NASA Astrophysics Data System (ADS)

    Chen, Yung-I.; Lu, Tso-Shen

    2015-10-01

    Researchers have observed the internal oxidation phenomenon in binary alloy coatings when developing refractory alloy coatings for protective purposes by conducting annealing at high temperatures and in oxygen-containing atmospheres. The coatings were assembled using cyclical gradient concentration deposition during cosputtering by employing a substrate holder rotating at a slow speed. The internally oxidized zone demonstrated a laminated structure, comprising alternating oxygen-rich and oxygen-deficient layers stacked in a general orientation. In the current study, Ru-Ta-Zr coatings were prepared with various stacking sequences during cosputtering. The Ru-Ta-Zr coatings were annealed at 600 °C in an atmosphere continuously purged with 1% O2-99% Ar mixed gas for 30 min. A transmission electron microscope was used to examine the periods of the laminated layers and crystallinity of the annealed coatings. Depth profiles produced using an Auger electron spectroscope and X-ray photoelectron spectroscope were used to certify the periodic variation of the related constituents and chemical states of the elements, respectively. The results indicate that the internally oxidized ternary coatings are stacked of Ru-, Ta2O5-, and ZrO2-dominant sublayers and that the stacking sequences of the sublayers affect the crystalline structure of the coatings. Zr is oxidized preferentially in the Ru-Ta-Zr coatings, increasing the surface hardness of the oxidized coatings.

  15. Magnetic properties of Co-Zr-B magnets produced by spark plasma sintering method

    SciTech Connect

    Saito, Tetsuji Akiyama, Tomoya

    2014-05-07

    Magnets of Co-Zr-B, one of the permanent magnetic compounds without rare-earth elements, were successfully produced by the spark plasma sintering method. The resultant Co-Zr-B magnets had high densities of 92%–96% and consisted mainly of the Co{sub x}Zr (x ≈ 5) phase. The coercivity of the Co-Zr-B magnets was highly dependent on the consolidation temperature and the boron content. The highest maximum energy product of 6.0 MGOe, with a remanence of 6.4 kG and the coercivity of 4.0 kOe, was achieved by the Co{sub 80}Zr{sub 18}B{sub 2} magnets consolidated at 873 K.

  16. Co-W-Zr (221)

    NASA Astrophysics Data System (ADS)

    Carow-Watamura, U.; Louzguine, D. V.; Takeuchi, A.

    This document is part of Part 2 http://dx.doi.org/10.1007/9getType="URL"/> 'Systems from B-Be-Fe to Co-W-Zr' of Subvolume B 'Physical Properties of Ternary Amorphous Alloys' of Volume 37 'Phase Diagrams and Physical Properties of Nonequilibrium Alloys' of Landolt-Börnstein - Group III 'Condensed Matter'. It contains the Chapter 'Co-W-Zr (221)' with the content:

  17. Co-V-Zr (220)

    NASA Astrophysics Data System (ADS)

    Carow-Watamura, U.; Louzguine, D. V.; Takeuchi, A.

    This document is part of Part 2 http://dx.doi.org/10.1007/97.etType="URL"/> 'Systems from B-Be-Fe to Co-W-Zr' of Subvolume B 'Physical Properties of Ternary Amorphous Alloys' of Volume 37 'Phase Diagrams and Physical Properties of Nonequilibrium Alloys' of Landolt-Börnstein - Group III 'Condensed Matter'. It contains the Chapter 'Co-V-Zr (220)' with the content:

  18. Co-Fe-Zr (203)

    NASA Astrophysics Data System (ADS)

    Carow-Watamura, U.; Louzguine, D. V.; Takeuchi, A.

    This document is part of Part 2 http://dx.doi.org/10.1007/9getType="URL"/> 'Systems from B-Be-Fe to Co-W-Zr' of Subvolume B 'Physical Properties of Ternary Amorphous Alloys' of Volume 37 'Phase Diagrams and Physical Properties of Nonequilibrium Alloys' of Landolt-Börnstein - Group III 'Condensed Matter'. It contains the Chapter 'Co-Fe-Zr (203)' with the content:

  19. Mechanical properties, in vitro corrosion and biocompatibility of newly developed biodegradable Mg-Zr-Sr-Ho alloys for biomedical applications

    PubMed Central

    Ding, Yunfei; Lin, Jixing; Wen, Cuie; Zhang, Dongmei; Li, Yuncang

    2016-01-01

    Our previous studies have demonstrated that Mg-Zr-Sr alloys can be anticipated as excellent biodegradable implant materials for load-bearing applications. In general, rare earth elements (REEs) are widely used in magnesium (Mg) alloys with the aim of enhancing the mechanical properties of Mg-based alloys. In this study, the REE holmium (Ho) was added to an Mg-1Zr-2Sr alloy at different concentrations of Mg1Zr2SrxHo alloys (x = 0, 1, 3, 5 wt. %) and the microstructure, mechanical properties, degradation behaviour and biocompatibility of the alloys were systematically investigated. The results indicate that the addition of Ho to Mg1Zr2Sr led to the formation of the intermetallic phases MgHo3, Mg2Ho and Mg17Sr2 which resulted in enhanced mechanical strength and decreased degradation rates of the Mg-Zr-Sr-Ho alloys. Furthermore, Ho addition (≤5 wt. %) to Mg-Zr-Sr alloys led to enhancement of cell adhesion and proliferation of osteoblast cells on the Mg-Zr-Sr-Ho alloys. The in vitro biodegradation and the biocompatibility of the Mg-Zr-Sr-Ho alloys were both influenced by the Ho concentration in the Mg alloys; Mg1Zr2Sr3Ho exhibited lower degradation rates than Mg1Zr2Sr and displayed the best biocompatibility compared with the other alloys. PMID:27553403

  20. Investigation of ZrO x /ZrC-ZrN/Zr thin-film structural evolution and their degradation using X-ray diffraction and Raman spectrometry

    NASA Astrophysics Data System (ADS)

    Usmani, B.; Vijay, V.; Chhibber, R.; Dixit, A.

    2016-11-01

    The thin-film structures of DC/FR magnetron-sputtered ZrO x /ZrC-ZrN/Zr tandem solar-selective coatings are investigated using X-ray diffraction and room-temperature Raman spectroscopic measurements. These studies suggest that the major contribution is coming from h-ZrN0.28, c-ZrC, h-Zr3C2 crystallographic phases in ZrN-ZrC absorber layer, in conjunction with mixed ZrO x crystallographic phases. The change in structure for thermally annealed samples has been examined and observed that cubic and hexagonal ZrO x phase converted partially into tetragonal and monoclinic ZrO x phases, whereas hexagonal and cubic ZrN phases, from absorber layer, have not been observed for these thermally treated samples in air. These studies suggest that thermal treatment may lead to the loss of ZrN phase in absorber, degrading the thermal response for the desired wavelength range in open ambient conditions in contrast to vacuum conditions.

  1. Zr/ZrC modified layer formed on AISI 440B stainless steel by plasma Zr-alloying

    NASA Astrophysics Data System (ADS)

    Shen, H. H.; Liu, L.; Liu, X. Z.; Guo, Q.; Meng, T. X.; Wang, Z. X.; Yang, H. J.; Liu, X. P.

    2016-12-01

    The surface Zr/ZrC gradient alloying layer was prepared by double glow plasma surface alloying technique to increase the surface hardness and wear resistance of AISI 440B stainless steel. The microstructure of the Zr/ZrC alloying layer formed at different alloying temperatures and times as well as its formation mechanism were discussed by using scanning electron microscopy, glow discharge optical emission spectrum, X-ray diffraction and X-ray photoelectron spectroscopy. The adhesive strength, hardness and tribological property of the Zr/ZrC alloying layer were also evaluated in the paper. The alloying surface consists of the Zr-top layer and ZrC-subsurface layer which adheres strongly to the AISI 440B steel substrate. The thickness of the Zr/ZrC alloying layer increases gradually from 16 μm to 23 μm with alloying temperature elevated from 900 °C to 1000 °C. With alloying time from 0.5 h to 4 h, the alloyed depth increases from 3 μm to 30 μm, and the ZrC-rich alloyed thickness vs time is basically parabola at temperature of 1000 °C. Both the hardness and wear resistance of the Zr/ZrC alloying layer obviously increase compared with untreated AISI 440B steel.

  2. Low beryllium content Zr-based bulk metallic glass composite with plasticity and work hardenability

    SciTech Connect

    Zheng, Q. E-mail: dujuan@nimte.ac.cn; Du, J. E-mail: dujuan@nimte.ac.cn

    2014-01-28

    A modified Zr-based bulk metallic glass matrix composite Zr{sub 47.67}Cu{sub 40}Ti{sub 3.66}Ni{sub 2.66}Be{sub 6} has been produced by increasing the contents of elements of Zr and Cu with higher Poisson ratio and reducing the contents of Ti, Ni, and Be elements with lower Poisson ratio based on famous metallic glass former Vitreloy 1. A compressive yielding strength of 1804 MPa, fracture strength of 1938 MPa and 3.5% plastic strain was obtained for obtained metallic glass composite. Also, work-hardening behavior was observed during compressive experiment which was ascribed to the interaction of the in situ precipitated CuZr phase and shear bands.

  3. PARTITION COEFFICIENTS OF Hf, Zr, AND REE BETWEEN PHENOCRYSTS AND GROUNDMASSES.

    USGS Publications Warehouse

    Fujimaki, Hirokazu; Tatsumoto, Mitsunobu; Aoki, Ken-ichiro

    1984-01-01

    Partition coefficients of Hf, Zr, and REE between olivine, orthopyroxene, clinopyroxene, plagioclase, garnet, amphibole, ilmenite, phlogopite, and liquid are presented. Samples consist of megacrysts in kimberlite, phenocrysts in alkaline basalts, tholeiitic basalts and andesitic to dacitic rocks, and synthetic garnet and clinopyroxene in Hawaiian tholeiites. The Hf-Lu and Zr-Lu elemental fractionations are as large as the Lu-Sm or Lu-Nd fractionation. The Hf and Zr partition coefficients between mafic phenocrysts and liquids are smaller than the Lu partition coefficients, but are similar to the Nd or Sm partition coefficients.

  4. Diagnostics development plan for ZR.

    SciTech Connect

    Hanson, David Lester

    2003-09-01

    The Z Refurbishment (ZR) Project is a program to upgrade the Z machine at SNL with modern durable pulsed power technology, providing additional shot capacity and improved reliability as well as advanced capabilities for both pulsed x-ray production and high pressure generation. The development of enhanced diagnostic capabilities is an essential requirement for ZR to meet critical mission needs. This report presents a comprehensive plan for diagnostic instrument and infrastructure development for the first few years of ZR operation. The focus of the plan is on: (1) developing diagnostic instruments with high spatial and temporal resolution, capable of low noise operation and survival in the severe EMP, bremsstrahlung, and blast environments of ZR; and (2) providing diagnostic infrastructure improvements, including reduced diagnostic trigger signal jitter, more and flexible diagnostic line-of-sight access, and the capability for efficient exchange of diagnostics with other laboratories. This diagnostic plan is the first step in an extended process to provide enhanced diagnostic capabilities for ZR to meet the diverse programmatic needs of a broad range of defense, energy, and general science programs of an international user community into the next decade.

  5. Metastable phases in Zr-Excel alloy and their stability under heavy ion (Kr2+) irradiation

    NASA Astrophysics Data System (ADS)

    Yu, Hongbing; Zhang, Ken; Yao, Zhongwen; Kirk, Mark A.; Long, Fei; Daymond, Mark R.

    2016-02-01

    Zr-Excel alloy (Zr-3.5Sn-0.8Nb-0.8Mo, wt.%) has been proposed as a candidate material of pressure tubes in the CANDU-SCWR design. It is a dual-phase alloy containing primary hcp α-Zr and metastable bcc β-Zr. Metastable hexagonal ω-Zr phase could form in β-Zr as a result of aging during the processing of the tube. A synchrotron X-ray study was employed to study the lattice properties of the metastable phases in as-received Zr-Excel pressure tube material. In situ heavy ion (1 MeV Kr2+) irradiations were carried out at 200 °C and 450 °C to emulate the stability of the metastable phase under a reactor environment. Quantitative Chemi-STEM EDS analysis was conducted on both un-irradiated and irradiated samples to investigate alloying element redistribution induced by heavy ion irradiation. It was found that no decomposition of β-Zr was observed under irradiation at both 200 °C and 450 °C. However, ω-Zr particles experienced shape changes and shrinkage associated with enrichment of Fe at the β/ω interface during 200 °C irradiation but not at 450 °C. There is a noticeable increase in the level of Fe in the α matrix after irradiation at both 200 °C and 450 °C. The concentrations of Nb, Mo and Fe are increased in the ω phase but decreased in the β phase at 200 °C. The stability of metastable phases under heavy ion irradiation associated with elemental redistribution is discussed.

  6. Etude numerique et experimentale de la reponse vibro-acoustique des structures raidies a des excitations aeriennes et solidiennes

    NASA Astrophysics Data System (ADS)

    Mejdi, Abderrazak

    Les fuselages des avions sont generalement en aluminium ou en composite renforces par des raidisseurs longitudinaux (lisses) et transversaux (cadres). Les raidisseurs peuvent etre metalliques ou en composite. Durant leurs differentes phases de vol, les structures d'avions sont soumises a des excitations aeriennes (couche limite turbulente : TBL, champs diffus : DAF) sur la peau exterieure dont l'energie acoustique produite se transmet a l'interieur de la cabine. Les moteurs, montes sur la structure, produisent une excitation solidienne significative. Ce projet a pour objectifs de developper et de mettre en place des strategies de modelisations des fuselages d'avions soumises a des excitations aeriennes et solidiennes. Tous d'abord, une mise a jour des modeles existants de la TBL apparait dans le deuxieme chapitre afin de mieux les classer. Les proprietes de la reponse vibro-acoustique des structures planes finies et infinies sont analysees. Dans le troisieme chapitre, les hypotheses sur lesquelles sont bases les modeles existants concernant les structures metalliques orthogonalement raidies soumises a des excitations mecaniques, DAF et TBL sont reexamines en premier lieu. Ensuite, une modelisation fine et fiable de ces structures est developpee. Le modele est valide numeriquement a l'aide des methodes des elements finis (FEM) et de frontiere (BEM). Des tests de validations experimentales sont realises sur des panneaux d'avions fournis par des societes aeronautiques. Au quatrieme chapitre, une extension vers les structures composites renforcees par des raidisseurs aussi en composites et de formes complexes est etablie. Un modele analytique simple est egalement implemente et valide numeriquement. Au cinquieme chapitre, la modelisation des structures raidies periodiques en composites est beaucoup plus raffinee par la prise en compte des effets de couplage des deplacements planes et transversaux. L'effet de taille des structures finies periodiques est egalement pris en

  7. Atomic structure of the Zr-He, Zr-vac, and Zr-vac-He systems: First-principles calculation

    NASA Astrophysics Data System (ADS)

    Lopatina, O. V.; Koroteev, Yu. M.; Chernov, I. P.

    2017-01-01

    The ab initio investigations have been performed for the atomic structure of the Zr-He, Zr-vac, and Zr-vac-He systems with concentrations of helium atoms and vacancies (vac) of 6 at %. A heliuminduced instability of the zirconia lattice has been revealed in the Zr-He system, which disappears with the formation of vacancies. The most preferred positions of impurities in the metal lattice have been determined. The energy of helium dissolution and the excess volume introduced by helium have been calculated. It has been established that the presence of helium in the Zr lattice leads to a significant decrease in the energy of vacancy formation.

  8. Radiation effects in Zr and Hf containing garnets

    NASA Astrophysics Data System (ADS)

    Whittle, Karl R.; Blackford, Mark G.; Smith, Katherine L.; Zaluzec, Nestor J.; Weyland, Matthew; Lumpkin, Gregory R.

    2015-07-01

    Garnets have been considered as host phases for the safe immobilisation of high-level nuclear waste, as they have been shown to accommodate a wide range of elements across three different cation sites, such as Ca, Y, Mn on the a-site, Fe, Al, U, Zr, and Ti on the b-site, and Si, Fe, Al on the c-site. Garnets, due to their ability to have variable composition, make ideal model materials for the examination of radiation damage and recovery in nuclear materials, including as potential waste forms. Kimzeyite, Ca3Zr2FeAlSiO12, has been shown naturally to contain up to 30 wt% Zr, and has previously been examined to elucidate both the structure and ordering within the lattice. This study examines the effects of radiation damage and recovery using in-situ ion beam irradiation with 1 MeV Kr ions at the IVEM-TANDEM facility, Argonne National Laboratory. The complementary Hf containing system Ca3Hf2FeAlSiO12 was also examined, and found to have a different response to irradiation damage. A sample of irradiated Ca3Zr2FeAlSiO12, at 1000 K, was characterised using aberration corrected (S)TEM and found to contain discreet, nano-sized, crystalline Fe rich particles, indicating a competing process during recovery is occurring.

  9. Effect of torsion conditions under high pressure on the structure and strengthening of the Zr-1% Nb alloy

    NASA Astrophysics Data System (ADS)

    Rogachev, S. O.; Rozhnov, A. B.; Nikulin, S. A.; Rybal'chenko, O. V.; Gorshenkov, M. V.; Chzhen, V. G.; Dobatkin, S. V.

    2016-04-01

    The effect of temperature and degree of deformation upon severe plastic deformation by torsion under a high pressure on the structure, phase composition, and microhardness of the industrial zirconium Zr-1% Nb alloy (E110) has been studied. The high-pressure torsion (HPT) (with N = 10 revolutions) of the Zr-1% Nb alloy at room temperature results in the formation of grain-subgrain nanosize structure with an average size of structural elements of 65 nm, increase in the microhardness by 2.3-2.8 times (to 358 MPa), and α-Zr → β-Zr and α-Zr → ω-Zr phase transformations. The increase in the HPT temperature to 200°C does not lead to a decrease in the microhardness of alloy owing to the increase in the fraction of ω-Zr phase, though the average size of structural elements increases to 125 nm. The increase in the temperature to 400°C during HPT with N = 10 revolutions leads to the grain growth in the α-Zr grain structure (~90%) to 160 nm and a decrease in the microhardness to 253-276 HV.

  10. Partition coefficients of Hf, Zr, and REE between phenocrysts and groundmasses

    NASA Technical Reports Server (NTRS)

    Fujimaki, H.; Tatsumoto, M.; Aoki, K.-I.

    1984-01-01

    Partition coefficients of Hf, Zr, and REE between olivine, orthopyroxene, clinopyroxene, plagioclase, garnet, amphibole, ilmenite, phlogopite, and liquid are presented. Samples consist of megacrysts in kimberlite, phenocrysts in alkaline basalts, tholeiitic basalts and andesitic to dacitic rocks, and synthetic garnet and clinopyroxene in Hawaiian tholeiites. The Hf-Lu and Zr-Lu elemental fractionations are as large as the Lu-Sm or Lu-Nd fractionation. The Hf and Zr partition coefficients between mafic phenocrysts and liquids are smaller than the Lu partition coefficients, but are similar to the Nd or Sm partition coefficients. The Hf and Zr partition coefficients between ilmenite, phlogopite, and liquid are larger than the Lu partition coefficients for these minerals and their corresponding liquids. The Hf-Zr elemental fractionation does not occur except for extreme fractionation involving Zr-minerals and extremely low fO2. These data have an important bearing on chronological and petrogenetic tracer studies involving the Lu-Hf isotopic system.

  11. Effets des electrons secondaires sur l'ADN

    NASA Astrophysics Data System (ADS)

    Boudaiffa, Badia

    Les interactions des electrons de basse energie (EBE) representent un element important en sciences des radiations, particulierement, les sequences se produisant immediatement apres l'interaction de la radiation ionisante avec le milieu biologique. Il est bien connu que lorsque ces radiations deposent leur energie dans la cellule, elles produisent un grand nombre d'electrons secondaires (4 x 104/MeV), qui sont crees le long de la trace avec des energies cinetiques initiales bien inferieures a 20 eV. Cependant, il n'y a jamais eu de mesures directes demontrant l'interaction de ces electrons de tres basse energie avec l'ADN, du principalement aux difficultes experimentales imposees par la complexite du milieu biologique. Dans notre laboratoire, les dernieres annees ont ete consacrees a l'etude des phenomenes fondamentaux induits par impact des EBE sur differentes molecules simples (e.g., N2, CO, O2, H2O, NO, C2H 4, C6H6, C2H12) et quelques molecules complexes dans leur phase solide. D'autres travaux effectues recemment sur des bases de l'ADN et des oligonucleotides ont montre que les EBE produisent des bris moleculaires sur les biomolecules. Ces travaux nous ont permis d'elaborer des techniques pour mettre en evidence et comprendre les interactions fondamentales des EBE avec des molecules d'interet biologique, afin d'atteindre notre objectif majeur d'etudier l'effet direct de ces particules sur la molecule d'ADN. Les techniques de sciences des surfaces developpees et utilisees dans les etudes precitees peuvent etre etendues et combinees avec des methodes classiques de biologie pour etudier les dommages de l'ADN induits par l'impact des EBE. Nos experiences ont montre l'efficacite des electrons de 3--20 eV a induire des coupures simple et double brins dans l'ADN. Pour des energies inferieures a 15 eV, ces coupures sont induites par la localisation temporaire d'un electron sur une unite moleculaire de l'ADN, ce qui engendre la formation d'un ion negatif transitoire

  12. Superconducting property of Zr-Co and Zr-Co-Al alloys fabricated by rapid solidification

    NASA Astrophysics Data System (ADS)

    Okai, D.; Nagai, R.; Motoyama, G.; Fukami, T.; Yamasaki, T.; Yokoyama, Y.; Kimura, H. M.; Inoue, A.

    2010-11-01

    The superconducting property of Zr(1-x)Cox (x = 10-50 at.%) alloys and a Zr55Co30Al15 bulk metallic glass fabricated using techniques of rapid solidification was investigated. The Zr55Co30Al15 alloy crystallized by heat treatment in a vacuum atmosphere exhibited superconductivity of Tc,on = 2.4 K. This was attributable to the superconducting property of a crystalline Zr-Co alloy precipitated in the Zr55Co30Al15 alloy. The Tc,on of the crystalline Zr(1-x)Cox alloy was sensitive to the Co content. The increase of Co content for the Zr(1-x)Cox alloy led to the decrease of Tc,on. The Zr(1-x)Cox alloy exhibited superconductivity of a maximum Tc,on = 3.9 K for the Zr80Co20 alloy with superconducting nanocrystal particles embedded in the amorphous matrix.

  13. Capture of Hydrogen Using ZrNi

    NASA Technical Reports Server (NTRS)

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

    2005-01-01

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

  14. Mechanism of abnormally slow crystal growth of CuZr alloy

    SciTech Connect

    Yan, X. Q.; Lü, Y. J.

    2015-10-28

    Crystal growth of the glass-forming CuZr alloy is shown to be abnormally slow, which suggests a new method to identify the good glass-forming alloys. The crystal growth of elemental Cu, Pd and binary NiAl, CuZr alloys is systematically studied with the aid of molecular dynamics simulations. The temperature dependence of the growth velocity indicates the different growth mechanisms between the elemental and the alloy systems. The high-speed growth featuring the elemental metals is dominated by the non-activated collision between liquid-like atoms and interface, and the low-speed growth for NiAl and CuZr is determined by the diffusion across the interface. We find that, in contrast to Cu, Pd, and NiAl, a strong stress layering arisen from the density and the local order layering forms in front of the liquid-crystal interface of CuZr alloy, which causes a slow diffusion zone. The formation of the slow diffusion zone suppresses the interface moving, resulting in much small growth velocity of CuZr alloy. We provide a direct evidence of this explanation by applying the compressive stress normal to the interface. The compression is shown to boost the stress layering in CuZr significantly, correspondingly enhancing the slow diffusion zone, and eventually slowing down the crystal growth of CuZr alloy immediately. In contrast, the growth of Cu, Pd, and NiAl is increased by the compression because the low diffusion zones in them are never well developed.

  15. Al-Cu-Zr (050)

    NASA Astrophysics Data System (ADS)

    Carow-Watamura, U.; Louzguine, D. V.; Takeuchi, A.

    This document is part of Part 1 http://dx.doi.org/10.1007/9getType="URL"/> 'Systems from Ag-Al-Ca to Au-Pd-Si' of Subvolume B 'Physical Properties of Ternary Amorphous Alloys' of Volume 37 'Phase Diagrams and Physical Properties of Nonequilibrium Alloys' of Landolt-Börnstein - Group III 'Condensed Matter'. It contains the Chapter 'Al-Cu-Zr (050)' with the content:

  16. Modelisation numerique de l'hydrologie pour l'aide a la gestion des bassins versants, par l'utilisation conjointe des systemes d'information geographique et de la methode des elements finis un nouvel outil pour le developpement durable SAGESS

    NASA Astrophysics Data System (ADS)

    Bel Hadj Kacem, Mohamed Salah

    All hydrological processes are affected by the spatial variability of the physical parameters of the watershed, and also by human intervention on the landscape. The water outflow from a watershed strictly depends on the spatial and temporal variabilities of the physical parameters of the watershed. It is now apparent that the integration of mathematical models into GIS's can benefit both GIS and three-dimension environmental models: a true modeling capability can help the modeling community bridge the gap between planners, scientists, decision-makers and end-users. The main goal of this research is to design a practical tool to simulate run-off water surface using Geographic design a practical tool to simulate run-off water surface using Geographic Information Systems and the simulation of the hydrological behavior by the Finite Element Method.

  17. Microcrystalline phase transformation from ZrF4·HF·2H2O to ZrO2 through the intermediate phases ZrF4·3H2O, ZrF4·H2O, Zr2OF6·H2O and ZrF4

    NASA Astrophysics Data System (ADS)

    Dey, C. C.

    2014-09-01

    The behavior of hydrated zirconium fluoride has been studied by perturbed angular correlation spectroscopy. It is found that the crystalline compound ZrF4·HF·2H2O, formed initially by drying solution of Zr metal in concentrated HF, transforms spontaneously to ZrF4·3H2O. This trihydrated compound dehydrates to ZrF4 through the intermediate monohydrates ZrF4·H2O and Zr2OF6·H2O. The compound ZrF4 finally transforms to ZrO2 at ∼343 K. Different crystalline phases of ZrF4·HF·2H2O, ZrF4·3H2O, ZrF4·H2O, Zr2OF6·H2O, ZrF4 and ZrO2 have been identified and characterized by PAC spectroscopy. From previous PAC measurements, the intermediate ZrF4·H2O and Zr2OF6·H2O were not observed and the dehydration from ZrF4·3H2O to ZrF4 was found to be routed directly. Present measurements by PAC exhibits dissimilar crystal structures for ZrF4·3H2O and ZrF4·H2O unlike the crystal structures found in hafnium analogous compounds.

  18. Brazing characteristics of a Zr-Ti-Cu-Fe eutectic alloy filler metal for Zircaloy-4

    NASA Astrophysics Data System (ADS)

    Lee, Jung G.; Lim, C. H.; Kim, K. H.; Park, S. S.; Lee, M. K.; Rhee, C. K.

    2013-10-01

    A Zr-Ti-Cu-Fe quaternary eutectic alloy was employed as a new Be-free brazing filler metal for Zircaloy-4 to supersede physically vapor-deposited Be coatings used conventionally with several disadvantages. The quaternary eutectic composition of Zr58Ti16Cu10Fe16 (at.%) showing a low melting temperature range from 832 °C to 853 °C was designed by a partial substitution of Zr with Ti based on a Zr-Cu-Fe ternary eutectic system. By applying an alloy ribbon with the determined composition, a highly reliable joint was obtained with a homogeneous formation of predominantly grown α-Zr phases owing to a complete isothermal solidification, exhibiting strength higher than that of Zircaloy-4. The homogenization of the joint was rate-controlled by the diffusion of the filler elements (Ti, Cu, and Fe) into the Zircaloy-4 base metal, and the detrimental segregation of the Zr2Fe phase in the central zone was completely eliminated by an isothermal holding at a brazing temperature of 920 °C for 10 min.

  19. Development of Ti-Nb-Zr alloys with high elastic admissible strain for temporary orthopedic devices.

    PubMed

    Ozan, Sertan; Lin, Jixing; Li, Yuncang; Ipek, Rasim; Wen, Cuie

    2015-07-01

    A new series of beta Ti-Nb-Zr (TNZ) alloys with considerable plastic deformation ability during compression test, high elastic admissible strain, and excellent cytocompatibility have been developed for removable bone tissue implant applications. TNZ alloys with nominal compositions of Ti-34Nb-25Zr, Ti-30Nb-32Zr, Ti-28Nb-35.4Zr and Ti-24.8Nb-40.7Zr (wt.% hereafter) were fabricated using the cold-crucible levitation technique, and the effects of alloying element content on their microstructures, mechanical properties (tensile strength, yield strength, compressive yield strength, Young's modulus, elastic energy, toughness, and micro-hardness), and cytocompatibilities were investigated and compared. Microstructural examinations revealed that the TNZ alloys consisted of β phase. The alloy samples displayed excellent ductility with no cracking, or fracturing during compression tests. Their tensile strength, Young's modulus, elongation at rupture, and elastic admissible strain were measured in the ranges of 704-839 MPa, 62-65 GPa, 9.9-14.8% and 1.08-1.31%, respectively. The tensile strength, Young's modulus and elongation at rupture of the Ti-34Nb-25Zr alloy were measured as 839 ± 31.8 MPa, 62 ± 3.6 GPa, and 14.8 ± 1.6%, respectively; this alloy exhibited the elastic admissible strain of approximately 1.31%. Cytocompatibility tests indicated that the cell viability ratios (CVR) of the alloys are greater than those of the control group; thus the TNZ alloys possess excellent cytocompatibility.

  20. An in situ experimental study of Zr4+ transport capacity of water-rich fluids in the temperature and pressure range of the deep crust and upper mantle

    NASA Astrophysics Data System (ADS)

    Mysen, Bjorn

    2015-12-01

    Throughout the Earth's history, mass transport involved fluids. In order to address the circumstances under which Zr4+ may have been transported in this manner, its solubility behavior in aqueous fluid with and without NaOH and SiO2 in equilibrium with crystalline ZrO2 was determined from 550 to 950 °C and 60 to 1200 MPa. The measurements were carried out in situ while the samples were at the temperatures and pressures of interest. In ZrO2-H2O and ZrO2-SiO2-H2O fluids, the Zr4+ concentration ranges from ≤10 to ~70 ppm with increasing temperature and pressure. Addition of SiO2 to the ZrO2-H2O system does not affect these values appreciably. In these two environments, Zr4+ forms simple oxide complexes in the H2O fluid with ∆H ~ 40 kJ/mol for the solution equilibrium, ZrO2(solid) = ZrO2(fluid). The Zr4+ concentration in aqueous fluid increases about an order of magnitude upon addition of 1 M NaOH, which reflects the formation of zirconate complexes. The principal solution mechanism is ZrO2 + 4NaOH = Na4ZrO4 + 2H2O with ∆H ~ 200 kJ/mol. Addition of both SiO2 and NaOH to ZrO2-H2O enhances the Zr4+ by an additional factor of about 5 with the formation of partially protonated alkali zircon silicate complexes in the fluid. The principal solution mechanism is 2ZrO2 + 2NaOH + 2SiO2 = Na2Zr2Si2O9 + H2O with ∆H ~ 40 kJ/mol. These results, in combination with other published experimental data, imply that fluid released during high-temperature/high-pressure dehydration of hydrous mineral assemblages in the Earth's interior under some circumstances may carry significant concentrations of Zr and probably other high field strength elements (HFSEs). This suggestion is consistent with the occurrence of Zr-rich veins in high-grade metamorphic eclogite and granulite terranes. Moreover, aqueous fluids transported from dehydrating oceanic crust into overlying mantle source rocks of partial melting also may carry high-abundance HFSE of fluids released from dehydrating slabs and

  1. A study on Zr-Ir multiple bonding active for C-H bond cleavage.

    PubMed

    Oishi, Masataka; Oshima, Masato; Suzuki, Hiroharu

    2014-07-07

    Zr-Ir hydrido complexes with ansa-(cyclopentadienyl)(amide) as the supporting ligand in the zirconium fragment, e.g., (L(1)ZrR)(Cp*Ir)(μ-H)3 [L(1) = Me2Si(η(5)-C5Me4)(N(t)Bu), R = Cl (5), Ph (7), Me (10), alkyl, and aryl] were designed, synthesized, and isolated as tractable early-late heterodinuclear complexes. Despite the presence of the three supporting hydride ligands, Zr-Ir distances in the crystal structures of 5, alkyl, and aryl complexes [2.74-2.76 Å] were slightly longer than the sum of the element radii of Zr and Ir [2.719 Å]. These hydrocarbyl complexes displayed the thermolytic C-H activation of a variety of aromatic compounds and several organometallic compounds. Also, the substrate scope and limitation in the Zr-Ir system were studied. The regiochemical outcomes during the C-H activation of pyridine derivatives and methoxyarenes suggested the in situ generation of a Lewis acidic active intermediate, i.e., (L(1)Zr)(Cp*IrH2) (III). The existence of III and relevant σ-complex intermediates {L(1)Zr(η(2)-R-H)}(Cp*IrH2) (IIR) (R = Me, Ph) in the ligand exchange was demonstrated by the direct isolation of a Et3PO-adduct of III (39b) from 7 and kinetic studies. The structure of the direct Zr-Ir bonds in IIPh, IIMe, III, and 39b were probed using computational studies. The unprecedented strong M-M' interactions in the early-late heterobimetallic (ELHB) complexes have been proposed herein.

  2. U-10Mo/Zr Interface Modeling using a Microstructure-Based FEM Approach

    SciTech Connect

    Soulami, Ayoub; Xu, Zhijie; Joshi, Vineet V.; Burkes, Douglas; Lavender, Curt A.; McGarrah, Eric J.

    2016-04-25

    The U-10Mo in low enrichments (LEU) has been identified as the most promising alternative to the current highly enriched uranium (HEU) used in the United States’ fleet of high performance research reactors (USHPRRs). The nominal configuration of the new LEU U-10Mo plate fuel comprises a U-10Mo fuel foil enriched to slightly less than 20% U-235 (0.08” to 0.02” thick), a thin Zr interlayer/diffusion barrier (25 m thick) and a relatively thick outer can of 6061 aluminum. Currently the Zr interlayer is clad by hot roll bonding. Previous studies and observations revealed a thinning of the zirconium (Zr) layer during this fuel fabrication process, which is not desirable from the fuel performance perspective. Coarse UMo grains, dendritic structures, Mo concentration segregation, carbides, and porosity are present in the as-cast material and can lead to a nonuniform UMo/Zr interface. The purpose of the current work is to investigate the effects of these microstructural parameters on the Zr coating variation. A microstructure-based finite-element method model was used in this work, and a study on the effect of homogenization on the interface between U-10Mo and Zr was conducted. The model uses actual backscattered electron–scanning electron microscopy microstructures, Mo concentrations, and mechanical properties to predict the behavior of a representative volume element under compressive loading during the rolling process. The model successfully predicted the experimentally observed thinning of the Zr layer in the as-cast material. The model also uses results from a homogenization model as an input, and a study on the effect of different levels of homogenization on the interface indicated that homogenization helps decrease this thinning. This model can be considered a predictive tool representing a first step for model integration and an input into a larger fuel fabrication performance model.

  3. Collectivity of high spin states in {sup 84}Zr

    SciTech Connect

    Lister, C.J.; Blumenthal, D.; Crowell, B.

    1995-08-01

    {sup 84}Zr is one of the most extensively studied of the A {approximately} 80 rotors, both from theoretical and experimental approaches. It was predicted to be a good candidate to support superdeformation, and to show interesting spectroscopic properties including saturation of its shell-model space at lower spin. We performed an experiment using Gammasphere in its early implementation phase. The reaction of {sup 29}Si on {sup 58}Ni was used to strongly populate {sup 84}Zr at high spin. Thin and thick targets were used to allow the extraction of transitional matrix elements at very high spin, and to allow a sensitive search for superdeformed states. Data analysis is in progress. The large data set allowed us to extend the previously known bands considerably. Candidates for a staggered M1-band, found previously {sup 86}Zr, were located. To date, no evidence for superdeformed bands was found. Analysis was slowed by the relocation of all the participants in this experiment, but we hope to complete the lifetime analysis this year. This analysis has become especially topical, due to reported measurements of superdeformation in this region.

  4. Pd-Cu-M (M = Y, Ti, Zr, V, Nb, and Ni) Alloys for the Hydrogen Separation Membrane.

    PubMed

    Nayebossadri, Shahrouz; Speight, John D; Book, David

    2017-01-25

    Self-supported fcc Pd-Cu-M (M = Y, Ti, Zr, V, Nb, and Ni) alloys were studied as potential hydrogen purification membranes. The effects of small additions (1-2.6 at. %) of these elements on the structure, hydrogen solubility, diffusivity, and permeability were examined. Structural analyses by X-ray diffraction (XRD) showed the fcc phase for all alloys with induced textures from cold rolling. Heat treatment at 650 °C for 96 h led to the reorientation in all alloys except the Pd-Cu-Zr alloy, exhibiting the possibility to enhance the structural stability by Zr addition. Hydrogen solubility was almost doubled in the ternary alloys containing Y and Zr compared to Pd65.1Cu34.9 alloy at 300 °C. It was noted that hydrogen diffusivity is decreased upon additions of these elements compared to the Pd65.1Cu34.9 alloy, with the Pd-Cu-Zr alloy showing the lowest hydrogen diffusivity. However, the comparable hydrogen permeability of the Pd-Cu-Zr alloy with the corresponding binary alloy, as well as its highest hydrogen permeability among the studied ternary alloys at temperatures higher than 300 °C, suggested that hydrogen permeation of these alloys within the fcc phase is mainly dominated by hydrogen solubility. Hydrogen flux variations of all ternary alloys were studied and compared with the Pd65.1Cu34.9 alloy under 1000 ppm of H2S + H2 feed gas. Pd-Cu-Zr alloy showed superior resistance to the sulfur poisoning probably due to the less favorable H2S-surface interaction and more importantly slower rate of bulk sulfidation as a result of improved structural stability upon Zr addition. Therefore, Pd-Cu-Zr alloys may offer new potential hydrogen purification membranes with improved chemical stability and hydrogen permeation compared to the binary fcc Pd-Cu alloys.

  5. Zr inclusions in actinide–Zr alloys: New data and ideas about how they form

    SciTech Connect

    Janney, Dawn E.; O’Holleran, Thomas P.

    2015-05-01

    High-Zr inclusions are common in actinide–Zr alloys despite phase diagrams indicating that these alloys should not contain a high-Zr phase. The inclusions may contain enough Zr to cause significant differences between bulk compositions and those of inclusion-free areas, leading to possible errors in interpreting data if the inclusions are not considered. This paper presents data from high-Zr inclusions in a complex U–Np–Pu–Am–Zr–RE alloy. It is suggested that the high-Zr inclusions nucleated as high-Zr solid solutions at interfaces with high-actinide RE liquids, then unmixed to form nanometer-scale high-actinide sub-inclusions.

  6. Zr partitioning and kinetics and mechanism

    NASA Technical Reports Server (NTRS)

    Taylor, L. A.

    1973-01-01

    The results of investigations concerning the cooling histories of lunar rocks are reported. Publications resulting from this research are listed. Studies discussed include the partitioning of Zr between FeTi03 and Fe2Ti04 in the presence of Fe + Zr02, and ulvospinel reduction.

  7. The Mechanical Properties of the Mo-0.5Ti and Mo-0.1Zr Alloys at Room Temperature and High Temperature Annealing

    NASA Astrophysics Data System (ADS)

    Cui, Chaopeng; Gao, Yimin; Wei, Shizhong; Zhang, Guoshang; Zhou, Yucheng; Pan, Kunming; Zhu, Xiangwei; Guo, Songliang

    2017-02-01

    Mo-0.5Ti and Mo-0.1Zr alloys were prepared by powder metallurgy. In Mo-0.5Ti and Mo-0.1Zr alloys, there appears the second-phase particles of Ti2O3 and ZrO2 respectively, each of which can effectively prevent the dislocation activity in the process of plastic deformation. The addition of Zr can increase the strength of molybdenum alloys. Meanwhile, the ZrO2 formed from the alloy element Zr can refine the grains of molybdenum alloys to improve the recrystallization plasticity. After annealing, the tensile strength decreases while the plasticity greatly increases compared to the annealed Mo-0.5Ti and Mo-0.1Zr alloys. With the increase of annealing temperature, both the tensile strength and plasticity of Mo-0.5Ti and Mo-0.1Zr alloys decrease. Compared with pure Mo, after annealing the properties of the Mo-0.5Ti alloy and the plasticity of the Mo-0.1Zr alloy significantly increases.

  8. Des ballons pour demain

    NASA Astrophysics Data System (ADS)

    Régipa, R.

    A partir d'une théorie sur la détermination des formes et des contraintes globales d'un ballon de révolution, ou s'en rapprochant, une nouvelle famille de ballons a été définie. Les ballons actuels, dits de ``forme naturelle'', sont calculés en général pour une tension circonférencielle nulle. Ainsi, pour une mission donnée, la tension longitudinale et la forme de l'enveloppe sont strictement imposées. Les ballons de la nouvelle génération sont globalement cylindriques et leurs pôles sont réunis par un câble axial, chargé de transmettre une partie des efforts depuis le crochet (pôle inférieur), directement au pôle supérieur. De plus, la zone latérale cylindrique est soumise à un faible champ de tensions circonférencielles. Ainsi, deux paramètres permettent de faire évoluer la distribution des tensions et la forme de l'enveloppe: - la tension du câble de liaison entre pôles (ou la longueur de ce câble) - la tension circonférencielle moyenne désirée (ou le rayon du ballon). On peut donc calculer et réaliser: - soit des ballons de forme adaptée, comme les ballons à fond plat pour le bon fonctionnement des montgolfières infrarouge (projet MIR); - soit des ballons optimisés pour une bonne répartition des contraintes et une meilleure utilisation des matériaux d'enveloppe, pour l'ensemble des programmes stratosphériques. Il s'ensuit une économie sensible des coûts de fabrication, une fiabilité accrue du fonctionnement de ces ballons et une rendement opérationnel bien supérieur, permettant entre autres, d'envisager des vols à très haute altitude en matériaux très légers.

  9. Microstructure and Properties of DCP-Derived W-ZrC Composite Using Nontoxic Sodium Alginate to Fabricate WC Preform

    NASA Astrophysics Data System (ADS)

    Najafzadeh Khoee, Ali Asghar; Habibolahzadeh, Ali; Qods, Fathallah; Baharvandi, Hamidreza

    2015-04-01

    In the present work, tungsten carbide (WC) preforms were fabricated by gel-casting process, using different nontoxic Na-alginate to tertiary calcium phosphate ratios and different loadings of WC powder in the initial slurries. The gel-cast green bodies were dried and pre-sintered at 1723 K for 4 h and then reactively infiltrated by molten Zr2Cu at 1623 K for 0.5 h, to produce W-ZrC composite via displacive compensation of porosity process. The phases, microstructures, and mechanical properties of the preforms and the W-ZrC composites were investigated by Fourier transform infrared spectroscope, x-ray diffractometer (XRD), scanning electron microscope (SEM), image analyzer, and universal mechanical testing machine. XRD results, SEM micrographs, and elemental maps indicated uniform distribution of phases (W and ZrC) and elements (W, Zr, and C). Flexural strengths and hardness of the fabricated composites were in the ranges of 429-460 MPa and 7.5-9.5 GPa, respectively. Fractography studies revealed two types of dimple rupture and cleavage fracture modes in different composite samples. The W-ZrC composite was ablated by an oxyacetylene flame for 60 s. The mean value of mass and linear ablation rates of the composite were 2.1 ± 0.1 mg/s and 3.6 ± 0.5 µm/s, respectively.

  10. The behaviour of REE and Zr-Hf fractionation in the volcanic waters of Nevado del Ruiz system (Colombia)

    NASA Astrophysics Data System (ADS)

    Inguaggiato, Claudio; Censi, Paolo; Zuddas, Pierpaolo; Makario Londoño, John; Chacón, Zoraida; Alzate, Diego; Brusca, Lorenzo; D'Alessandro, Walter

    2015-04-01

    The geochemical behaviour of Rare Earth Element (REE), Zr and Hf have been investigated in the thermal waters of Nevado del Ruiz volcanic system. These fluids are characterised by a wide range of pH ranging between 1.0 and 8.8. The acidic waters are sulphate dominated with different Cl/SO4 ratios. The Nevado del Ruiz waters allowed to investigate the behaviour of investigated elements in a wide spectrum of pH and chemical composition of water. The important role of the pH and the ionic complexes have been evidenced in the distribution of REE, Zr and Hf in the aqueous phase. The pH rules the precipitation of authigenic oxyhydroxides of Fe, Al producing changes in REE, Zr, Hf amount and strong anomalies of Cerium and Europium. Y-Ho and Zr-Hf (twin pairs) have different behaviour in strong acidic waters with respect to the water with higher pH. Yttrium and Ho have the same behaviour of Zr and Hf in waters with pH near neutral-to-neutral, showing super-chondritic ratios. The twin pairs showed to be sensitive to the co-precipitation and/or adsorption onto the surface of authigenic particulate suggesting an enhanced scavenging of Ho and Hf respect to Y and Zr, leading to super-chondritic ratios. In acidic waters a different behaviour of twin pairs occurs with chondritic Y/Ho ratios (reflecting the Y/Ho ratio of average local rock) and sub-chondritic Zr/Hf ratios. For the first time, Zr and Hf have been investigated in natural acidic fluids to understand the behaviour of these elements in extreme acidic conditions and different major anions chemistry. Zr/Hf molar ratio changes from 4.75 to 49.29 in water with pH<3.6. In strong acidic waters, a different fractionation of Zr and Hf have been recognised as function of major anion contents (Cl and SO4), suggesting the formation of complexes leading to sub-chondritic Zr/Hf molar ratios.

  11. Effect of atomic size on undercoolability of binary solid solution alloy liquids with Zr, Ti, and Hf using electrostatic levitation.

    PubMed

    Jeon, S; Kang, D-H; Lee, Y H; Lee, S; Lee, G W

    2016-11-07

    We investigate the relationship between the excess volume and undercoolability of Zr-Ti and Zr-Hf alloy liquids by using electrostatic levitation. Unlike in the case of Zr-Hf alloy liquids in which sizes of the constituent atoms are matched, a remarkable increase of undercoolability and negative excess volumes are observed in Zr-Ti alloy liquids as a function of their compositional ratios. In this work, size mismatch entropies for the liquids were obtained by calculating their hard sphere diameters, number densities, and packing fractions. We also show that the size mismatch entropy, which arises from the differences in atomic sizes of the constituent elements, plays an important role in determining the stabilities of metallic liquids.

  12. Effect of atomic size on undercoolability of binary solid solution alloy liquids with Zr, Ti, and Hf using electrostatic levitation

    NASA Astrophysics Data System (ADS)

    Jeon, S.; Kang, D.-H.; Lee, Y. H.; Lee, S.; Lee, G. W.

    2016-11-01

    We investigate the relationship between the excess volume and undercoolability of Zr-Ti and Zr-Hf alloy liquids by using electrostatic levitation. Unlike in the case of Zr-Hf alloy liquids in which sizes of the constituent atoms are matched, a remarkable increase of undercoolability and negative excess volumes are observed in Zr-Ti alloy liquids as a function of their compositional ratios. In this work, size mismatch entropies for the liquids were obtained by calculating their hard sphere diameters, number densities, and packing fractions. We also show that the size mismatch entropy, which arises from the differences in atomic sizes of the constituent elements, plays an important role in determining the stabilities of metallic liquids.

  13. Ti-based glassy alloys in Ti-Cu-Zr-Sn system

    NASA Astrophysics Data System (ADS)

    Wang, ZengRui; Dong, DanDan; Qiang, JianBing; Wang, Qing; Wang, YingMin; Dong, Chuang

    2013-07-01

    Bulk amorphous formation in Ti-Cu-based multicomponent alloys, free of Ni, Pd and Be elements, were studied using the cluster-plus-glue-atom model. The basic cluster formula was revealed as [Ti9Cu6]Cu3 to explain the best binary glass forming composition Ti50Cu50=Ti9Cu9, where the CN14 rhombi-dodecahedron Ti9Cu6 was the principal cluster in the devitrification phase CuTi. This basic cluster formula was further alloyed with Zr and Sn and a critical glass forming ability was reached at (Ti7.2Zr1.8)(Cu8.72Sn0.28) and (Ti7.2Zr1.8)(Cu8.45Sn0.55) up to 5 mm in diameter by suction casting, which was the largest in Ti-Cu-based and Ni-, Pd- and Be-free alloys.

  14. Effet Hall et Magnetisme des Alliages Amorphes Nickel-Zirconium Fabriques Par Pulverisation

    NASA Astrophysics Data System (ADS)

    Morel, Robert

    Cette these se situe dans le cadre d'une etude des proprietes electroniques et structurales des alliages metalliques amorphes, en cours depuis quelques annees a l'Universite de Montreal. Ce programme nous a entre autres amene a caracteriser la magnetoresistivite et l'effet Hall d'alliages FeZr, CoZr et NiZr, ce qui a permis de mettre en evidence deux caracteristiques de l'effet Hall: Dans les alliages amorphes ferromagnetiques, la resistivite elevee engendre un effet Hall extraordinaire beaucoup plus important que celui enregistre dans les metaux cristallins. La polarisation des spins entrai ne une asymetrie de la diffusion qui, tant dans les phases cristalline et amorphe, est tenue responsable de cette contribution. L'autre particularite du comportement de Hall de ces systemes est le renversement de signe du coefficient de Hall ordinaire, qui passe du negatif au positif dans les echantillons plus riches en zirconium. Dans les metaux cristallins, un modele d'electrons libres predit un signe negatif a moins que la conduction ne soit dominee par les trous. Or, dans un milieu desordonne les memes concepts sont difficilement applicables et de nouvelles theories ont du etre elaborees pour expliquer ce phenomene. Jusqu'a maintenant, l'etude des alliages amorphes nickel-zirconium s'est faite surtout a partir d'echantillons fabriques par trempe sur roue. Malheureusement cette technique ne permet pas la fabrication d'alliages contenant plus de 70% de nickel, a l'exception du seul compose Ni _{90}Zr_{10 }. Pour pallier a cette lacune et etendre nos connaissance a l'ensemble de la gamme de compositions, nous avons fabrique par pulverisation cathodique des echantillons NiZr amorphes--et quelques alliages cristallins tres riches en nickel--couvrant une bonne partie de la gamme interdite par la technique de trempe sur roue. Dans un premier temps, par comparaison avec les resultats connus nous avons mis en evidence les similitudes et les differences entre les alliages obtenus par

  15. Solid-state coexistence of {Zr 12 } and {Zr 6 } zirconium oxocarboxylate clusters

    SciTech Connect

    Malaestean, Iurie L.; Alıcı, Meliha Kutluca; Besson, Claire; Ellern, Arkady; Kögerler, Paul

    2014-01-01

    Ligand metathesis, Co(II) coordination, and partial condensation reactions of an archetypal {Zr6} zirconium oxocarboxylate cluster result in the first example of the coexistence of the distinct zirconium oxide frameworks {Zr6O8} and {Zr12O22}. Even minor modifications to the reaction conditions push this apparent equilibrium towards the {Zr6O8}-based product.

  16. Effects of Zr and Si on the Glass Forming Ability and Compressive Properties of Ti-Cu-Co-Sn Alloys

    NASA Astrophysics Data System (ADS)

    Wang, Tan; Wu, Yidong; Si, Jiajia; Hui, Xidong

    2015-06-01

    To succeed in finding novel Ti-based bulk metallic glasses, which are free from Be, Ni, and noble metallic elements, a comprehensive study was performed on the effects of Zr and Si on the microstructural evolution, glass-forming ability (GFA), and mechanical properties of Ti46Cu44- x Zr x Co7Sn3 ( x = 0, 5, 10, 12.5, and 16 at. pct) and Ti46Cu31.5Zr12.5- x Co7Sn3Si x ( x = 0.5, 1, and 1.5 at. pct) alloys. It is shown that with the increase of Zr, the sequence of phase formation is β-Ti + α-Ti + (Ti, Zr)3Cu4 ⇒ β-Ti + α-Ti + TiCu ⇒ β-Ti + Ti2Cu + glass ⇒ glass ⇒ β-Ti + Ti2Cu + TiCuSn. The quinary Ti-Zr-Cu-Co-Sn alloy with 12.5 pct Zr exhibits the best GFA. The addition of 1 pct Si results in the improvement of the critical size of glassy rods up to 3 mm in diameter. The yield stress and Young's modulus of Z-series alloys increases, and the plastic strain decreases with the addition of Zr. The yield stress and ultimate compression stress of Ti46Zr11.5Cu31.5Co7Sn3Si1 glassy alloy reach 2477.9 and 2623.3 MPa, respectively. It was found that the addition of Si promotes the generation and multiplication of shear bands, resulting in certain plasticity in these kinds of glassy alloys.

  17. Magnetic properties of Fe/Zr multilayers

    SciTech Connect

    Dubowik, J.; Stobiecki, F.; Szymanski, B.

    1994-03-01

    Measurements of ferromagnetic resonance (FMR), magnetic moment, and torque curves have been made for three series of Fe/Zr multilayers (MLs) with thickness ratio of Fe to Zr sublayers equal to 2:1, 1:1, and 1:2, respectively. The authors show that Fe/Zr MLs readily yield to amorphization by a solid-state reaction (SSR) during the deposition process. Nevertheless, the resulting structure may be regarded as inhomogeneous one; there still exist some ferromagnetic phases that they relate to the Fe atoms in various surroundings.

  18. Novel Processing of Infrared Transmitting ZrO2-ZrW2O8 Nanocomposites

    DTIC Science & Technology

    2013-09-01

    oxides reacted with Zr(W,Mo)208. Attempts to process fully dense nanocomposite by traditional sintering were not successful. Highest density we were able...porosity and grain size . The choice of sintering temperature, in this case, is dictated by the high temperature stability of Zr(W,Mo)208 compound. The...transmittance of nanocrystalline Zr(W,Mo)20g compacts need to be established. In previous grant period, we synthesized nano powders and single crystals of

  19. Microstructural Evolution of the Interface Between Pure Titanium and Low Melting Point Zr-Ti-Ni(Cu) Filler Metals

    NASA Astrophysics Data System (ADS)

    Lee, Dongmyoung; Sun, Juhyun; Kang, Donghan; Shin, Seungyoung; Hong, Juhwa

    2014-12-01

    Low melting point Zr-based filler metals with melting point depressants (MPDs) such as Cu and Ni elements are used for titanium brazing. However, the phase transition of the filler metals in the titanium joint needs to be explained, since the main element of Zr in the filler metals differs from that of the parent titanium alloys. In addition, since the MPDs easily form brittle intermetallics, that deteriorate joint properties, the phase evolution they cause needs to be studied. Zr-based filler metals having Cu content from 0 to 12 at. pct and Ni content from 12 to 24 at. pct with a melting temperature range of 1062 K to 1082 K (789 °C to 809 °C) were wetting-tested on a titanium plate to investigate the phase transformation and evolution at the interface between the titanium plate and the filler metals. In the interface, the alloys system with Zr, Zr2Ni, and (Ti,Zr)2Ni phases was easily changed to a Ti-based alloy system with Ti, Ti2Ni, and (Ti,Zr)2Ni phases, by the local melting of parent titanium. The dissolution depths of the parent metal were increased with increasing Ni content in the filler metals because Ni has a faster diffusion rate than Cu. Instead, slow diffusion of Cu into titanium substrate leads to the accumulation of Cu at the molten zone of the interface, which could form undesirable Ti x Cu y intermetallics. This study confirmed that Zr-based filler metals are compatible with the parent titanium metal with the minimum content of MPDs.

  20. Nanostructured FeZrCuB alloys prepared by mechanosynthesis

    SciTech Connect

    Pereira, R. D.; Passamani, E. C.; Larica, C.; Freitas, J. C. C.; Takeuchi, A. Y.

    2007-08-01

    Nanostructured Fe{sub 84}Zr{sub 9}B{sub 6}Cu{sub 1} alloys were prepared by the mechanosynthesis method, following two alternative routes. In the first procedure, the alloy was directly obtained from the milling of the powder mixture of all elemental components. The resulting alloy was partially nanocrystalline, with dispersion of nanograins in an amorphous matrix. In the second route, Cu and B elemental powders were progressively added to a previously milled Fe{sub 90}Zr{sub 10} alloy. A nearly single amorphous phase was consequently obtained. The dispersion of nanograins was easily recovered in this case, after annealing the milled alloy. The hyperfine magnetic properties of the amorphous phase prepared by milling were comparable to those found in similar melt-spun alloys. The crystallization temperatures and activation energies, associated with the first and second crystallization stages, were found to be lower for the milled alloy when compared with the corresponding melt-spun alloy, an effect associated with the larger number of defects induced by the mechanosynthesis process.

  1. Microstructure and Room Temperature Properties of a High-Entropy TaNbHfZrTi Alloy (Postprint)

    DTIC Science & Technology

    2014-04-01

    AND ROOM TEMPERATURE PROPERTIES OF A HIGH - ENTROPY TaNbHfZrTi ALLOY (POSTPRINT) 5a. CONTRACT NUMBER In-house 5b. GRANT NUMBER 5c. PROGRAM...is worth noting that, among all other high entropy alloys with the BCC structure produced so far, the Ta20Nb20Hf20Zr20Ti20 alloy has the highest RT...concentration of the matrix element (solvent) exceeds 60–70%, and these mechanisms may not be applicable to high - entropy alloys , where all elements are at

  2. Phase evolution, microstructure and mechanical properties of equi-atomic substituted TiZrHfNiCu and TiZrHfNiCuM (M = Co, Nb) high-entropy alloys

    NASA Astrophysics Data System (ADS)

    Park, Hae Jin; Na, Young Sang; Hong, Sung Hwan; Kim, Jeong Tae; Kim, Young Seok; Lim, Ka Ram; Park, Jin Man; Kim, Ki Buem

    2016-07-01

    In this study, alloys with composition of equi-atomic substituted TiZrHfNiCu, TiZrHfNiCuCo, and TiZrHfNiCuNb high-entropy alloys (HEAs) were produced by suction casting method. The effects of addition elements on phase composition, microstructure and mechanical behaviors of the HEA were studied. The suction casted Ti20Zr20Hf20Ni20Cu20 HEA exhibits single C14 Laves phase (MgZn2-type) with fine homogeneous microstructure. When Co or Nb elements are added, morphologies are slightly modulated toward well-developed dendritic microstructure, phase constitutions are significantly changed from single Laves phase to mixed multi-phases as well as mechanical properties are also altered with increased plasticity and high strength. It is believed that modulated mechanical properties are mainly ascribed to the change of phase constitution and crystalline structure, together with the microstructural characteristics. This clearly reveals that the selection and addition of supplementary elements based on the formation rule for HEAs play an important role on the evolution of phase, microstructural morphology and mechanical properties of Ti20Zr20Hf20Ni20Cu20 HEA.

  3. Maladie des vibrations

    PubMed Central

    Shen, Shixin (Cindy); House, Ronald A.

    2017-01-01

    Résumé Objectif Permettre aux médecins de famille de comprendre l’épidémiologie, la pathogenèse, les symptômes, le diagnostic et la prise en charge de la maladie des vibrations, une maladie professionnelle importante et courante au Canada. Sources d’information Une recherche a été effectuée sur MEDLINE afin de relever les recherches et comptes rendus portant sur la maladie des vibrations. Une recherche a été effectuée sur Google dans le but d’obtenir la littérature grise qui convient au contexte canadien. D’autres références ont été tirées des articles relevés. Message principal La maladie des vibrations est une maladie professionnelle répandue touchant les travailleurs de diverses industries qui utilisent des outils vibrants. La maladie est cependant sous-diagnostiquée au Canada. Elle compte 3 éléments : vasculaire, sous la forme d’un phénomène de Raynaud secondaire; neurosensoriel; et musculosquelettique. Aux stades les plus avancés, la maladie des vibrations entraîne une invalidité importante et une piètre qualité de vie. Son diagnostic exige une anamnèse minutieuse, en particulier des antécédents professionnels, un examen physique, des analyses de laboratoire afin d’éliminer les autres diagnostics, et la recommandation en médecine du travail aux fins d’investigations plus poussées. La prise en charge consiste à réduire l’exposition aux vibrations, éviter les températures froides, abandonner le tabac et administrer des médicaments. Conclusion Pour assurer un diagnostic rapide de la maladie des vibrations et améliorer le pronostic et la qualité de vie, les médecins de famille devraient connaître cette maladie professionnelle courante, et pouvoir obtenir les détails pertinents durant l’anamnèse, recommander les patients aux cliniques de médecine du travail et débuter les demandes d’indemnisation de manière appropriée. PMID:28292812

  4. Template-directed synthesis and characterization of microstructured ceramic Ce/ZrO2@SiO2 composite tubes

    PubMed Central

    Naumann, Meike

    2014-01-01

    Summary An exo-templating synthesis process using polymeric fibers and inorganic sol particles deposited onto structured one-dimensional objects is presented. In particular, CeO2/ZrO2@SiO2 composite tubes were synthesized in a two-step procedure by using electrospun polystyrene fibers as fiber template. First, a sol–gel approach based on an exo-templating technique was employed to obtain polystyrene(PS)/SiO2 composite fibers. These composite fibers were subsequently covered by spray-coating with ceria and zirconia sol solutions. After drying and final calcination of the green body composites, the PS polymer template was removed, and composite tubes of the composition CeO2/ZrO2@SiO2 were obtained. The SiO2/ZrO2/CeO2 microtubes, which consist of interconnected silica particles, are held together by ceria and zirconia deposits formed during the thermal treatment process. These microtubes are mainly located in the pendentive connecting the individual spherical silica particles and glue them together. The composition and crystallinity of this material connecting the individual silica particles contains the elements Ce and Zr and O as mixed oxide solid solution identified by XRD, Raman and high-resolution TEM and EFTEM. High-resolution microscopy techniques allowed for an elemental mapping on the surface of the silica host structure and determination of the O, Zr and Ce elemental distribution with nm precision. PMID:25161848

  5. Bio-corrosion and cytotoxicity studies on novel Zr55Co30Ti15 and Cu60Zr20Ti20 metallic glasses

    DOE PAGES

    Vincent, S.; Daiwile, A.; Devi, S. S.; ...

    2014-09-26

    Metallic glasses are a potential and compatible implant candidate for biomedical applications. In the present investigation, a comparative study between novel Zr55Co30Ti15 and Cu60Zr20Ti20 metallic glasses is carried out to evaluate in vitro biocompatibility using simulated body fluids. The bio-corrosion behavior of Zr- and Cu-based metallic glasses in different types of artificial body fluids such as artificial saliva solution, phosphate-buffered saline solution, artificial blood plasma solution, and Hank’s balanced saline solution is evaluated using potentiodynamic polarization studies at a constant body temperature of 310.15 K (37 °C). Surface morphology of samples after bio-corrosion experiments was observed by scanning electron microscopy.more » In vitro cytotoxicity test on glassy alloys were performed using human osteosarcoma cell line as per 10993-5 guidelines from International Organization for Standardization. As a result, the comparative study between Zr- and Cu-based glassy alloys provides vital information about the effect of elemental composition on biocompatibility of metallic glasses.« less

  6. Bio-corrosion and Cytotoxicity Studies on Novel Zr55Co30Ti15 and Cu60Zr20Ti20 Metallic Glasses

    NASA Astrophysics Data System (ADS)

    Vincent, S.; Daiwile, A.; Devi, S. S.; Kramer, M. J.; Besser, M. F.; Murty, B. S.; Bhatt, Jatin

    2014-09-01

    Metallic glasses are a potential and compatible implant candidate for biomedical applications. In the present investigation, a comparative study between novel Zr55Co30Ti15 and Cu60Zr20Ti20 metallic glasses is carried out to evaluate in vitro biocompatibility using simulated body fluids. The bio-corrosion behavior of Zr- and Cu-based metallic glasses in different types of artificial body fluids such as artificial saliva solution, phosphate-buffered saline solution, artificial blood plasma solution, and Hank's balanced saline solution is evaluated using potentiodynamic polarization studies at a constant body temperature of 310.15 K (37 °C). Surface morphology of samples after bio-corrosion experiments was observed by scanning electron microscopy. In vitro cytotoxicity test on glassy alloys were performed using human osteosarcoma cell line as per 10993-5 guidelines from International Organization for Standardization. The comparative study between Zr- and Cu-based glassy alloys provides vital information about the effect of elemental composition on biocompatibility of metallic glasses.

  7. Bio-corrosion and Cytotoxicity Studies on Novel Zr55Co30Ti15 and Cu60Zr20Ti20 Metallic Glasses

    NASA Astrophysics Data System (ADS)

    Vincent, S.; Daiwile, A.; Devi, S. S.; Kramer, M. J.; Besser, M. F.; Murty, B. S.; Bhatt, Jatin

    2015-06-01

    Metallic glasses are a potential and compatible implant candidate for biomedical applications. In the present investigation, a comparative study between novel Zr55Co30Ti15 and Cu60Zr20Ti20 metallic glasses is carried out to evaluate in vitro biocompatibility using simulated body fluids. The bio-corrosion behavior of Zr- and Cu-based metallic glasses in different types of artificial body fluids such as artificial saliva solution, phosphate-buffered saline solution, artificial blood plasma solution, and Hank's balanced saline solution is evaluated using potentiodynamic polarization studies at a constant body temperature of 310.15 K (37 °C). Surface morphology of samples after bio-corrosion experiments was observed by scanning electron microscopy. In vitro cytotoxicity test on glassy alloys were performed using human osteosarcoma cell line as per 10993-5 guidelines from International Organization for Standardization. The comparative study between Zr- and Cu-based glassy alloys provides vital information about the effect of elemental composition on biocompatibility of metallic glasses.

  8. Determination of the direct double- β -decay Q value of Zr 96 and atomic masses of Zr 90 - 92 , 94 , 96 and Mo 92 , 94 - 98 , 100

    DOE PAGES

    Gulyuz, K.; Ariche, J.; Bollen, G.; ...

    2015-05-06

    Experimental searches for neutrinoless double-β decay offer one of the best opportunities to look for physics beyond the standard model. Detecting this decay would confirm the Majorana nature of the neutrino, and a measurement of its half-life can be used to determine the absolute neutrino mass scale. Important to both tasks is an accurate knowledge of the Q value of the double-β decay. The LEBIT Penning trap mass spectrometer was used for the first direct experimental determination of the ⁹⁶Zr double-β decay Q value: Qββ=3355.85(15) keV. This value is nearly 7 keV larger than the 2012 Atomic Mass Evaluation [M.more » Wang et al., Chin. Phys. C 36, 1603 (2012)] value and one order of magnitude more precise. The 3-σ shift is primarily due to a more accurate measurement of the ⁹⁶Zr atomic mass: m(⁹⁶Zr)=95.90827735(17) u. Using the new Q value, the 2νββ-decay matrix element, |M2ν|, is calculated. Improved determinations of the atomic masses of all other zirconium (90-92,94,96Zr) and molybdenum (92,94-98,100Mo) isotopes using both ¹²C₈ and ⁸⁷Rb as references are also reported.« less

  9. Incommensurate modulated structure study of a Cu-Zn-Al-Zr phase

    SciTech Connect

    Chung, C.Y.; Zou, W.H.; Han, X.D.; Lam, C.W.H.; Lai, J.K.L.; Gao, M.; Duan, X.F.

    1998-09-18

    Zr was added to Cu-Zn-Al shape memory alloy as a grain refinement element. There are two new phases, Cu{sub 50.2}Zr{sub 24.6}Al{sub 17.3}Zn{sub 7.9} (at%) (Z{sub 1} phase) and Cu{sub 57.4}Zr{sub 20.4}Zn{sub 10.3}Al{sub 11.9} (at%) (Z{sub 2}) phase is studied in detail in the present paper. The results of electron diffraction and high-resolution electron microscopy (HREM) investigations indicated a one-dimensional incommensurate modulated structure in the Z{sub 2} phase. The average structure of the phase is base-centered orthorhombic. The systematic reflection conditions associated with the main and satellite reflections demonstrate that the Bravais class of the Z{sub 2} phases is P{sub 11{bar 1}}{sup Cmmm} type in a (3 + 1) dimensional space for the incommensurate modulated structure. The substitution modulation effects of the Al and Zr elements are revealed by energy-filtered transmission electron microscopy (EFTEM), {l_brace}1{bar 3}{bar 2}{r_brace} compound-type twins are observed in the Z{sub 2} phase. The relationship between the Z{sub 1} and Z{sub 2} phases in the alloy is discussed.

  10. Des Vents et des Jets Astrophysiques

    NASA Astrophysics Data System (ADS)

    Sauty, C.

    well expected result from the theory. Although, collimation may be conical, paraboloidal or cylindrical (Part 4), cylindrical collimation is the more likely to occur. The shape of outflows may then be used as a tool to predict physical conditions on the flows or on their source. L'éjection continue de plasma autour d'objets massifs est un phénomène largement répandu en astrophysique, que ce soit sous la forme du vent solaire, de vents stellaires, de jets d'étoiles en formation, de jets stellaires autour d'objets compacts ou de jets extra-galactiques. Cette zoologie diversifiée fait pourtant l'objet d'un commun effort de modélisation. Le but de cette revue est d'abord de présenter qualitativement le développement, depuis leur origine, des diverses théories de vents (Partie 1) et l'inter disciplinarité dans ce domaine. Il s'agit d'une énumération, plus ou moins exhaustive, des idées proposées pour expliquer l'accélération et la morphologie des vents et des jets, accompagnée d'une présentation sommaire des aspects observationnels. Cette partie s'abstient de tout aspect faisant appel au formalisme mathématique. Ces écoulements peuvent être décrits, au moins partiellement, en résolvant les équations magnétohydrodynamiques, axisymétriques et stationnaires. Ce formalisme, à la base de la plupart des théories, est exposé dans la Partie 2. Il permet d'introduire quantitativement les intégrales premières qu'un tel système possède. Ces dernières sont amenées à jouer un rôle important dans la compréhension des phénomènes d'accélération ou de collimation, en particulier le taux de perte de masse, le taux de perte de moment angulaire ou l'énergie du rotateur magnétique. La difficulté de modélisation réside dans l'existence de points critiques, propres aux équations non linéaires, qu'il faut franchir. La nature physique et la localisation de ces points critiques fait l'objet d'un débat important car ils sont la clef de voute de la r

  11. Growth and microstructure formation of isothermally-solidified Zircaloy-4 joints brazed by a Zr-Ti-Cu-Ni amorphous alloy ribbon

    NASA Astrophysics Data System (ADS)

    Kim, K. H.; Lim, C. H.; Lee, J. G.; Lee, M. K.; Rhee, C. K.

    2013-10-01

    The microstructure and growth characteristics of Zircaloy-4 joints brazed by a Zr48Ti16Cu17Ni19 (at.%) amorphous filler metal have been investigated with regard to the controlled isothermal solidification and intermetallic formation. Two typical joints were produced depending on the isothermal brazing temperature: (1) a dendritic growth structure including bulky segregation in the central zone (at 850 °C), and (2) a homogeneous dendritic structure throughout the joint without segregation (at 890 °C). The primary α-Zr phase was solidified isothermally, nucleating to grow into a joint with a cellular or dendritic structure. Also, the continuous Zr2Ni and particulate Zr2Cu phases were formed in the segregated center zone and at the intercellular region, respectively, owing to the different solubility and atomic mobility of the solute elements (Ti, Cu, and Ni) in the α-Zr matrix. A disappearance of the central Zr2Ni phase was also rate-controlled by the outward diffusion of the Cu and Ni elements. When the detrimental Zr2Ni intermetallic phase was eliminated by a complete isothermal solidification at 890 °C, the strengths of the joints were high enough to cause yielding and fracture in the base metal, exceeding those of the bulk Zircaloy-4, at room temperature as well as at elevated temperatures (up to 400 °C).

  12. Zr/Nb isobar separation experiment for future 93Zr AMS measurement

    NASA Astrophysics Data System (ADS)

    Lu, W.; Anderson, T.; Bowers, M.; Bauder, W.; Collon, P.; Kutschera, W.; Kashiv, Y.; Lachner, J.; Martschini, M.; Ostdiek, K.; Robertson, D.; Schmitt, C.; Skulski, M.; Steier, P.

    2015-10-01

    93Zr (t1/2 = 1.6 Ma) is mostly produced by the main s-process in low-to-intermediate mass AGB stars. Large uncertainty exists in the current 92Zr(n,γ)93Zr Maxwellian Average cross section. This could have significant impact on nucleosynthesis calculations. Large amounts of 93Zr are also produced in nuclear reactors and pose long-term environmental radioactivity. Hence, measurement of 93Zr by the AMS is important for both fields above. We report here on progress in the development of AMS method to measure 93Zr. Compared with 98 MeV beam energy, Zr/Nb isobar position separation was improved using 155.2 MeV beam energy and Gas-Filled Magnet. Energy loss measurement with increased beam energy inside the detector indicates that higher beam energy can improve isobar energy loss separation. A chemical procedure to reduce the Nb content in Zr samples has been developed and tested. It reduces the 93Nb content by a factor of 1000.

  13. Determination des Parametres Atmospheriques des Etoiles Naines Blanches de Type DB

    NASA Astrophysics Data System (ADS)

    Beauchamp, Alain

    1995-01-01

    Les etoiles naines blanches dont les spectres visibles sont domines par des raies fortes d'helium neutre sont subdivisees en trois classes, DB (raies d'helium neutre seulement), DBA (raies d'helium neutre et d'hydrogene) et DBZ (raies d'helium neutre et d'elements lourds). Nous analysons trois echantillons de spectres observes de ces types de naines blanches. Les echantillons consistent, respectivement, de 48 spectres dans le domaine du visible (3700-5100 A). 24 dans l'ultraviolet (1200-3100 A) et quatre dans la partie rouge du visible (5100-6900) A). Parmi les objets de l'echantillon visible, nous identifions quatre nouvelles DBA, ainsi que deux nouvelles DBZ, auparavant classees DB. L'analyse nous permet de determiner spectroscopiquement les parametres atmospheriques, soit la temperature effective, la gravite de surface, ainsi que l'abondance relative de l'hydrogene, N(H)/N(He), dans le cas des DBA. Pour les objets plus chauds que ~15,000 K, la gravite de surface determinee est fiable, et nous obtenons les masses stellaires avec une relation masse -rayon theorique. Les exigences propres a l'analyse de ces objets ont requis d'importantes ameliorations dans la modelisation de leurs atmospheres et distributions de flux de radiation emis par ces derniers. Nous avons inclus dans les modeles d'atmospheres, pour la premiere fois a notre connaissance, les effets dus a la molecule He_sp{2 }{+}, ainsi que l'equation d'etat de Hummer et Mihalas (1988), qui tient compte des perturbations entre particules dans le calcul des populations des differents niveaux atomiques. Nous traitons la convection dans le cadre de la theorie de la longueur de melange. Trois grilles de modeles d'atmospheres a l'ETL (equilibre thermodynamique local) ont ete produites, pour un ensemble de temperatures effectives, gravites de surface et abondances d'hydrogene couvrant les proprietes des etoiles de nos echantillons; elles sont caracterisees par differentes parametrisations appelees, respectivement

  14. How Zr/Hf and gd Anomaly Signatures can Depict Solid-Liquid Interactions in Seawater

    NASA Astrophysics Data System (ADS)

    Censi, P.; Raso, M.; Saiano, F.; Zuddas, P.

    2012-04-01

    Natural positive La, Gd e Lu anomalies in seawater have been explained by larger stability of these elements in dissolved phase with respect to the neighbor Lanthanides, when these elements are not related to anthropogenic input (Kulaksiz and Bau, 2011 and references therein). Here we report original measurements based on the systematic investigation of Earth Rare Elements, Zr and Hf concentrations in the water column of Mediterranean Sea indicating the occurrence of positive Gd anomalies in open marine conditions. Obtained results indicate that amplitudes of positive Gd anomaly are strongly linearly related to Zr/Hf ratio values in shallowest water layers from (0-200 m depth) and at the oxic seawater-anoxic brine interface (3200-3400 m depth), whereas this relationship disappears along the oxic seawater column (200-3200 m depth). Several papers investigated implications of occurrence of suspended Mn oxides and Fe-oxyhydroxides in particulates of seawater column on the dissolved REE distribution mainly according to laboratory experiments (Bau and Koschinsky, 2009 and references therein), whereas the aqueous behaviour of tetravalent Zr and Hf was essentially related to processes occurring onto hydrous Fe oxides surfaces (Bau and Koschinsky, 2006). Therefore the recognition of the above mentioned relationship between Gd/Gd* and Zr/Hf in seawater indicates that REE, Zr and Hf fates are driven by the same phenomenon, namely the scavenging onto Fe-oxyhydroxides. These materials certainly play an important role both in shallow waters because they are main components of Fe-rich coating of atmospheric dust that dissolves therein inducing the early formation of authigenic Fe-oxyhydroxides. Moreover Fe rich antigenic materials sinking along the water column dissolve at seawater-brine interface where redox Fe cycling occurs and poorly soluble Fe(II)-bearing phases can crystallize in brines under reductive conditions. On the contrary the Zr/Hf vs. Gd/Gd* linear relationship is

  15. Etude du processus de changement vecu par des familles ayant decide d'adopter volontairement des comportements d'attenuation des changements climatiques

    NASA Astrophysics Data System (ADS)

    Leger, Michel T.

    recension des ecrits sur le changement de comportement en environnement. Nous explorons egalement la famille comme systeme fonctionnel de sorte a mieux comprendre ce contexte d'action environnementale qui est, a notre connaissance, peu etudie. Dans le deuxieme article, nous presentons nos resultats de recherche concernant les facteurs d'influence observes ainsi que les competences manifestees au cours du processus d'adoption de nouveaux comportements environnementaux dans trois familles. Enfin, le troisieme article presente les resultats du cas d'une quatrieme famille ou les membres vivent depuis longtemps des modes de vie ecologique. Dans le cadre d'une demarche d'analyse par theorisation ancree, l'etude de ce cas modele nous a permis d'approfondir les categories conceptuelles identifiees dans le deuxieme article de sorte a produire une modelisation de l'integration de comportements environnementaux dans le contexte de la famille. Les conclusions degagees grace a la recension des ecrits nous ont permis d'identifier les elements qui pourraient influencer l'adoption de comportements environnementaux dans des familles. La recension a aussi permis une meilleure comprehension des divers facteurs qui peuvent affecter l'adoption de comportements environnementaux et, enfin, elle a permis de mieux cerner le phenomene de changement de comportement dans le contexte de la famille consideree comme un systeme. En appliquant un processus d'analyse inductif, a partir de nos donnees qualitatives, les resultats de notre etude multi-cas nous ont indique que deux construits conceptuels semblent influencer l'adoption de comportements environnementaux en famille : 1) les valeurs biospheriques communes au sein de la famille et 2) les competences collectivement mises a profit collectivement durant l'essai de nouveaux comportements environnementaux. Notre modelisation du processus de changement dans des familles indique aussi qu'une dynamique familiale collaborative et la presence d'un groupe de

  16. The distribution of trace elements in carbonaceous chondrites

    NASA Astrophysics Data System (ADS)

    Knab, H.-J.

    1981-09-01

    Twelve carbonaceous chondrites, among them representatives of nearly all known petrologic types, were analyzed for twenty trace elements by spark source mass spectrography combined with the isotope dilution method. Data on different element groups (refractory, moderately volatile and volatile) show that the distribution of the trace elements in the carbonaceous chondrites, with the exception of Renazzo, can be well explained by Anders' two-component model. This is also valid for the highly metamorphosed CV5 chondrite Karoonda. Furthermore, it is observed that the Zr/Hf-ratios in the carbonaceous chondrites increase with increasing petrologic type, which is interpreted as the result of mixing two components with different Zr/Hf-ratios.

  17. Properties of Porous TiNbZr Shape Memory Alloy Fabricated by Mechanical Alloying and Hot Isostatic Pressing

    NASA Astrophysics Data System (ADS)

    Ma, L. W.; Chung, C. Y.; Tong, Y. X.; Zheng, Y. F.

    2011-07-01

    In the past decades, systematic researches have been focused on studying Ti-Nb-based SMAs by adding ternary elements, such as Mo, Sn, Zr, etc. However, only arc melting or induction melting methods, with subsequent hot or cold rolling, were used to fabricate these Ni-free SMAs. There is no work related to powder metallurgy and porous structures. This study focuses on the fabrication and characterization of porous Ti-22Nb-6Zr (at.%) shape memory alloys produced using elemental powders by means of mechanical alloying and hot isostatic pressing. It is found that the porous Ti-22Nb-6Zr alloys prepared by the HIP process exhibit a homogenous pore distribution with spherical pores, while the pores have irregular shape in the specimen prepared by conventional sintering. X-ray diffraction analysis showed that the solid solution-treated Ti-22Nb-6Zr alloy consists of both β phase and α″ martensite phase. Morphologies of martensite were observed. Finally, the porous Ti-22Nb-6Zr SMAs produced by both MA and HIP exhibit good mechanical properties, such as superior superelasticity, with maximum recoverable strain of ~3% and high compressive strength.

  18. Nanoindentation of ZrO2 and ZrO2/Zr systems by molecular dynamics simulation

    NASA Astrophysics Data System (ADS)

    Lu, Zizhe; Chernatynskiy, Aleksandr; Noordhoek, Mark J.; Sinnott, Susan B.; Phillpot, Simon R.

    2017-04-01

    The deformation behaviors of cubic zirconia and a cubic zirconia thin film on top of an hcp zirconium substrate are investigated using molecular dynamics nanoindentation simulation. Interatomic interactions are described by the previously developed Charge Optimized Many Body (COMB) potential for the Zr-ZrO2-O2 system. The load-displacement curves, deformation processes and hardnesses of zirconia and the zirconia/zirconium systems are characterized. In addition, by comparing with a previous nanoindentation simulation on zirconium, the effects of the zirconia layer on top on the mechanical properties of the zirconium substrate are determined.

  19. Processing of U-2.5Zr-7.5Nb and U-3Zr-9Nb alloys by sintering process

    SciTech Connect

    Dos Santos, A. M. M.; Ferraz, W. B.; Lameiras, F. S.; Mazzeu, T. D. O.

    2012-07-01

    To minimize the risk of nuclear proliferation, there is worldwide interest in reducing fuel enrichment of research and test reactors. To achieve this objective while still guaranteeing criticality and cycle length requirements, there is need of developing high density uranium metallic fuels. Alloying elements such as Zr, Nb and Mo are added to uranium to improve fuel performance in reactors. In this context, the Centro de Desenvolvimento da Tecnologia Nuclear (CDTN) is developing the U-2.5Zr-7.5Nb and U-3Zr-9Nb (weight %) alloys by the innovative process of sintering that utilizes raw materials in the form of powders. The powders were pressed at 400 MPa and then sintered under a vacuum of about 1x10{sup -4} Torr at temperatures ranging from 1050 deg. to 1500 deg.C. The densities of the alloys were measured geometrically and by hydrostatic method and the phases identified by X ray diffraction (XRD). The microstructures of the pellets were observed by scanning electron microscopy (SEM) and the alloying elements were analyzed by energy dispersive X-ray spectroscopy (EDS). The results obtained showed the fuel density to slightly increase with the sintering temperature. The highest density achieved was approximately 80% of theoretical density. It was observed in the pellets a superficial oxide layer formed during the sintering process. (authors)

  20. Novel approach to Zr powder production by smooth ZrCl4 bubbling through molten salt

    NASA Astrophysics Data System (ADS)

    Bae, Hyun-Na; Choi, Mi-Seon; Lee, Go-Gi; Kim, Seon-Hyo

    2016-01-01

    A reduction process using ZrCl4 bubbles as a reactant was investigated to produce zirconium metals. ZrCl4 vapor was bubbled through the lance in the bath, in which Mg melt and MgCl2 salt were separated. Zr powder was formed by a reduction of ZrCl4 bubbles in magnesium layer. However, the lance was clogged by the aggregate of zirconium occurred during ZrCl4 vapor injecting leading to interruption of ZrCl4 supply into the bath. This phenomenon could be caused by the presence of magnesium at the lance tip, which passes through MgCl2 salt during bubbling, and then zirconium was formed in the forms of intermetallic compounds with aluminum. In this study, the effect of molten salt on the troubled phenomena was investigated and it was verified that CaCl2 with relatively low Weber number meaning relatively high surface tension as molten salt is effective in inhibiting the lance clogging phenomena. Then, a few micrometer-sized Zr powder with the high purity of 91.6 wt% was obtained smoothly without the formation of intermetallic compound.

  1. Strengthening mechanisms in Ti-Nb-Zr-Ta and Ti-Mo-Zr-Fe orthopaedic alloys.

    PubMed

    Banerjee, Rajarshi; Nag, Soumya; Stechschulte, John; Fraser, Hamish L

    2004-08-01

    The microstructural evolution and attendant strengthening mechanisms in two novel orthopaedic alloy systems, Ti-Nb-Zr-Ta and Ti-Mo-Zr-Fe, have been compared and contrasted in this paper. Specifically, the alloy compositions considered are Ti-34Nb-9Zr-8Ta and Ti-13Mo-7Zr-3Fe. In the homogenized condition, both alloys exhibited a microstructure consisting primarily of a beta matrix with grain boundary alpha precipitates and a low-volume fraction of intra-granular alpha precipitates. On ageing the homogenized alloys at 600 degrees C for 4 hr, both alloys exhibited the precipitation of refined scale secondary alpha precipitates homogeneously in the beta matrix. However, while the hardness of the Ti-Mo-Zr-Fe alloy marginally increased, that of the Ti-Nb-Zr-Ta alloy decreased substantially as a result of the ageing treatment. In order to understand this difference in the mechanical properties after ageing, TEM studies have been carried out on both alloys prior to and post the ageing treatment. The results indicate the existence of a metastable B2 ordering in the Ti-Nb-Zr-Ta alloy in the homogenized condition which is destroyed by the ageing treatment, consequently leading to a decrease in the hardness.

  2. Photon strength function of 97Zr

    NASA Astrophysics Data System (ADS)

    Mosby, Shea; Couture, Aaron; Lee, Hye Young

    2015-10-01

    Some of the major questions in stockpile stewardship require nuclear reaction rates on fission fragments where there are few or no experimental constraints. Theoretical calculations are an alternative, but their reliability is ultimately limited by our incomplete understanding of such physics inputs as the photon strength function. 96Zr lies near the light mass peak for 239Pu fission, and neutron capture on and near this nucleus is of great importance for applications. The DANCE array at LANSCE and the Apollo array coupled to HELIOS at Argonne National Laboratory offer complementary probes into the neutron capture reaction, and an experimental campaign is underway to study 96Zr(n, γ) and 96Zr(d , p) with these instruments. The status of these reaction studies will be presented.

  3. Fractionation of traffic-emitted Ce, La and Zr in road dusts.

    PubMed

    Lyubomirova, Valentina; Djingova, Rumyana; van Elteren, Johannes T

    2011-06-01

    The introduction of catalytic converters has led to a new environmental problem since catalysts emit platinum group elements (PGEs) which are among the least distributed elements in nature. Along with PGEs the vehicle exhaust catalysts contain also a number of stabilizers, commonly oxides of rare earth elements and alkaline earth elements such as Ce, La and Zr. Since vehicular emission of these elements has received little attention so far this work attempts to offer insight into their distribution and fate in the environment by measuring their speciation in road dust samples collected along several highways in Germany and a city centre (Saarbrücken). Speciation of the elements (fractionation into associated mineralogical phases) was carried out via a conventional sequential extraction protocol and the complexing abilities of humic substances in the organic matter were investigated by selective extraction methods in combination with size segregation. For evaluation purposes soil samples spiked with catalytic converter material were analyzed, showing a much lower fraction of Ce, La and Zr mobilized in comparison to the road dust samples. It was found that the elements were effectively bound to humic substances in road dust with a preference for complexation with low molecular weight compounds (<1600 Da).

  4. Effect of oxygen pressure on phase composition and magnetic structure of FeCoZr-Pb(ZrTi)O3 nanocomposites

    NASA Astrophysics Data System (ADS)

    Kasiuk, J. V.; Fedotova, J. A.; Marszalek, M.; Karczmarska, A.; Mitura-Nowak, M.; Kalinin, Yu. E.; Sitnikov, A. V.

    2012-01-01

    The elemental and phase compositions and the magnetic state of metal particles in FeCoZr-Pb(ZrTi)O3 granular nanocomposites (GNCs) synthesized by ion-beam sputtering of composite targets in oxygen-containing media at different oxygen partial pressures have been studied. The phase transformations in GNCs have been monitored by the Raman and Mössbauer spectroscopy techniques. Correlation between the oxygen pressure during GNC synthesis and the valence state of iron ions in metal granules has been established. It has been confirmed that (i) the degree of metal oxidation increases with increasing oxygen pressure and (ii) the degree of crystallinity of oxides increases as a result of annealing. It has been established that the percolation threshold in GNCs can also be varied by changing the oxygen pressure during GNC synthesis.

  5. Structure of zirconium-93 and zirconium-91 as shown by the reactions Zr-92(d,p)Zr-93 and Zr-92(d,t)Zr-91

    NASA Technical Reports Server (NTRS)

    Baron, N.; Leonard, R. F.; Stewart, W. M.; Fink, C. L.; Christensen, P. R.; Nickles, J.; Thorsteinsen, T. F.

    1972-01-01

    Deuterons of 13-MeV incident energy were scattered from Zr-92(d,p)Zr-93. The Zr-92(d,p)Zr-93 data analysis resulted in the location of 47 levels up to an excitation energy of 4.84 MeV, and the spins of 43 of these levels were identified. Essentially all the strength of the 2d5/2, 3s1/2, 2d3/2, and 1g7/2 shells was observed; and the excitation energy of their centroids was computed to be 0.00, 1.21, 2.23, and 2.37 MeV, respectively. Also, 43 percent of the 1h11/2 strength, 21 percent of the 2f7/2 strength, and 3 percent of the 3p3/2 strength were observed. In addition, the Zr-92(d,t)Zr-91 data analysis resulted in the location of 26 levels up to an excitation energy of 4.01 MeV, and the spins of 21 of these levels were identified. Most of the expected strength of the 2d5/2 and 1g9/2 shells was obtained, and the excitation energy of their centroids was computed to be 0.31 and 3.19 MeV, respectively. In addition, six l=1 states are populated belonging to either the 2p1/2 or 2p3/2 shells.

  6. Injectabilite des coulis de ciment dans des milieux fissures

    NASA Astrophysics Data System (ADS)

    Mnif, Thameur

    Le travail presente ici est un bilan du travaux de recherche effectues sur l'injectabilite des coulis de ciment dans lu milieux fissures. Un certain nombre de coulis a base de ciment Portland et microfin ont ete selectionnes afin de caracteriser leur capacite a penetrer des milieux fissures. Une partie des essais a ete menee en laboratoire. L'etude rheologique des differents melanges a permis de tester l'influence de l'ajout de superplastifiant et/ou de fumee de silice sur la distribution granulometrique des coulis et par consequent sur leur capacite a injecter des colonnes de sable simulant un milieu fissure donne. La classe granulometrique d'un coulis, sa stabilite et sa fluidite sont apparus comme les trois facteurs principaux pour la reussite d'une injection. Un facteur de finesse a ete defini au cours de cette etude: base sur la classe granulometrique du ciment et sa stabilite, il peut entrer dans la formulation theorique du debit d'injection avant application sur chantier. La deuxieme et derniere partie de l'etude presente les resultats de deux projets de recherche sur l'injection realises sur chantier. L'injection de dalles de beton fissurees a permis le suivi de l'evolution des pressions avec la distance au point d'injection. L'injection de murs de maconnerie a caractere historique a montre l'importance de la definition de criteres de performance des coulis a utiliser pour traiter un milieu donne et pour un objectif donne. Plusieurs melanges peuvent ainsi etre predefinis et mis a disposition sur le chantier. La complementarite des ciments traditionnels et des ciments microfins devient alors un atout important. Le choix d'utilisation de ces melanges est fonction du terrain rencontre. En conclusion, cette recherche etablit une methodologie pour la selection des coulis a base de ciment et des pressions d'injection en fonction de l'ouverture des fissures ou joints de construction.

  7. Solid-state coexistence of {Zr12} and {Zr6} zirconium oxocarboxylate clusters

    SciTech Connect

    Malaestean, Iurie L.; Alici, Meliha Kutluca; Besson, Claire; Ellern, Arkady; Kogerler, Paul

    2013-10-30

    Ligand metathesis, Co(II) coordination, and partial condensation reactions of an archetypal {Zr6} zirconium oxocarboxylate cluster result in the first example of the coexistence of the distinct zirconium oxide frameworks {Zr6O8} and {Zr12O22}. Even minor modifications to the reaction conditions push this apparent equilibrium towards the {Zr6O8}-based product.

  8. Effects of chemical composition on the shock response of Zr-based metallic glasses

    NASA Astrophysics Data System (ADS)

    Escobedo, J. P.; Chapman, D. J.; Laws, K. J.; Brown, A. D.; Wang, F.; Eakins, D.; Hazell, P. J.; Ferry, M.

    2017-01-01

    The effect chemical composition on the shock response of two bulk metallic glass (BMG) alloys with slightly different elemental compositions (Zr55Cu10Ni5Al30 and Zr46Cu38Ag8Al8) has been investigated. Plate-impact experiments were conducted at a peak compressive stress of ˜10GPa, above the expected elastic limit of these alloys (˜7GPa). Velocity interferometry was used to measure the particle (up) and free surface velocity (FSV) histories. These measurements allowed calculation of the Hugoniot elastic limits and onset stresses of fracture (i.e. spall strength) for each alloy. The soft recovered specimens were characterized by means of optical and electron microscopy. It was found that the Zr55Cu10Ni5Al30 exhibited a higher HEL and spall strength and a smooth fracture surface morphology consisting of dimple-like features. Conversely, the lower spall strength of the Zr46Cu38Ag8Al38 alloy seems to correlate with rougher fracture surface that shows cup-cone features associated with a predominantly brittle dynamic fracture.

  9. Zirconium hydrides and Fe redistribution in Zr-2.5%Nb alloy under ion irradiation

    NASA Astrophysics Data System (ADS)

    Idrees, Y.; Yao, Z.; Cui, J.; Shek, G. K.; Daymond, M. R.

    2016-11-01

    Zr-2.5%Nb alloy is used to fabricate the pressure tubes of the CANDU reactor. The pressure tube is the primary pressure boundary for coolant in the CANDU design and is susceptible to delayed hydride cracking, reduction in fracture toughness upon hydride precipitation and potentially hydride blister formation. The morphology and nature of hydrides in Zr-2.5%Nb with 100 wppm hydrogen has been investigated using transmission electron microscopy. The effect of hydrides on heavy ion irradiation induced decomposition of the β phase has been reported. STEM-EDX mapping was employed to investigate the distribution of alloying elements. The results show that hydrides are present in the form of stacks of different sizes, with length scales from nano- to micro-meters. Heavy ion irradiation experiments at 250 °C on as-received and hydrided Zr-2.5%Nb alloy, show interesting effects of hydrogen on the irradiation induced redistribution of Fe. It was found that Fe is widely redistributed from the β phase into the α phase in the as-received material, however, the loss of Fe from the β phase and subsequent precipitation is retarded in the hydrided material. This preliminary work will further the current understanding of microstructural evolution of Zr based alloys in the presence of hydrogen.

  10. Trace element characteristics of graywackes and tectonic setting discrimination of sedimentary basins

    NASA Astrophysics Data System (ADS)

    Bhatia, Mukul R.; Crook, Keith A. W.

    1986-02-01

    The graywackes of Paleozoic turbidite sequences of eastern Australia show a large variation in their trace element characteristics, which reflect distinct provenance types and tectonic settings for various suites. The tectonic settings recognised are oceanic island arc, continental island arc, active continental margin, and passive margins. Immobile trace elements, e.g. La, Ce, Nd, Th, Zr, Nb, Y, Sc and Co are very useful in tectonic setting discrimination. In general, there is a systematic increase in light rare earth elements (La, Ce, Nd), Th, Nb and the Ba/Sr, Rb/Sr, La/Y and Ni/Co ratios and a decrease in V, Sc and the Ba/Rb, K/Th and K/U ratios in graywackes from oceanic island arc to continental island arc to active continental margin to passive margin settings. On the basis of graywacke geochemistry, the optimum discrimination of the tectonic settings of sedimentary basins is achieved by La-Th, La-Th-Sc, Ti/Zr-La/Sc, La/Y-Sc/Cr, Th-Sc-Zr/10 and Th-Co-Zr/10 plots. The analysed oceanic island arc graywackes are characterised by extremely low abundances of La, Th, U, Zr, Nb; low Th/U and high La/Sc, La/Th, Ti/Zr, Zr/Th ratios. The studied graywackes of the continental island arc type setting are characterised by increased abundances of La, Th, U, Zr and Nb, and can be identified by the La-Th-Sc and La/Sc versus Ti/Zr plots. Active continental margin and passive margin graywackes are discriminated by the Th-Sc-Zr/10 and Th-Co-Zr/10 plots and associated parameters (e.g. Th/Zr, Th/Sc). The most important characteristic of the analysed passive margin type graywackes is the increased abundance of Zr, high Zr/Th and lower Ba, Rb, Sr and Ti/Zr ratio compared to the active continental margin graywackes.

  11. Phase stability and elastic modulus of Ti alloys containing Nb, Zr, and/or Sn from first-principles calculations

    SciTech Connect

    Hu Qingmiao; Li Shujun; Hao Yulin; Yang Rui; Johansson, Boerje; Vitos, Levente

    2008-09-22

    The alloying effects of Nb, Zr, and/or Sn on the phase stability and elastic properties of Ti are investigated by using a first-principles method. Our calculation results indicate that a carefully designed Ti-Nb-Zr-Sn system can be a good candidate for low modulus biomedical materials. We find that the well-known correlation between the e/a ratio and both elastic and phase stabilities for Ti alloyed with transition metal elements breaks down for the Ti-Sn alloy.

  12. Initial stages of Zr-Fe-Si alloy formation on Zr(0001) surface

    NASA Astrophysics Data System (ADS)

    Horáková, Kateřina; Cichoň, Stanislav; Lančok, Ján; Sajdl, Petr; Cháb, Vladimír

    2017-03-01

    We studied initial stages of Fe and Si atoms interaction with the Zr(0001) surface. Fe and Si were deposited in-situ on the clean Zr surface up to coverage of one monolayer. Chemical state of Zr as a function of annealing temperature and the surface composition was investigated. Characteristic (1×1) LEED (Low Energy Electron Diffraction) pattern of the clean Zr surface becomes significantly modified when Fe and Si are deposited and annealed at 400 °C. The arrangement of new spots of the pattern corresponds to the (2√3×2√3)R30° structure, stable up to annealing at 750 °C. Changes in the electronic structure were identified from the images of equi-energy cuts of the k-space covering the entire Brillouin zone. The results imply that hydrogen, typically present in the clean surface, was eliminated either by annealing or upon the deposition of Fe and Si.

  13. Fractionation of Zr and Hf in surface processes

    SciTech Connect

    Chyi, L.L.; Garg, A.N.

    1985-01-01

    Zircons from a pegmatite near Tuxedo, North Carolina were crushed and treated with different reagents under different conditions. The treated and untreated samples were determined for Zr and Hf with radiochemical neutron activation analysis. Zircons treated with 50% sulfuric acid were having lowered Zr content and Zr/Hf ratio. The conclusions are that a portion of Zr and Hf in zircons is sensitive to leaching, and Zr appears to be selectively leached over Hf. The conclusions of this work support the observations of small dissolutions of Zr in both acidic podzolic soils and in alkaline laterites, of lower Zr content in soils on glacial drift, and of lower Zr/Hf ratios in loess deposits from various parts of the world. The fractionation of Zr and Hf in surface processes appears to be due to selective leaching. Weakening of Zr-O over Hf-O bonds in zircon by fission projectiles is postulated to be the viable process. The observed fractionation from leaching experiments suggest that areas receiving leachates such as swamps, lakes, and oceans should have high to very high Zr/Hf ratios preserved in rocks. High ratios are found in the Springfield (No. 9) Coal, the Green River Shale, and various limestones. High ratio is also found in orchard leaves, which grow by absorbing leachate from soil.

  14. Preparation and characterization of free-standing Zr, PI and Zr/PI filter

    NASA Astrophysics Data System (ADS)

    Wu, Heyun; Wu, Yonggang; Lv, Gang; Wang, Zhenhua; Ling, Leijie; Xia, Zihuan; Chen, Naibo

    2010-10-01

    A thin PI film equal to or less than 200nm was fabricated on a Zr film to improve the mechanical characteristics of the latter. The PI film was prepared by two-step process. Througth fully reaction between Pyromellitic Dianhydride (PMDA) and Oxydianiline (ODA) in Dimethylacetamide (DMAC), polyamic acid (PAA) was produced. After the deposition of Zr film on floating glass using direct-current magnetron sputtering, PAA was prepared on the Zr film through dip-coating and then thermally imidized to form the PI film. The transmission spectrum obtained by using synchrotron radiation fits with calculation result fairly well. Although the combination of the PI film with Zr film results in the decline of the transmission, the mechanical strength of the composite film is improved, and the transmittances of the Zr(300nm)/PI(200nm) and Zr(400nm)/PI(200nm) films reach 14.9% and 7.5% respectively at 13.9 nm, still satisfying the actual requirement.

  15. Preparation and characterization of free-standing Zr, PI and Zr/PI filter

    NASA Astrophysics Data System (ADS)

    Wu, Heyun; Wu, Yonggang; Lv, Gang; Wang, Zhenhua; Ling, Leijie; Xia, Zihuan; Chen, Naibo

    2011-02-01

    A thin PI film equal to or less than 200nm was fabricated on a Zr film to improve the mechanical characteristics of the latter. The PI film was prepared by two-step process. Througth fully reaction between Pyromellitic Dianhydride (PMDA) and Oxydianiline (ODA) in Dimethylacetamide (DMAC), polyamic acid (PAA) was produced. After the deposition of Zr film on floating glass using direct-current magnetron sputtering, PAA was prepared on the Zr film through dip-coating and then thermally imidized to form the PI film. The transmission spectrum obtained by using synchrotron radiation fits with calculation result fairly well. Although the combination of the PI film with Zr film results in the decline of the transmission, the mechanical strength of the composite film is improved, and the transmittances of the Zr(300nm)/PI(200nm) and Zr(400nm)/PI(200nm) films reach 14.9% and 7.5% respectively at 13.9 nm, still satisfying the actual requirement.

  16. Valence electron energy-loss spectroscopy study of ZrSiO₄ and ZrO₂.

    PubMed

    Jiang, Nan; Spence, John C H

    2013-11-01

    ZrSiO4 (zircon) and m-ZrO2 (zirconia) are fundamental and industrially important materials. This work reports the detailed valence electron energy-loss spectroscopy (VEELS) studies of these compounds. The dielectric response functions, as well as single-electron interband transition spectra, are derived from VEELS data for both ZrSiO4 and m-ZrO2, in the range 5-50 eV using the Kramers-Kronig analysis method. Our interpretation of the interband transitions is given with the aid of ab initio calculations of density of states. The bandgap energies for both materials are also measured using VEELS. The surface and bulk plasmons are identified: the surface plasmon peaks locate at around 12 eV, and two bulk plasmon peaks are ∼15-16 eV and ∼25-27 eV, respectively. Although similarities in the VEELS exist between ZrSiO4 and m-ZrO2, two major differences are also noticed and explained in terms of composition and structure differences.

  17. Valence electronenergy-lossspectroscopystudyofZrSiO4 and ZrO2

    SciTech Connect

    Spence, John; Jiang, Nan

    2013-07-01

    ZrSiO4 (zircon) and m-ZrO2 (zirconia) are fundamental and industrially important materials.This work reports the detailed valence electron energy-loss spectroscopy (VEELS) studies of these compounds. The dielectric response functions, as well as single-electron interband transition spectra,are derived from VEELS data for both ZrSiO4 and m-ZrO2, in the rang e5–50 eV using the Kramers–Kronig analysis method. Our interpretation of the interband transitions is given with the aid of ab initio calculations of density of states. The bandgap energies for both materials are also measured using VEELS.The surface and bulk plasmons are identified: the surface plasmon peaks locate at around 12 eV,and two bulk plasmon peaks are ~15–16 eV and ~25–27 eV,respectively.Although similarities in the VEELS exist between ZrSiO4 and m-ZrO2, two majo rdifferences are als onoticed and explained in terms of composition and structure differences.

  18. The preparation of Zr-deuteride and phase stability studies of the Zr-D system

    NASA Astrophysics Data System (ADS)

    Maimaitiyili, T.; Steuwer, A.; Bjerkén, C.; Blomqvist, J.; Hoelzel, M.; Ion, J. C.; Zanellato, O.

    2017-03-01

    Deuteride phases in the zirconium-deuterium system in the temperature range 25-286 °C have been studied in-situ by high resolution neutron diffraction. The study primarily focused on observations of δ→γ transformation at 180 °C, and the peritectoid reaction α + δ ↔ γ at 255 °C in commercial grade Zr powder that was deuterated to a deuterium/Zr ratio of one to one. A detailed description of the zirconium deuteride preparation route by high temperature gas loading is also described. The lattice parameters of α-Zr, δ-ZrDx and ε-ZrDx were determined by whole pattern crystal structure analysis, using Rietveld and Pawley refinements, and are in good agreement with values reported in the literature. The controversial γ-hydride phase was observed both in-situ and ex-situ in deuterated Zr powder after a heat treatment at 286 °C and slow cooling.

  19. Industrial scale HP-HT synthesis of hard and wear resistant c-Zr3N4

    NASA Astrophysics Data System (ADS)

    Dzivenko, Dmytro; Riedel, Ralf; Taniguchi, Takashi; Chauveau, Thierry; Zerr, Andreas

    2013-06-01

    We present a large scale high-pressure high-temperature (HP-HT) synthesis of hard and wear resistant cubic zirconium nitride having Th3P4-type structure,c-Zr3N4. This material, also available as well-adhesive coatings with exceptional wear resistance, represents a compound competitive to diamond and c-BN with respect to machining of low-carbon steels and other ferrous alloys. We obtained c-Zr3N4 powder at pressures as low as 6.5 GPa and temperatures of 1400-1600 °C from nanocrystalline Zr3N4+x precursor using a belt-type apparatus - a static HP-HT device widely employed for the commercial production of diamond and c-BN. The HP products are characterized in details by means of powder X-ray diffraction, Raman spectroscopy, scanning electron microscopy and combustion elemental analysis. In addition to major polycrystalline c-Zr3N4, we unveil the formation of a quaternary compound c-(Zr1-xTax)3 (N1-yOy)4 which indicates the possibility of doping of c-Zr3N4, thus introducing it for practical application as a multifunctional material. Moreover, we consider ways of cementing the c-Zr3N4 powders (similar to cemented tungsten carbides) which would allow economic fabrication of large bodies based on this compound. Supported by the DFG (Bonn, Germany) within SPP 1236 and by the IFR ``Paris Nord Plaine de France''.

  20. Mechanochemical synthesis of magnetically hard anisotropic RFe10Si2 powders with R representing combinations of Sm, Ce and Zr

    NASA Astrophysics Data System (ADS)

    Gabay, A. M.; Hadjipanayis, G. C.

    2017-01-01

    Alloy synthesis consisting of mechanical activation followed by annealing was explored as a method of manufacturing medium-grade permanent magnet materials with a reduced content of the critical rare earth elements. Four RxFe10Si2 alloys with R=Sm, Sm0.7Zr0.3, Sm0.3Ce0.3Zr0.4 and Ce0.6Zr0.4 (nominal compositions) were prepared from mixtures of Sm2O3, CeO2, ZrO2, Fe2O3 and Si powders in the presence of a reducing agent Ca and a CaO dispersant. The collected alloy particles typically consisted of few joined submicron crystals. For R=Sm, X-ray diffraction analysis reveals a significant amount of the unwanted Th2Zn17-type compound forming alongside the desired ThMn12-type 1:12 compound. A more pure 1:12 phase could be obtained for R=Ce0.6Zr0.4, but it exhibited a room-temperature coercivity of less than 1 kOe. The most pure 1:12 phase and the highest values of the coercivity (10.8 kOe) and calculated maximum energy product (13.8 MGOe) were obtained for R=Sm0.7Zr0.3 processed at 1150 °C. The calculated maximum energy products of the Sm0.3Ce0.3Zr0.4Fe10Si2 particles, with half of their rare earths constituents represented by the relatively abundant Ce, was 10.1 MGOe.

  1. Microstructure, Surface Characterization, and Electrochemical Behavior of New Ti-Zr-Ta-Ag Alloy in Simulated Human Electrolyte

    NASA Astrophysics Data System (ADS)

    Vasilescu, Cora; Drob, Silviu Iulian; Osiceanu, Petre; Moreno, Jose Maria Calderon; Prodana, Mariana; Ionita, Daniela; Demetrescu, Ioana; Marcu, Maria; Popovici, Ion Alexandru; Vasilescu, Ecaterina

    2017-01-01

    A new Ti-20Zr-5Ta-2Ag alloy was elaborated and characterized regarding its microstructure, its native passive film composition and thickness, its surface wettability, its electrochemical behavior in Ringer solution of different pH values, and its ion release. The new alloy has a bi-phase, α + β, acicular, homogeneous microstructure (scanning electron microscopy (SEM)). Its native passive film (12-nm thicknesses) consists of the protective TiO2, ZrO2, and Ta2O5 oxides, Ti and Ta suboxides, and metallic Ag (X-ray photoelectron spectroscopy (XPS) data). The alloy possesses high hydrophilic properties. The main electrochemical parameters of the new alloy are superior to those of Ti as a result of the beneficial influence of Zr, Ta, and Ag alloying elements, which reinforce its native passive film. Electrochemical impedance spectroscopy (EIS) spectra in Ringer solutions for the new alloy displayed better values of impedances and phase angles, proving a more insulate passive film than that on the Ti surface. The main corrosion parameters for the new Ti-20Zr-5Ta-2Ag alloy are more favorable by about 25 to 38 times than those of Ti, confirming extremely resistant passive film. The new Ti-20Zr-5Ta-2Ag alloy releases into Ringer solution low quantities of Ti4+, Zr4+ metallic ions (inductively coupled plasma-mass spectroscopy (ICP-MS)). The Ag+ ions are released in low quantity, conferring to this alloy's low antibacterial activity. All experimental results show that the new Ti-20Zr-5Ta-2Ag alloy fulfills the requirements for biocompatibility, corrosion resistance, and antibacterial protection.

  2. The origin of low water vapor transmission rates through Al2O3/ZrO2 nanolaminate gas-diffusion barriers grown by atomic layer deposition

    NASA Astrophysics Data System (ADS)

    Meyer, J.; Schmidt, H.; Kowalsky, W.; Riedl, T.; Kahn, A.

    2010-06-01

    This paper reports on thin film gas-diffusion barriers consisting of Al2O3/ZrO2 nanolaminates (NL) grown by low-temperature (80 °C) atomic layer deposition. We show that reliable barriers with water vapor transmission rates of 3.2×10-4 g/(m2 day), measured at 80 °C and 80% relative humidity, can be realized with very thin layers down to 40 nm. We determine that ZrO2 acts as anticorrosion element in our NL. Furthermore, we demonstrate by x-ray photoemission spectroscopy that an aluminate phase is formed at the interfaces between Al2O3 and ZrO2 sublayers, which additionally improves the gas-diffusion barrier due to a densification of the layer system. These Al2O3/ZrO2 NLs prepared at low temperatures hold considerable promises for application in organic electronics and beyond.

  3. Novel regenerable sorbent based on Zr-Mn binary metal oxides for flue gas mercury retention and recovery.

    PubMed

    Xie, Jiangkun; Qu, Zan; Yan, Naiqiang; Yang, Shijian; Chen, Wanmiao; Hu, Lingang; Huang, Wenjun; Liu, Ping

    2013-10-15

    To capture and recover mercury from coal-fired flue gas, a series of novel regenerable sorbents based on Zr-Mn binary metal oxides were prepared and employed at a relatively low temperature. PXRD, TEM, TPR, XPS, and N2-adsorption methods were employed to characterize the sorbents. The Hg(0) adsorption performance of the sorbents was tested, and the effects of the main operation parameters and the gas components on the adsorption were investigated. Zr significantly improved the sorbent's mercury capacity, which was nearly 5mg/g for Zr0.5Mn0.5Oy. Furthermore, the spent sorbent could be regenerated by heating to 350°C, and the highly concentrated elemental mercury released could be facilely recycled. Therefore, a much greener process for mercury capture and recovery could be anticipated based on this regenerable sorbent.

  4. Study of nanostructured (Ti-Zr-Nb)N coatings’ physical- mechanical properties obtained by vacuum arc evaporation

    NASA Astrophysics Data System (ADS)

    Plotnikov, S. V.; Pogrebnjak, A. D.; Yerokhina, L. N.; Yeskermessov, D. K.; erdybaeva, N. K. Y.

    2016-02-01

    The coatings were formed by vacuum arc deposition. Unit cast target (cathodes) was used on the basis of 30 atm. % Ti, 35 at. % Zr and 35 atm. % Nb as the vaporized materials. Molecular nitrogen was used as the working gas. The thickness of the coatings in the experiments was 4.0 microns. The surface morphology fractograph fracture, track friction were investigated in a scanning electron microscope JSM-6390 LV. The use of multicoatings based on carbides is very promising to ensure the high performance properties of the complex, nitrides and silicides of transition metals. Findings - nanostructured coating of (Ti-Zr-Nb) N was obtained by vacuum arc evaporation cathode-cast in a nitrogen gas reaction medium. Multicomponent films have a pronounced columnar structure. Elemental composition was obtained by the vacuum arc deposition of coatings (Ti-Zr-Nb) N, depending on the physical parameters of the deposition process, in particular the pressure of the reaction gas nitrogen.

  5. Modifying the TiAlZr biomaterial surface with coating, for a better anticorrosive and antibacterial performance

    NASA Astrophysics Data System (ADS)

    Ionita, Daniela; Grecu, Mihaela; Ungureanu, Camelia; Demetrescu, Ioana

    2011-08-01

    The paper investigates the increase of anticorrosive and antimicrobial properties of a composite elaborated by coating TiAlZr with Ag nanoparticles. Silver nanoparticles (AgNPs) were synthesized by reducing silver salts using NaBH 4, and were characterized using dynamic light scattering instrument to determine the size distribution. The morphological and elemental analysis of Ag nanoparticles on the TiAlZr surface were performed with scanning electron microscopy (SEM) and energy disperse spectroscopy (EDS). Antibacterial activity was evaluated on the basis of the inhibition of the growth of Escherichia coli bacteria, and of the electrochemical parameters from dynamic polarization tests performed in Ringers bioliquid. An empirical model of antibacterial effect of silver nanoparticles at biointerface in the presence of TiAlZr implant was discussed.

  6. Grundlagen des Tissue Engineering

    NASA Astrophysics Data System (ADS)

    Mayer, Jörg; Blum, Janaki; Wintermantel, Erich

    Die Organtransplantation stellt eine verbreitete Therapie dar, um bei krankheitsoder unfallbedingter Schädigung eines Organs die Gesamtheit seiner Funktionen wieder herzustellen, indem es durch ein Spenderorgan ersetzt wird. Organtransplantationen werden für die Leber, die Niere, die Lunge, das Herz oder bei schweren grossflächigen Verbrennungen der Haut vorgenommen. Der grosse apparative, personelle und logistische Aufwand und die Risiken der Transplantationschirurgie (Abstossungsreaktionen) sowie die mangelnde Verfügbarkeit von immunologisch kompatiblen Spenderorganen führen jedoch dazu, dass der Bedarf an Organtransplantaten nur zu einem sehr geringen Teil gedeckt werden kann. Sind Spenderorgane nicht verfügbar, können in einzelnen Fällen lebenswichtige Teilfunktionen, wie beispielsweise die Filtrationsfunktion der Niere durch die Blutreinigung mittels Dialyse ersetzt oder, bei mangelnder Funktion der Bauchspeicheldrüse (Diabetes), durch die Verabreichung von Insulin ein normaler Zustand des Gesamtorganismus auch über Jahre hinweg erhalten werden. Bei der notwendigen lebenslangen Anwendung apparativer oder medikamentöser Therapie können für den Patienten jedoch häufig schwerwiegende, möglicherweise lebensverkürzende Nebenwirkungen entstehen. Daher werden in der Forschung Alternativen gesucht, um die Funktionen des ausgefallenen Organs durch die Implantation von Zellen oder in vitro gezüchteten Geweben möglichst umfassend wieder herzustellen. Dies erfordert biologisch aktive Implantate, welche die für den Stoffwechsel des Organs wichtigen Zellen enthalten und einen organtypischen Stoffwechsel entfalten.

  7. Photocatalytic degradation of gaseous toluene with multiphase Ti(x)Zr(1-x)O2 synthesized via co-precipitation route.

    PubMed

    Liu, Baojun; Li, Xinyong; Zhao, Qidong; Ke, Jun; Liu, Jie; Liu, Shaomin; Tadé, Moses

    2015-01-15

    In the present work, the multiphase Ti(x)Zr(1-x)O2 particles containing cubic-phase ZrO2 were fabricated via co-precipitation route. The mole ratios of Ti and Zr elements were controlled by three levels: Ti/Zr=7/3 (maximum), Ti/Zr=5/5 (medium), and Ti/Zr=3/7 (minimum). The materials prepared were characterized by using X-ray diffraction (XRD), field emission scanning electron microscope (FE-SEM), energy-dispersive X-ray (EDX), X-ray photoelectron spectroscopy (XPS), UV-vis diffuse reflectance spectra (DRS) and photoluminescence (PL) spectra. For the maximum usage of solar power with fabricated catalysts, elimination of gaseous toluene was chosen as a model to evaluate the performances under visible light. The results indicated that the degradation efficiency of toluene was about 80% after 6 h reaction using Ti(0.3)Zr(0.7)O2 as the photocatalyst. On the other hand, the multiphase Ti(x)Zr(1-x)O2 (x=0.7 or 0.5) photocatalysts showed significant enhancement in the activity, compared with the commercial TiO2 (Degussa P25). The enhanced performances of Ti(x)Zr(1-x)O2 might be attributed to the lower charge recombination rate of photoinduced electron-hole pairs. In addition, some intermediates (the benzaldehyde and benzoic acid) and final product (CO2) adsorbed on the surface of the particles were also detected by using in situ Fourier transform infrared (FTIR) spectroscopy.

  8. Evidence of Topological Nodal-Line Fermions in ZrSiSe and ZrSiTe

    NASA Astrophysics Data System (ADS)

    Hu, Jin; Tang, Zhijie; Liu, Jinyu; Liu, Xue; Zhu, Yanglin; Graf, David; Myhro, Kevin; Tran, Son; Lau, Chun Ning; Wei, Jiang; Mao, Zhiqiang

    2016-07-01

    A Dirac nodal-line semimetal phase, which represents a new quantum state of topological materials, has been experimentally realized only in a few systems, including PbTaSe2 , PtSn4 , and ZrSiS. In this Letter, we report evidence of nodal-line fermions in ZrSiSe and ZrSiTe probed in de Haas-van Alphen quantum oscillations. Although ZrSiSe and ZrSiTe share a similar layered structure with ZrSiS, our studies show the Fermi surface (FS) enclosing a Dirac nodal line has a 2D character in ZrSiTe, in contrast with 3D-like FS in ZrSiSe and ZrSiS. Another important property revealed in our experiment is that the nodal-line fermion density in this family of materials (˜1020 cm-3 ) is much higher than the Dirac fermion density of other topological materials with discrete nodes. In addition, we have demonstrated ZrSiSe and ZrSiTe single crystals can be thinned down to 2D atomic thin layers through microexfoliation, which offers the first platform to explore exotic properties of topological nodal-line fermions in low dimensions.

  9. Evidence of Topological Nodal-Line Fermions in ZrSiSe and ZrSiTe.

    PubMed

    Hu, Jin; Tang, Zhijie; Liu, Jinyu; Liu, Xue; Zhu, Yanglin; Graf, David; Myhro, Kevin; Tran, Son; Lau, Chun Ning; Wei, Jiang; Mao, Zhiqiang

    2016-07-01

    A Dirac nodal-line semimetal phase, which represents a new quantum state of topological materials, has been experimentally realized only in a few systems, including PbTaSe_{2}, PtSn_{4}, and ZrSiS. In this Letter, we report evidence of nodal-line fermions in ZrSiSe and ZrSiTe probed in de Haas-van Alphen quantum oscillations. Although ZrSiSe and ZrSiTe share a similar layered structure with ZrSiS, our studies show the Fermi surface (FS) enclosing a Dirac nodal line has a 2D character in ZrSiTe, in contrast with 3D-like FS in ZrSiSe and ZrSiS. Another important property revealed in our experiment is that the nodal-line fermion density in this family of materials (∼10^{20}  cm^{-3}) is much higher than the Dirac fermion density of other topological materials with discrete nodes. In addition, we have demonstrated ZrSiSe and ZrSiTe single crystals can be thinned down to 2D atomic thin layers through microexfoliation, which offers the first platform to explore exotic properties of topological nodal-line fermions in low dimensions.

  10. Silver activation on thin films of Ag-ZrCN coatings for antimicrobial activity.

    PubMed

    Ferreri, I; Calderon V, S; Escobar Galindo, R; Palacio, C; Henriques, M; Piedade, A P; Carvalho, S

    2015-10-01

    Nowadays, with the increase of elderly population and related health problems, knee and hip joint prosthesis are being widely used worldwide. However, failure of these invasive devices occurs in a high percentage thus demanding the revision of the chirurgical procedure. Within the reasons of failure, microbial infections, either hospital or subsequently-acquired, contribute in high number to the statistics. Staphylococcus epidermidis (S. epidermidis) has emerged as one of the major nosocomial pathogens associated with these infections. Silver has a historic performance in medicine due to its potent antimicrobial activity, with a broad-spectrum on the activity of different types of microorganisms. Consequently, the main goal of this work was to produce Ag-ZrCN coatings with antimicrobial activity, for the surface modification of hip prostheses. Thin films of ZrCN with several silver concentrations were deposited onto stainless steel 316 L, by DC reactive magnetron sputtering, using two targets, Zr and Zr with silver pellets (Zr+Ag target), in an atmosphere containing Ar, C2H2 and N2. The antimicrobial activity of the modified surfaces was tested against S. epidermidis and the influence of an activation step of silver was assessed by testing samples after immersion in a 5% (w/v) NaClO solution for 5 min. The activation procedure revealed to be essential for the antimicrobial activity, as observed by the presence of an inhibition halo on the surface with 11 at.% of Ag. The morphology analysis of the surface before and after the activation procedure revealed differences in silver distribution indicating segregation/diffusion of the metallic element to the film's surface. Thus, the results indicate that the silver activation step is responsible for an antimicrobial effect of the coatings, due to silver oxidation and silver ion release.

  11. Density-functional study of U-TRU-Zr and U-TRU-Mo alloys

    NASA Astrophysics Data System (ADS)

    Landa, Alexander; Soderlind, Per; Turchi, Patrice

    2013-03-01

    The U-Zr and U-Mo alloys proved to be very promising fuels for liquid metal fast breeder reactors. The optimal composition of these alloys is determined from the condition that the fuel could remain stable in the bcc phase (γ-U) in the temperature range of stability of α-U phase. In other words, both Zr and Mo play a role of `` γ-stabilizers'' helping to keep U in the metastable bcc phase upon cooling. In the present study we perform KKR-ASA-CPA and EMTO-CPA calculations of the ground state properties of γ-U-Zr and γ-U-Mo alloys and compare their heats of formation with CALPHAD assessments. Though the U-Zr and U-Mo alloys can be used as nuclear fuels, a fast rector operation on a closed fuel cycle will, due to the nuclear reactions, contain significant amount of TRU elements (Np, Pu, and Am). Above mentioned density-functional theory techniques are extended to study ground-state properties of the bcc-based X-Zr and X-Mo (X = Np, Pu, Am) solid solutions. We discuss how the heat of formation correlates with the charge transfer between the alloy components, and how magnetism influences the deviation from Vegard's law for the equilibrium atomic volume. This work was performed under the auspices of the US Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. Work at LLNL was funded by the Laboratory Directed Research and Development Program under project tracking code 12-SI-008.

  12. Bone response to a novel Ti-Ta-Nb-Zr alloy.

    PubMed

    Stenlund, Patrik; Omar, Omar; Brohede, Ulrika; Norgren, Susanne; Norlindh, Birgitta; Johansson, Anna; Lausmaa, Jukka; Thomsen, Peter; Palmquist, Anders

    2015-07-01

    Commercially pure titanium (cp-Ti) is regarded as the state-of-the-art material for bone-anchored dental devices, whereas the mechanically stronger alloy (Ti-6Al-4V), made of titanium, aluminum (Al) and vanadium (V), is regarded as the material of choice for high-load applications. There is a call for the development of new alloys, not only to eliminate the potential toxic effect of Al and V but also to meet the challenges imposed on dental and maxillofacial reconstructive devices, for example. The present work evaluates a novel, dual-stage, acid-etched, Ti-Ta-Nb-Zr alloy implant, consisting of elements that create low toxicity, with the potential to promote osseointegration in vivo. The alloy implants (denoted Ti-Ta-Nb-Zr) were evaluated after 7 days and 28 days in a rat tibia model, with reference to commercially pure titanium grade 4 (denoted Ti). Analyses were performed with respect to removal torque, histomorphometry and gene expression. The Ti-Ta-Nb-Zr showed a significant increase in implant stability over time in contrast to the Ti. Further, the histological and gene expression analyses suggested faster healing around the Ti-Ta-Nb-Zr, as judged by the enhanced remodeling, and mineralization, of the early-formed woven bone and the multiple positive correlations between genes denoting inflammation, bone formation and remodeling. Based on the present experiments, it is concluded that the Ti-Ta-Nb-Zr alloy becomes osseointegrated to at least a similar degree to that of pure titanium implants. This alloy is therefore emerging as a novel implant material for clinical evaluation.

  13. Discovery of ferromagnetism with large magnetic anisotropy in ZrMnP and HfMnP

    NASA Astrophysics Data System (ADS)

    Lamichhane, Tej N.; Taufour, Valentin; Masters, Morgan W.; Parker, David S.; Kaluarachchi, Udhara S.; Thimmaiah, Srinivasa; Bud'ko, Sergey L.; Canfield, Paul C.

    2016-08-01

    ZrMnP and HfMnP single crystals are grown by a self-flux growth technique, and structural as well as temperature dependent magnetic and transport properties are studied. Both compounds have an orthorhombic crystal structure. ZrMnP and HfMnP are ferromagnetic with Curie temperatures around 370 K and 320 K, respectively. The spontaneous magnetizations of ZrMnP and HfMnP are determined to be 1.9 μB/f.u. and 2.1 μB/f.u., respectively, at 50 K. The magnetocaloric effect of ZrMnP in terms of entropy change (ΔS) is estimated to be -6.7 kJ m-3 K-1 around 369 K. The easy axis of magnetization is [100] for both compounds, with a small anisotropy relative to the [010] axis. At 50 K, the anisotropy field along the [001] axis is ˜4.6 T for ZrMnP and ˜10 T for HfMnP. Such large magnetic anisotropy is remarkable considering the absence of rare-earth elements in these compounds. The first principle calculation correctly predicts the magnetization and hard axis orientation for both compounds, and predicts the experimental HfMnP anisotropy field within 25%. More importantly, our calculations suggest that the large magnetic anisotropy comes primarily from the Mn atoms, suggesting that similarly large anisotropies may be found in other 3d transition metal compounds.

  14. Effects of ZrO{sub 2} doping on HfO{sub 2} resistive switching memory characteristics

    SciTech Connect

    Ryu, Seung Wook; Kwac, Jungsuk; Nishi, Yoshio; Cho, Seongjae; Park, Joonsuk; Kim, Hyeong Joon

    2014-08-18

    A resistive switching (RS) random access memory device with ZrO{sub 2}-doped HfO{sub 2} exhibits better RS performance than that with pure HfO{sub 2}. In particular, I{sub res}, V{sub res}, and V{sub set} are reduced by approximately 58%, 38%, and 39%, respectively, when HfO{sub 2} is doped with ZrO{sub 2} (9 at. %). In addition, the ZrO{sub 2} doping in HfO{sub 2} makes the distribution of most parameters steeper. Transmission electron microscopy (TEM) analysis reveals that the deposited zirconium-doped hafnium oxide (HZO) (9 at. %) is polycrystalline. Elemental mapping results by scanning TEM–energy dispersive spectroscopy also prove that ZrO{sub 2} is uniformly distributed in the HZO (9 at. %) film. The possible mechanism for the improvement in the RS characteristics is also suggested on the basis of the X-ray photoelectron spectroscopy results and filamentary RS mechanism. These results suggest that the ZrO{sub 2} doping into HfO{sub 2} likely not only will reduce power consumption but also will improve cyclic endurance by controlling the nonstoichiometric phase.

  15. Reticulation des fibres lignocellulosiques

    NASA Astrophysics Data System (ADS)

    Landrevy, Christel

    Pour faire face à la crise économique la conception de papier à valeur ajoutée est développée par les industries papetières. Le but de se projet est l'amélioration des techniques actuelles de réticulation des fibres lignocellulosiques de la pâte à papier visant à produire un papier plus résistant. En effet, lors des réactions de réticulation traditionnelles, de nombreuses liaisons intra-fibres se forment ce qui affecte négativement l'amélioration anticipée des propriétés physiques du papier ou du matériau produit. Pour éviter la formation de ces liaisons intra-fibres, un greffage sur les fibres de groupements ne pouvant pas réagir entre eux est nécessaire. La réticulation des fibres par une réaction de « click chemistry » appelée cycloaddition de Huisgen entre un azide et un alcyne vrai, catalysée par du cuivre (CuAAC) a été l'une des solutions trouvée pour remédier à ce problème. De plus, une adaptation de cette réaction en milieux aqueux pourrait favoriser son utilisation en milieu industriel. L'étude que nous désirons entreprendre lors de ce projet vise à optimiser la réaction de CuAAC et les réactions intermédiaires (propargylation, tosylation et azidation) sur la pâte kraft, en milieu aqueux. Pour cela, les réactions ont été adaptées en milieu aqueux sur la cellulose microcristalline afin de vérifier sa faisabilité, puis transférée à la pâte kraft et l'influence de différents paramètres comme le temps de réaction ou la quantité de réactifs utilisée a été étudiée. Dans un second temps, une étude des différentes propriétés conférées au papier par les réactions a été réalisée à partir d'une série de tests papetiers optiques et physiques. Mots Clés Click chemistry, Huisgen, CuAAC, propargylation, tosylation, azidation, cellulose, pâte kraft, milieu aqueux, papier.

  16. Surface analysis, microstructural, mechanical and electrochemical properties of new Ti-15Ta-5Zr alloy

    NASA Astrophysics Data System (ADS)

    Vasilescu, Cora; Drob, Silviu Iulian; Osiceanu, Petre; Drob, Paula; Moreno, Jose Maria Calderon; Preda, Silviu; Ivanescu, Steliana; Vasilescu, Ecaterina

    2015-03-01

    This paper describes the synthesis of a novel Ti-15Ta-5Zr alloy with an α + ß stable, homogeneous, biphasic microstructure (by optical microscopy, X-ray diffraction and scanning electron microscopy) and the determination of its mechanical properties, hardness and a Young's modulus of 42.2 GPa. The alloy passive film composition and thickness were analyzed by X-ray photoelectron spectroscopy; a thick, compact native passive film containing the protective oxides of all constituent elements (TiO2, Ta2O5, ZrO2) was identified. The electrochemical parameters confirmed a nobler behaviour and a more capacitive, resistant passive film on the alloy surface compared to Ti and other existing implant alloys; these facts are due to the alloying elements that, by their oxides stabilize and reinforce the alloy passive film. This passive film thickened in time, which increased its protective capacity. The new alloy had no susceptibility to galvanic or local corrosion. Ti-15Ta-5Zr alloy is recommended as an advanced orthopaedic implant material.

  17. Mechanical and electrochemical characterisation of new Ti-Mo-Nb-Zr alloys for biomedical applications.

    PubMed

    Nnamchi, Paul S; Obayi, C S; Todd, Iain; Rainforth, M W

    2016-07-01

    The development and characterisation of new metallic biomaterials that contain non-toxic and non-allergic elements but possess low elastic modulus and low biodegradation rates, has become a topic of serious investigation in orthopaedic implant application. The lowering of elastic modulus and improving of corrosion resistance can be achieved by specific chemical alloying and super-elasticity effects, associated with a stress-induced phase transformation from the BCC metastable beta phase to the orthorhombic α″ martensite. Using this framework, this paper focuses on the effect of Nb and/or Zr micro-additions on the elastic modulus/yield strength balance and discusses microstructure, and the mechanical and electrochemical behaviour of four new β-Ti-8Mo-xNb-xZr (x=2-5) alloys, using tensile tests, X-ray diffraction, SEM characterisation, ultrasound technique and potentiodynamic polarisation methods. The results reveal that the alloys exhibit a pronounced microstructural sensitivity response, with alloying elements and excellent agreement between β-stability and high mechanical strength, with increasing Nb additions. Although all the alloys possess excellent corrosion resistance and low Young׳s modulus, Ti-8Mo-4Nb-2Zr alloy, which consists of β+α'' phases, exhibits a low Young modulus of 35GPa, which is lower than those of the commercial alloys already used in biomedical implantation. The significant corrosion resistance, nontoxicity and better mechanical compatibility are properties pertinent to preventing stress shielding and bone resorption in orthopaedic implant applications.

  18. La diffraction des neutrons et des rayons X pour l'étude structurale des liquides et des verres

    NASA Astrophysics Data System (ADS)

    Fischer, H. E.; Salmon, P. S.; Barnes, A. C.

    2003-02-01

    La compréhension de mainte propriété physique d'un verre ou d'un liquide nécessite la connaissance des facteurs de structure partiels (PSFs) qui décrivent chacun la distribution d'une espèce atomique autour d'une autre. La technique de diffraction des neutrons avec substitution isotopique (NDIS) [1,2,3], ayant bien réussi a déterminer les PSFs de certains composés [4,5], est pourtant restreinte aux isotopes présentant un contraste suffisant en longueur de diffusion. D'un autre cote, la technique de diffusion anomale des rayons X (AXS ou AXD) [6] permet de faire varier la longueur de diffusion d'une espèce atomique pourvu que son énergie d'absorption soit à la fois accessible et suffisamment élevée pour donner un assez grand transfert du moment. La combinaison des techniques de diffraction des neutrons (avec ou sans substitution isotopique) et de diffraction des rayons X (avec ou sans diffusion anomale) peut donc permettre d'obtenir un meilleur contraste en longueurs de diffusion pour un système donné, mais exige une analyse de données plus soignée pour pouvoir bien tenir compte des erreurs systématiques qui sont différentes pour les 2 techniques [7]. Pour les atomes ayant des distributions électroniques quasi-sphériques, e.g. dans le cas d'un alliage liquide, la combinaison des techniques de NDIS et de diffraction des rayons X s'est déjà montrée très avantageuse pour la détermination des PSFs [8,9]. Dans le cas des verres ayant d'importantes liaisons covalentes, l'effective combinaison des 2 techniques peut être moins directe mais facilitée lorsqu'il s'agit des atomes de grand Z [10,11]. Nous présentons ici un sommaire du méthode et quelques exemples des résultats.

  19. Observations of a Cast Cu-Cr-Zr Alloy

    NASA Technical Reports Server (NTRS)

    Ellis, David L.

    2006-01-01

    Prior work has demonstrated that Cu-Cr-Nb alloys have considerable advantages over the copper alloys currently used in regeneratively cooled rocket engine liners. Observations indicated that Zr and Nb have similar chemical properties and form very similar compounds. Glazov and Zakharov et al. reported the presence of Cr2Zr in Cu-Cr-Zr alloys with up to 3.5 wt% Cr and Zr though Zeng et al. calculated that Cr2Zr could not exist in a ternary Cu-Cr-Zr alloy. A cast Cu-6.15 wt% Cr-5.25 wt% Zr alloy was examined to determine if the microstructure developed would be similar to GRCop-84 (Cu-6.65 wt% Cr-5.85 wt% Nb). It was observed that the Cu-Cr-Zr system did not form any Cr2Zr even after a thermal exposure at 875 C for 176.5 h. Instead the alloy consisted of three phases: Cu, Cu5Zr, and Cr.

  20. Deformed Structures and Shape Coexistence in Zr-98

    NASA Astrophysics Data System (ADS)

    Olaizola, Bruno; 8pi Collaboration

    2015-10-01

    The nuclear structure of the zirconium isotopes evolves from a mid-open neutron shell deformed region (80Zr), through a closed shell (90Zr), to a closed subshell (96Zr), and then to a sudden reappearance of deformation (100Zr). This rapid onset of deformation across the Zr isotopes is unprecedented, and the issue of how collectivity appears and disappears in these isotopes is of special interest. Until recently, only 98Zr (and maybe 100Zr) had indirect and weak evidence for shape coexistence, with only speculative interpretation of the experiments. Recent results from high precision B(E2) measurements provided direct evidence of shape coexistence in 94Zr and suggested that it may happen in many other nuclei in this region. In order to provide direct evidence of shape coexistence in 98Zr a high-statistical-quality γγ experiment was carried out with the 8 π spectrometer at ISAC-TRIUMF. The array consists of 20 Compton-suppressed hyper-pure germanium detectors plus β particle and conversion electron detectors. Excited states up to ~ 5 MeV in 98Zr were populated in the β- decay of 98Y Jπ = (0-) and 98mY J = (4,5). Preliminary results on key branching ratios will be presented. This work was supported by the Natural Sciences and Engineering Research Council of Canada and the National Research Council of Canada.

  1. Ni-Zr alloys: relationship between surface characteristics and electrocatalytic behavior

    PubMed

    Angelini; Antonione; Baricco; Daolio; Fabrizio; Rosalbino

    2000-01-01

    A relationship between electrocatalytic activity for the hydrogen evolution reaction and the surface composition of the electrode was established for Ni-Zr crystalline and amorphous alloys by means of secondary ion mass spectrometry (SIMS). Electrocatalytic activity was tested by means of cathodic polarization in 1 M KOH at 25 degrees C and the resulting exchange current density has been taken as a measure of catalytic efficiency. Surface activation treatment involved chemical etching in HF solutions; the consequent morphological and compositional surface changes were studied by differential scanning calorimetry (DSC), X-ray diffraction (XRD) and scanning electron microscopy (SEM). The electrochemical behavior of the pure elements (Ni and Zr) was also considered for comparison. All samples submitted to chemical etching in HF solutions showed an increase in electrocatalytic activity, particularly the alloy with the highest Ni content. The beneficial effect of chemical etching is due to dissolution of the zirconium oxide layer and to the formation of nanocrystalline Ni on the surfaces.

  2. Nanostructured Zr-Pd Metallic Glass Thin Film for Biochemical Applications

    NASA Astrophysics Data System (ADS)

    Ketov, Sergey V.; Shi, Xuetao; Xie, Guoqiang; Kumashiro, Ryotaro; Churyumov, Alexander Yu.; Bazlov, Andrey I.; Chen, Na; Ishikawa, Yoshifumi; Asao, Naoki; Wu, Hongkai; Louzguine-Luzgin, Dmitri V.

    2015-01-01

    Zr-Pd metallic glassy thin films with a hierarchical nano-scale structure, produced by magnetron sputtering of the Zr and Pd powder mixture, demonstrate a unique combination of physical and biochemical properties. Thermal stability of the nano-structured glassy samples, their resistance to oxidation in dry air and phase transformation behavior are discussed in the present work. These binary alloy samples also show exceptionally high corrosion resistance and spontaneous passivation in a simulated body fluid. Experiments on the catalytic activity and biocompatibility of this nanostructured metallic glass indicate that this is a very suitable material for biochemical applications. Compared to the multicomponent alloys studied earlier this binary alloy has much simpler chemical composition, which makes preparation of the sample with defined stoichiometry easier, especially when the elements have different sputtering rates.

  3. Synthesis of (U,Zr)C solid solutions under exothermic conditions. Revision

    SciTech Connect

    Wang, Lily L.; Moore, H.G.; Gladson, J.W.

    1993-10-01

    The reactions of forming (U,Zr)C solid solutions from their elemental components or similarly less stable reactants such as UC{sub 2} are strongly exothermic due to the high stability of these solid solutions. A simple approach of utilizing this heat of formation energy to assist the solid solution reaction process is intimately mix the less stable reactant powders and pressed them into compact; the compact is then heated to the ignition temperature of the reaction. The feasibility of this reaction method to synthesize (U,Zr) solid solutions has been demonstrated in this study. The preliminary results also show that both the initial composition and the heating rate have a significant effect on the nature of the reaction process. As expected the degree of powder mixing was also found to affect the completeness of the reaction.

  4. Partition coefficients of Hf, Zr, and REE between zircon, apatite, and liquid

    USGS Publications Warehouse

    Fujimaki, H.

    1986-01-01

    Concentration ratios of Hf, Zr, and REE between zircon, apatite, and liquid were determined for three igneous compositions: two andesites and a diorite. The concentration ratios of these elements between zircon and corresponding liquid can approximate the partition coefficient. Although the concentration ratios between apatite and andesite groundmass can be considered as partition coefficients, those for the apatite in the diorite may deviate from the partition coefficients. The HREE partition coefficients between zircon and liquid are very large (100 for Er to 500 for Lu), and the Hf partition coefficient is even larger. The REE partition coefficients between apatite and liquid are convex upward, and large (D=10-100), whereas the Hf and Zr partition coefficients are less than 1. The large differences between partition coefficients of Lu and Hf for zircon-liquid and for apatite-liquid are confirmed. These partition coefficients are useful for petrogenetic models involving zircon and apatite. ?? 1986 Springer-Verlag.

  5. Unique properties of CuZrAl bulk metallic glasses induced by microalloying

    SciTech Connect

    Huang, B.; Bai, H. Y.; Wang, W. H.

    2011-12-15

    We studied the glass forming abilities (GFA), mechanical, and physical properties of (CuZr){sub 92.5}Al{sub 7}X{sub 0.5} (X = La, Sm, Ce, Gd, Ho, Y, and Co) bulk metallic glasses (BMGs). We find that the GFA, mechanical, and physical properties can be markedly changed and modulated by the minor rare earth addition. The Kondo screening effect is found to exist in (CuZr){sub 92.5}Al{sub 7}Ce{sub 0.5} BMG at low temperatures and the Schottky effect exists in all the rare earth element doped BMGs. Our results indicate that the minor addition is an effective way for modulating and getting desirable properties of the BMGs. The mechanisms of the effects of the addition are discussed. The results have implications for the exploration of metallic glasses and for improving the mechanical and low temperature physical properties of BMGs.

  6. Synthesis and characterization of a polyborosilazane/Cp2ZrCl2 hybrid precursor for the Si-B-C-N-Zr multinary ceramic.

    PubMed

    Long, Xin; Shao, Changwei; Wang, Hao; Wang, Jun

    2015-09-21

    A novel zirconium-contained polyborosilazane (PBSZ-Zr) was synthesized by chemical modification of a liquid polyborosilazane (LPBSZ) with Cp2ZrCl2. A Si-B-C-N-Zr multinary ceramic was prepared via pyrolysis of PBSZ-Zr. The properties and the ceramization process of PBSZ-Zr, as well as the microstructural development and properties of the derived SiBCN-Zr ceramic, were well studied. The active Si-H and N-H groups in LPBSZ react with Zr-Cl in Cp2ZrCl2 to form PBSZ-Zr polymers. The Zr content of the SiBCN-Zr ceramic was 3.39 wt% when the weight ratio of Cp2ZrCl2 to LPBSZ was 20 : 100. The SiBCN-Zr ceramic remains amorphous when pyrolyzed below 1600 °C, but the crystal phases of Zr2CN, ZrC, BN, SiC, and Si3N4 were detected from a 1600 °C treated sample. Due to the low activity of free carbon at the interface of the SiBCN-Zr ceramic, the oxidation resistance of the SiBCN-Zr ceramic under air was improved compared with the SiBCN ceramic.

  7. Experimental partitioning of Zr, Ti, and Nb between silicate liquid and a complex noble metal alloy and the partitioning of Ti between perovskite and platinum metal

    NASA Technical Reports Server (NTRS)

    Jurewicz, Stephen R.; Jones, John H.

    1993-01-01

    El Goresy et al.'s observation of Nb, Zr, and Ta in refractory platinum metal nuggets (RPMN's) from Ca-Al-rich inclusions (CAI's) in the Allende meteorite led them to propose that these lithophile elements alloyed in the metallic state with noble metals in the early solar nebula. However, Grossman pointed out that the thermodynamic stability of Zr in the oxide phase is vastly greater than metallic Zr at estimated solar nebula conditions. Jones and Burnett suggested this discrepancy may be explained by the very non-ideal behavior of some lithophile transition elements in noble metal solutions and/or intermetallic compounds. Subsequently, Fegley and Kornacki used thermodynamic data taken from the literature to predict the stability of several of these intermetallic compounds at estimated solar nebula conditions. Palme and Schmitt and Treiman et al. conducted experiments to quantify the partitioning behavior of certain lithophile elements between silicate liquid and Pt-metal. Although their results were somewhat variable, they did suggest that Zr partition coefficients were too small to explain the observed 'percent' levels in some RPMN's. Palme and Schmitt also observed large partition coefficients for Nb and Ta. No intermetallic phases were identified. Following the work of Treiman et al., Jurewicz and Jones performed experiments to examine Zr, Nb, and Ti partitioning near solar nebula conditions. Their results showed that Zr, Nb, and Ti all have an affinity for the platinum metal, with Nb and Ti having a very strong preference for the metal. The intermetallic phases (Zr,Fe)Pt3, (Nb,Fe)Pt3, and (Ti,Fe)Pt3 were identified. Curiously, although both experiments and calculations indicate that Ti should partition strongly into Pt-metal (possibly as TiPt3), no Ti has ever been observed in any RPMN's. Fegley and Kornacki also noticed this discrepancy and hypothesized that the Ti was stabilized in perovskite which is a common phase in Allende CAI's.

  8. Missile Aerodynamics (Aerodynamique des Missiles)

    DTIC Science & Technology

    1998-11-01

    guerre froide la production des missiles a baisse’, avec pour consequence une diminution des budgets de d6veloppement. Les nouveaux types de conflits ...Roma) Directeur - Gestion de l’information LUXEMBOURG (Recherche et developpement) - DRDGI 3 Voir Belgique Ministbre de la Difense nationale NORVEGE

  9. 89 Zr(n,γ)90 Zr from a surrogate reaction approach

    NASA Astrophysics Data System (ADS)

    Ota, Shuya; Burke, J. T.; Casperson, R. J.; Escher, J. E.; Hughes, R. O.; Ressler, J. J.; Scielzo, N. D.; Thompson, I.; Austin, R. A. E.; McCleskey, E.; McCleskey, M.; Saastamoinen, A.; Ross, T.

    2015-04-01

    While recent studies have demonstrated the validity of the surrogate reaction approach for studying fission cross sections of short-lived actinides, its applicability for (n, γ) is still under investigation. We studied the γ-decay of 90 Zr produced by 91 Zr(p,d) and 92 Zr(p,t) in order to infer the 89 Zr(n, γ) cross sections. The experiments were carried out at the K150 Cyclotron facility at Texas A&M University with a 28.5-MeV proton beam. The reaction deuterons and tritons were measured at forward angles of 30-60° with the STARS (Silicon Telescope Array for Reaction Studies) array of three segmented Micron S2 silicon detectors. Compound nuclei with energies up to a few MeV above the neutron separation thresholds were populated. The coincident γ-rays were measured with the LiTeR (Livermore Texas Richmond) array of five Compton-suppressed HPGe clovers. We will present results of γ-emission probabilities of 89 Zr(n, γ) and some theoretical discussions. This work was performed under the auspices of the US Department of Energy by Lawrence Livermore National Laboratory under Contract No. DE-AC52- 07NA27344. One of the authors, S. O. is supported by JSPS Postdoctoral Fellowship for Research Abroad.

  10. Precipitate Evolution and Strengthening in Supersaturated Rapidly Solidified Al-Sc-Zr Alloys

    NASA Astrophysics Data System (ADS)

    Deane, Kyle; Kampe, S. L.; Swenson, Douglas; Sanders, P. G.

    2017-04-01

    Because of the low diffusivities of scandium and zirconium in aluminum, trialuminide precipitates containing these elements have been reported to possess excellent thermal stability at temperatures of 573 K (300 °C) and higher. However, the relatively low equilibrium solubilities of these elements in aluminum limit the achievable phase fraction and, in turn, strengthening contributions from these precipitates. One method of circumventing this limitation involves the use of rapid solidification techniques to suppress the initial formation of precipitates in alloys containing higher solute compositions. This work specifically discusses the fabrication of supersaturated Al-Sc, Al-Zr, and Al-Sc-Zr alloys via melt spinning, in which supersaturations of at least 0.55 at. pct Zr and 0.8 at. pct Sc are shown to be attainable through XRD analysis. The resulting ribbons were subjected to a multistep aging heat treatment in order to encourage a core-shell precipitate morphology, the precipitate evolution behavior was monitored with XRD and TEM, and the aging behavior was observed. While aging in these alloys is shown to follow similar trends to conventionally processed materials reported in literature, with phase fraction increasing until higher aging temperatures causing a competing dissolution effect, the onset of precipitation begins at lower temperatures than previously observed and the peak hardnesses occurred at higher temperature steps due to an increased aging time associated with increased solute concentration. Peaking in strength at a higher temperature doesn't necessarily mean an increase in thermal stability, but rather emphasizes the need for intelligently designed heat treatments to take full advantage of the potential strengthening of supersaturated Al-Sc-Zr alloys.

  11. Precipitate Evolution and Strengthening in Supersaturated Rapidly Solidified Al-Sc-Zr Alloys

    NASA Astrophysics Data System (ADS)

    Deane, Kyle; Kampe, S. L.; Swenson, Douglas; Sanders, P. G.

    2017-02-01

    Because of the low diffusivities of scandium and zirconium in aluminum, trialuminide precipitates containing these elements have been reported to possess excellent thermal stability at temperatures of 573 K (300 °C) and higher. However, the relatively low equilibrium solubilities of these elements in aluminum limit the achievable phase fraction and, in turn, strengthening contributions from these precipitates. One method of circumventing this limitation involves the use of rapid solidification techniques to suppress the initial formation of precipitates in alloys containing higher solute compositions. This work specifically discusses the fabrication of supersaturated Al-Sc, Al-Zr, and Al-Sc-Zr alloys via melt spinning, in which supersaturations of at least 0.55 at. pct Zr and 0.8 at. pct Sc are shown to be attainable through XRD analysis. The resulting ribbons were subjected to a multistep aging heat treatment in order to encourage a core-shell precipitate morphology, the precipitate evolution behavior was monitored with XRD and TEM, and the aging behavior was observed. While aging in these alloys is shown to follow similar trends to conventionally processed materials reported in literature, with phase fraction increasing until higher aging temperatures causing a competing dissolution effect, the onset of precipitation begins at lower temperatures than previously observed and the peak hardnesses occurred at higher temperature steps due to an increased aging time associated with increased solute concentration. Peaking in strength at a higher temperature doesn't necessarily mean an increase in thermal stability, but rather emphasizes the need for intelligently designed heat treatments to take full advantage of the potential strengthening of supersaturated Al-Sc-Zr alloys.

  12. Iron aluminide useful as electrical resistance heating elements

    DOEpatents

    Sikka, V.K.; Deevi, S.C.; Fleischhauer, G.S.; Hajaligol, M.R.; Lilly, A.C. Jr.

    1997-04-15

    The invention relates generally to aluminum containing iron-base alloys useful as electrical resistance heating elements. The aluminum containing iron-base alloys have improved room temperature ductility, electrical resistivity, cyclic fatigue resistance, high temperature oxidation resistance, low and high temperature strength, and/or resistance to high temperature sagging. The alloy has an entirely ferritic microstructure which is free of austenite and includes, in weight %, over 4% Al, {<=}1% Cr and either {>=}0.05% Zr or ZrO{sub 2} stringers extending perpendicular to an exposed surface of the heating element or {>=}0.1% oxide dispersoid particles. The alloy can contain 14-32% Al, {<=}2% Ti, {<=}2% Mo, {<=}1% Zr, {<=}1% C, {<=}0.1% B, {<=}30% oxide dispersoid and/or electrically insulating or electrically conductive covalent ceramic particles, {<=}1% rare earth metal, {<=}1% oxygen, {<=}3% Cu, balance Fe. 64 figs.

  13. Iron aluminide useful as electrical resistance heating elements

    DOEpatents

    Sikka, Vinod K.; Deevi, Seetharama C.; Fleischhauer, Grier S.; Hajaligol, Mohammad R.; Lilly, Jr., A. Clifton

    2001-01-01

    The invention relates generally to aluminum containing iron-base alloys useful as electrical resistance heating elements. The aluminum containing iron-base alloys have improved room temperature ductility, electrical resistivity, cyclic fatigue resistance, high temperature oxidation resistance, low and high temperature strength, and/or resistance to high temperature sagging. The alloy has an entirely ferritic microstructure which is free of austenite and includes, in weight %, over 4% Al, .ltoreq.1% Cr and either .gtoreq.0.05% Zr or ZrO.sub.2 stringers extending perpendicular to an exposed surface of the heating element or .gtoreq.0.1% oxide dispersoid particles. The alloy can contain 14-32% Al, .ltoreq.2% Ti, .ltoreq.2% Mo, .ltoreq.1% Zr, .ltoreq.1% C, .ltoreq.0.1% B, .ltoreq.30% oxide dispersoid and/or electrically insulating or electrically conductive covalent ceramic particles, .ltoreq.1% rare earth metal, .ltoreq.1% oxygen, .ltoreq.3% Cu, balance Fe.

  14. Iron aluminide useful as electrical resistance heating elements

    DOEpatents

    Sikka, Vinod K.; Deevi, Seetharama C.; Fleischhauer, Grier S.; Hajaligol, Mohammad R.; Lilly, Jr., A. Clifton

    1997-01-01

    The invention relates generally to aluminum containing iron-base alloys useful as electrical resistance heating elements. The aluminum containing iron-base alloys have improved room temperature ductility, electrical resistivity, cyclic fatigue resistance, high temperature oxidation resistance, low and high temperature strength, and/or resistance to high temperature sagging. The alloy has an entirely ferritic microstructure which is free of austenite and includes, in weight %, over 4% Al, .ltoreq.1% Cr and either .gtoreq.0.05% Zr or ZrO.sub.2 stringers extending perpendicular to an exposed surface of the heating element or .gtoreq.0.1% oxide dispersoid particles. The alloy can contain 14-32% Al, .ltoreq.2% Ti, .ltoreq.2% Mo, .ltoreq.1% Zr, .ltoreq.1% C, .ltoreq.0.1% B, .ltoreq.30% oxide dispersoid and/or electrically insulating or electrically conductive covalent ceramic particles, .ltoreq.1% rare earth metal, .ltoreq.1% oxygen, .ltoreq.3% Cu, balance Fe.

  15. Iron aluminide useful as electrical resistance heating elements

    DOEpatents

    Sikka, Vinod K.; Deevi, Seetharama C.; Fleischhauer, Grier S.; Hajaligol, Mohammad R.; Lilly, Jr., A. Clifton

    1999-01-01

    The invention relates generally to aluminum containing iron-base alloys useful as electrical resistance heating elements. The aluminum containing iron-base alloys have improved room temperature ductility, electrical resistivity, cyclic fatigue resistance, high temperature oxidation resistance, low and high temperature strength, and/or resistance to high temperature sagging. The alloy has an entirely ferritic microstructure which is free of austenite and includes, in weight %, over 4% Al, .ltoreq.1% Cr and either .gtoreq.0.05% Zr or ZrO.sub.2 stringers extending perpendicular to an exposed surface of the heating element or .gtoreq.0.1% oxide dispersoid particles. The alloy can contain 14-32% Al, .ltoreq.2% Ti, .ltoreq.2% Mo, .ltoreq.1% Zr, .ltoreq.1% C, .ltoreq.0.1% B, .ltoreq.30% oxide dispersoid and/or electrically insulating or electrically conductive covalent ceramic particles, .ltoreq.1% rare earth metal, .ltoreq.1% oxygen, .ltoreq.3% Cu, balance Fe.

  16. Pr-Zr-Co precipitation-hardened magnet

    NASA Astrophysics Data System (ADS)

    Gabay, A. M.; Zhang, Yong; Hadjipanayis, G. C.

    2000-06-01

    Hard magnetic properties have been found in homogenized and subsequently aged Pr-Zr-Co alloys. Transmission electron microscopy reveals a microstructure consisting of a Pr2(Co, Zr)17 matrix with (Pr, Zr)Co5 precipitates formed after aging the homogenized alloys with the (Pr, Zr)Co5+δ structure. This microstructure is similar to that of the Sm-Co-Cu-Zr precipitation-hardened magnets. However, unlike Sm2Co17, the easy magnetization direction (EMD) of Pr2Co17 lies in a basal plane. The coexistence of the 2:17 matrix phase with EMD∥(001) and the 1:5 cell-boundary phase with EMD∥[001] results in unusual alignment effects. Anisotropic Pr11.5Zr4Co85 powders with coercivity of 4.1 kOe and energy product of 7.2 MGOe were obtained.

  17. Superelastic properties of biomedical (Ti-Zr)-Mo-Sn alloys.

    PubMed

    Ijaz, Muhammad Farzik; Kim, Hee Young; Hosoda, Hideki; Miyazaki, Shuichi

    2015-03-01

    A new class of Ti-50Zr base biomedical superelastic alloys was developed in this study. The (Ti-Zr)-Mo-Sn alloys exhibited a shape memory effect and superelastic property by adjusting Mo and Sn contents. The (Ti-Zr)-1.5Mo-3Sn alloy revealed the most stable superelasticity among (Ti-Zr)-(1-2)Mo-(2-4)Sn alloys. The superelastic recovery strain showed a strong dependence on heat treatment temperature after cold working in the (Ti-Zr)-1.5Mo-3Sn alloy. The superelastic recovery strain increased as the heat treatment temperature increased although the critical stress for slip decreased. The (Ti-Zr)-1.5Mo-3Sn alloy heat treated at 1073K exhibited excellent superelastic properties with a large recovery strain as large as 7% which is due to the strong {001}β<110>β recrystallization texture.

  18. Review of oxidation of Nb-1Zr

    SciTech Connect

    DiStefano, J.R.

    1989-04-01

    A major objective of the SP-100 Program Nuclear Assembly Test is to demonstrate the performance of a full-scale nuclear subsystem of a 100-kWe space nuclear power supply. The test will be run in a large vacuum chamber to protect the Nb-1Zr components from oxidation during operation. Much information about the oxidation of niobium and Nb-1Zr alloy already exists, and previous work in this area is reviewed. Oxidation of Nb-1Zr can proceed by solution, internal oxidation, and/or film formation. At temperatures up to about 650 K (377/degree/C), oxidation generally follows a parabolic rate law because of the formation of protective oxide(s). At higher temperatures, oxidation becomes linear, but results are extremely sensitive to pressure and other system variables. Results obtained by several investigators could not be predicted using empirical equations developed by one investigator relating the increase in oxygen concentration to pressure, temperature, time, and specimen thickness. Additional data are required to provide more reliable guidelines for system operation that will protect against catastrophic effects. 20 refs., 12 figs., 7 tabs.

  19. New technology to realize printed radiating elements

    NASA Astrophysics Data System (ADS)

    Tarot, A. C.; Sharaiha, A.; Terret, C.; Garnier, Y.

    1995-05-01

    A plating process for low-cost dielectric substrates (like polypropylene or foam) has been developed by the CNET (Centre National d'Etudes des Telecommunications) in collaboration with LAM (Laboratoire Antennes et Microelectronique). This process allows the realization of printed radiating elements like microstrip antennas. An example of a multilayered printed antenna realized with this technology is presented with its performance.

  20. Implications of near-rim compositional zoning in rutile for geothermometry, geospeedometry, and trace element equilibration

    NASA Astrophysics Data System (ADS)

    Kohn, Matthew J.; Penniston-Dorland, Sarah C.; Ferreira, Jean C. S.

    2016-10-01

    In principle, compositional profiling of the near-rim region of minerals can provide insight into cooling rates, but presumes that loss or gain of material from the crystal rim is not kinetically restricted. Trace element depth profiles collected for Zr, Hf, Ta, Nb, and U in amphibolite-facies rutile grains of the Catalina Schist, southern California, show significant variability within a single rock: Profiles of the same element among different grains can have significantly different slopes, grains with indistinguishable Zr profiles show vastly different Nb profiles, and grains with indistinguishable Nb profiles show different Zr profiles. Textural and kinetic idiosyncrasies within the matrix apparently affect the ability of specific crystals to accept or release trace elements, and impugn the common assumption that mineral surfaces maintain equilibrium at amphibolite-facies conditions. A new model that limits the flux of Zr from rutile grains helps explain commonly observed compositional profiles, and implies that inversion of compositional profiles assuming equilibrium among grain surfaces will invariably overestimate cooling rates. Few grains may record the low closure temperatures that experimentally determined diffusivities imply. Rather, higher temperatures will be retained, depending on the proximity of reactants and products in the matrix. Silicon diffusion does not control Zr reequilibration in rutile, and relative diffusion coefficients ( D's) of trace elements in rutile are D Zr ~ D Hf ~ 10 D Nb ~ 20 D Ta ~ 40 D U.

  1. Comparison of the Effect of Individual and Combined Zr and Mn Additions on the Fracture Behavior of Al-Cu-Li Alloy AA2198 Rolled Sheet

    NASA Astrophysics Data System (ADS)

    Tsivoulas, Dimitrios; Prangnell, Philip B.

    2013-11-01

    The effect of individual and combined addition of dispersoid-forming alloying elements Zr and Mn on the fracture behavior of the Al-Cu-Li alloy 2198 has been investigated by the Kahn tear test. Overall, the standard baseline 2198 alloy containing only Zr exhibited the best performance, while the alloy with the combined presence of Zr and Mn was slightly inferior. The lowest properties were seen for a Zr-free 2198-0.4Mn alloy variant. In the T351 temper fracture initiated at coarse constituent particles that formed large cavities and microvoid sheets linked the initial sites of void growth. In the Mn-containing alloys microvoids clearly nucleated at the coarser Al20Cu2Mn3 dispersoids within the microstructure, while this was not identifiable for the finer coherent Al3Zr dispersoids. However, this difference in the mechanism of cavity linkage had little effect on the overall toughness of the materials, which was more closely related to the effect of Mn and Zr on the level of recrystallization. Extended artificial aging promoted grain boundary decohesion due to the precipitation of high densities of T1 particles on GBs and favored a cleavage fracture mode. Particle decohesive fracture was also promoted by T1 precipitation on the Mn dispersoids.

  2. Distribution of Oxygen Vacancies and Gadolinium Dopants in ZrO2-CeO2 Multi-Layer Films Grown on α-Al2O3

    SciTech Connect

    Wang, Chong M.; Engelhard, Mark H.; Azad, Samina; Saraf, Laxmikant V.; McCready, David E.; Shutthanandan, V.; Yu, Zhongqing; Thevuthasan, Suntharampillai; Watanabe, M.; Williams, D. B.

    2006-06-15

    Gd-doped ZrO2 and CeO2 multi-layer films were deposited on α-Al2O3 (0001) using oxygen plasma assisted molecular beam epitaxy. Oxygen vacancies and Gd dopant distributions were investigated in these multi-layer films using x-ray diffraction (XRD), conventional and high-resolution transmission electron microscopy (HRTEM), annular dark-filed imaging in scanning transmission electron microscopy (STEM), energy dispersive x-ray spectroscopy (EDS) elemental mapping and x-ray photoelectron spectroscopy (XPS) depth profiling. EDS and XPS reveal that Gd concentration in the ZrO2 layer is lower than that in the CeO2 layer. As a result, higher oxygen vacancy concentration exists in CeO2 layers compared to that in ZrO2 layers. In addition, Gd is found to segregate only at the interfaces formed during the deposition of CeO2 layers on ZrO2 layers. On the other hand, the interfaces formed during the deposition of ZrO2 layers on CeO2 layers did not show any Gd segregation. The Gd segregation behavior at the every other interface is believed to be associated with the low solubility of Gd in ZrO2.

  3. Computational Design of ZrO2-SiO2 Coatings for Oxidation of ZrB2/ZrC Composites Containing ZrSix Intermetallics at 1700 degrees C

    DTIC Science & Technology

    2009-03-01

    available thermodynamic data [Bale02] determines the silicide compounds of ZrSi, Zr5Si3, and Zr2Si, as shown in Figure 3. However, the Okamoto phase...partial pressure greater than ambient pressure at 2000 K even with a thermodynamic activity of 0.01 considering equilibration with a silicide (e.g...ZrCh scale with the silicide emerging along the scale/matrix interface, as shown in Figure 2. The diffusional path must cross the join at least

  4. Physical properties of molten core materials: Zr-Ni and Zr-Cr alloys measured by electrostatic levitation

    NASA Astrophysics Data System (ADS)

    Ohishi, Yuji; Kondo, Toshiki; Ishikawa, Takehiko; Okada, Junpei T.; Watanabe, Yuki; Muta, Hiroaki; Kurosaki, Ken; Yamanaka, Shinsuke

    2017-03-01

    It is important to understand the behaviors of molten core materials to investigate the progression of a core meltdown accident. In the early stages of bundle degradation, low-melting-temperature liquid phases are expected to form via the eutectic reaction between Zircaloy and stainless steel. The main component of Zircaloy is Zr and those of stainless steel are Fe, Ni, and Cr. Our group has previously reported physical property data such as viscosity, density, and surface tension for Zr-Fe liquid alloys using an electrostatic levitation technique. In this study, we report the viscosity, density, and surface tension of Zr-Ni and Zr-Cr liquid alloys (Zr1-xNix (x = 0.12 and 0.24) and Zr0.77Cr0.23) using the electrostatic levitation technique.

  5. Mass transport and crystal growth of the mixed ZrS2-ZrSe2 system

    NASA Technical Reports Server (NTRS)

    Wiedemeier, Heribert; Goldman, Howard

    1986-01-01

    The solid solubility of the ZrS2-ZrSe2 system was reinvestigated by annealing techniques to establish the relationship between composition and lattice parameters. Mixed crystals of ZrS(2x)Se2(1-x) for selected compositions of the source material were grown by chemical vapor transport and characterized by X-ray diffraction and microscopic methods. The mass transport rates and crystal growth of ZrSSe were investigated and compared with those of other compositions. The mass fluxes of the mixed system showed an increase with increasing selenium content. The transport products were richer in ZrSe2 than the residual source materials when the ZrSe2 content of the starting materials was greater than 50 mol.-pct. The mass transport rates revealed an increasing mass flux with pressure.

  6. Producing composite materials based on ZrB2, ZrB2-SiC

    NASA Astrophysics Data System (ADS)

    Mirovoi, Yu A.; Burlachenko, A. G.; Buyakova, S. P.; Sevostiyanova, I. N.; Kulkov, S. N.

    2016-11-01

    The effect of mechanical treatment by planetary ball milling on the properties of hot pressed ZrB2 - SiC ceramics was studied. It has been shown that material densification after mechanical treatment is finished at initial stages of sintering process. Addition of SiC causes a substantial increase in density of the sample to 99% of the theoretical powder containing 20% of silicon carbide, in comparison with samples ZrB2 density not exceeding 76%. It has been shown that all defects which were accumulated during mechanical treatment anneal in hot pressure process and there are no any changes of CDD values in sintered ceramics.

  7. Effects of phase constitution on magnetic susceptibility and mechanical properties of Zr-rich Zr-Mo alloys.

    PubMed

    Suyalatu; Kondo, Ryota; Tsutsumi, Yusuke; Doi, Hisashi; Nomura, Naoyuki; Hanawa, Takao

    2011-12-01

    The effects of the microstructures and phases of Zr-rich Mo alloys on their magnetic susceptibilities and mechanical properties were investigated in order to develop a Zr alloy with low magnetic susceptibility for use in magnetic resonance imaging (MRI). The magnetic susceptibility was measured with a magnetic susceptibility balance, while mechanical properties were evaluated by a tensile test. The microstructure was evaluated with an X-ray diffractometer, an optical microscope, and a transmission electron microscope. Evaluation of the microstructures revealed that the α' phase was the dominant form at less than 2% Mo content in the as-cast alloy. The ω phase was formed in as-cast Zr-3Mo but disappeared with aging at 973 K. Magnetic susceptibility was reflected in the phase constitution: the susceptibility showed a local minimum at Zr-(0.5-1)Mo with mostly α' phase and a minimum at Zr-3Mo with mostly β and ω phases. The magnetic susceptibility of as-cast Zr-3Mo increased at 973 K due to disappearance of the ω phase. However, the susceptibility was still as low as that of as-cast Zr-1Mo. The ultimate tensile strength of α'-based Zr-Mo alloys was tailored from 674 to 970 MPa, and the corresponding elongation varied from 11.1% to 2.9%. Because Zr-Mo alloys containing ω phase were found, through tensile tests, to be brittle this phase should be avoided, irrespective of the low magnetic susceptibility, in order to maintain mechanical reliability. Elongation of the Zr-3Mo alloy was dramatically improved when the phase constitution was changed to α and β phases by aging at 973 K for 86.4 ks. The magnetic susceptibilities of the α'-based Zr-Mo alloys are one-third those of Ti-6Al-4V and Ti-6Al-7Nb, and thus these Zr alloys are useful for medical devices under MRI.

  8. Modelisation par elements finis du muscle strie

    NASA Astrophysics Data System (ADS)

    Leonard, Mathieu

    Ce present projet de recherche a permis. de creer un modele par elements finis du muscle strie humain dans le but d'etudier les mecanismes engendrant les lesions musculaires traumatiques. Ce modele constitue une plate-forme numerique capable de discerner l'influence des proprietes mecaniques des fascias et de la cellule musculaire sur le comportement dynamique du muscle lors d'une contraction excentrique, notamment le module de Young et le module de cisaillement de la couche de tissu conjonctif, l'orientation des fibres de collagene de cette membrane et le coefficient de poisson du muscle. La caracterisation experimentale in vitro de ces parametres pour des vitesses de deformation elevees a partir de muscles stries humains actifs est essentielle pour l'etude de lesions musculaires traumatiques. Le modele numerique developpe est capable de modeliser la contraction musculaire comme une transition de phase de la cellule musculaire par un changement de raideur et de volume a l'aide des lois de comportement de materiau predefinies dans le logiciel LS-DYNA (v971, Livermore Software Technology Corporation, Livermore, CA, USA). Le present projet de recherche introduit donc un phenomene physiologique qui pourrait expliquer des blessures musculaires courantes (crampes, courbatures, claquages, etc.), mais aussi des maladies ou desordres touchant le tissu conjonctif comme les collagenoses et la dystrophie musculaire. La predominance de blessures musculaires lors de contractions excentriques est egalement exposee. Le modele developpe dans ce projet de recherche met ainsi a l'avant-scene le concept de transition de phase ouvrant la porte au developpement de nouvelles technologies pour l'activation musculaire chez les personnes atteintes de paraplegie ou de muscles artificiels compacts pour l'elaboration de protheses ou d'exosquelettes. Mots-cles Muscle strie, lesion musculaire, fascia, contraction excentrique, modele par elements finis, transition de phase

  9. Fractionation of Zr and Hf during the differentiation of peralkaline magmatic system (Lovozero rare metal deposit, Kola Peninsula)

    NASA Astrophysics Data System (ADS)

    Kogarko, Liya

    2016-04-01

    Zirconium and hafnium are valuable strategic metals. We assessed principal features of the distribution of these elements in peralkaline rocks, ores and rock-forming and accessory minerals of Lovozero complex. The accumulation of these elements during the evolution of alkaline magma of Lovozero deposit up to extremely high concentrations in eudialyte ores (5-8% ZrO2 and 1200-1800 ppm Hf) has been established. These ores represent valuable complex raw material not only for Zr and Hf, but for REE as well. We evaluated partition coefficients of these elements in alkaline pyroxenes (aegirines) from porphyry-like agpaitic lujavrites of Lovozero massif which are 0.40 for zirconium and 0.58 for hafnium. We assessed variations of Zr/Hf ratio for all the rocks of Lovozero alkaline massif. The growth of this ratio in the course of the evolution of alkaline magma has been observed from 38 in the earliest magmatic phase, to 44 in the second phase and to 51-53 in the latest manifestation of alkaline magmatsm. On the basis of the obtained data and equations of equilibrium and fractional crystallization the model of the fractionation of zirconium and hafnium during the evolution of Lovozero intrusion has been constructed. We have demonstrated that the source of strongly enriched magmatic systems similar to Lovozero rare metal deposit is short-lived enriched reservoir - metasomatized and carbonatized mantle substrate. We investigated the fractionation of zirconium and hafnium in carbonatized mantle xenoliths from East Antarctica. The elevated Zr/Hf ratios (up to 125) in metasomatized xenoliths by comparison with the chondritic value have been found. The main reactions of carbonate metasomatism lead to the replacement of primary orthopyroxene by clinopyroxene 2Mg2Si2O6 + CaMg(CO3)2 = 2Mg2SiO4 + CaMgSi2O6 + 2CO2 3CaMg(CO3)2 + CaMgSi2O6 = 4CaCO3 + 2Mg2SiO4 + 2CO2 The substantial expansion of the clinopyroxene crystallization field results in increase of Zr/Hf ratio in equilibrium

  10. Médecine des voyages

    PubMed Central

    Aw, Brian; Boraston, Suni; Botten, David; Cherniwchan, Darin; Fazal, Hyder; Kelton, Timothy; Libman, Michael; Saldanha, Colin; Scappatura, Philip; Stowe, Brian

    2014-01-01

    Résumé Objectif Définir la pratique de la médecine des voyages, présenter les éléments fondamentaux d’une consultation complète préalable aux voyages à des voyageurs internationaux et aider à identifier les patients qu’il vaudrait mieux envoyer en consultation auprès de professionnels de la médecine des voyages. Sources des données Les lignes directrices et les recommandations sur la médecine des voyages et les maladies liées aux voyages publiées par les autorités sanitaires nationales et internationales ont fait l’objet d’un examen. Une recension des ouvrages connexes dans MEDLINE et EMBASE a aussi été effectuée. Message principal La médecine des voyages est une spécialité très dynamique qui se concentre sur les soins préventifs avant un voyage. Une évaluation exhaustive du risque pour chaque voyageur est essentielle pour mesurer avec exactitude les risques particuliers au voyageur, à son itinéraire et à sa destination et pour offrir des conseils sur les interventions les plus appropriées en gestion du risque afin de promouvoir la santé et prévenir les problèmes médicaux indésirables durant le voyage. Des vaccins peuvent aussi être nécessaires et doivent être personnalisés en fonction des antécédents d’immunisation du voyageur, de son itinéraire et du temps qu’il reste avant son départ. Conclusion La santé et la sécurité d’un voyageur dépendent du degré d’expertise du médecin qui offre le counseling préalable à son voyage et les vaccins, au besoin. On recommande à ceux qui donnent des conseils aux voyageurs d’être conscients de l’ampleur de cette responsabilité et de demander si possible une consultation auprès de professionnels de la médecine des voyages pour tous les voyageurs à risque élevé.

  11. Trace Element Abundances in Extraterrestrial Apatite and Merrillite

    NASA Astrophysics Data System (ADS)

    Ward, D.; Bischoff, A.; Roszjar, J.; Berndt, J.; Whitehouse, M. J.

    2016-08-01

    The trace element abundances (Sc, Ti, V, Cr, Mn, Co, As, Rb, Sr, Y, Zr, Nb, Ba, Hf, Ta, Pb, Th, U, as well as the REE) of 133 apatite and 163 merrillite grains from 24 meteorites, covering 9 different classes were analyzed by LA-ICP-MS and SIMS.

  12. Hot Workability of CuZr-Based Shape Memory Alloys for Potential High-Temperature Applications

    NASA Astrophysics Data System (ADS)

    Biffi, Carlo Alberto; Tuissi, Ausonio

    2014-07-01

    The research on high-temperature shape memory alloys has been growing because of the interest of several potential industrial fields, such as automotive, aerospace, mechanical, and control systems. One suitable candidate is given by the CuZr system, because of its relative low price in comparison with others, like the NiTi-based one. In this context, the goal of this work is the study of hot workability of some CuZr-based shape memory alloys. In particular, this study addresses on the effect of hot rolling process on the metallurgical and calorimetric properties of the CuZr system. The addition of some alloying elements (Cr, Co, Ni, and Ti) is taken into account and their effect is also put in comparison with each other. The alloys were produced by means of an arc melting furnace in inert atmosphere under the shape of cigars. Due to the high reactivity of these alloys at high temperature, the cigars were sealed in a stainless steel can before the processing and two different procedures of hot rolling were tested. The characterization of the rolled alloys is performed using discrete scanning calorimetry in terms of evolution of the martensitic transformation and scanning electron microscopy for the microstructural investigations. Additionally, preliminary tests of laser interaction has been also proposed on the alloy more interesting for potential applications, characterized by high transformation temperatures and its good thermal stability.

  13. Combinatorial development of antibacterial Zr-Cu-Al-Ag thin film metallic glasses

    PubMed Central

    Liu, Yanhui; Padmanabhan, Jagannath; Cheung, Bettina; Liu, Jingbei; Chen, Zheng; Scanley, B. Ellen; Wesolowski, Donna; Pressley, Mariyah; Broadbridge, Christine C.; Altman, Sidney; Schwarz, Udo D.; Kyriakides, Themis R.; Schroers, Jan

    2016-01-01

    Metallic alloys are normally composed of multiple constituent elements in order to achieve integration of a plurality of properties required in technological applications. However, conventional alloy development paradigm, by sequential trial-and-error approach, requires completely unrelated strategies to optimize compositions out of a vast phase space, making alloy development time consuming and labor intensive. Here, we challenge the conventional paradigm by proposing a combinatorial strategy that enables parallel screening of a multitude of alloys. Utilizing a typical metallic glass forming alloy system Zr-Cu-Al-Ag as an example, we demonstrate how glass formation and antibacterial activity, two unrelated properties, can be simultaneously characterized and the optimal composition can be efficiently identified. We found that in the Zr-Cu-Al-Ag alloy system fully glassy phase can be obtained in a wide compositional range by co-sputtering, and antibacterial activity is strongly dependent on alloy compositions. Our results indicate that antibacterial activity is sensitive to Cu and Ag while essentially remains unchanged within a wide range of Zr and Al. The proposed strategy not only facilitates development of high-performing alloys, but also provides a tool to unveil the composition dependence of properties in a highly parallel fashion, which helps the development of new materials by design. PMID:27230692

  14. Resistive switching mechanism of Ag/ZrO2:Cu/Pt memory cell

    NASA Astrophysics Data System (ADS)

    Long, Shibing; Liu, Qi; Lv, Hangbing; Li, Yingtao; Wang, Yan; Zhang, Sen; Lian, Wentai; Zhang, Kangwei; Wang, Ming; Xie, Hongwei; Liu, Ming

    2011-03-01

    Resistive switching mechanism of zirconium oxide-based resistive random access memory (RRAM) devices composed of Cu-doped ZrO2 film sandwiched between an oxidizable electrode and an inert electrode was investigated. The Ag/ZrO2:Cu/Pt RRAM devices with crosspoint structure fabricated by e-beam evaporation and e-beam lithography show reproducible bipolar resistive switching. The linear I- V relationship of low resistance state (LRS) and the dependence of LRS resistance ( R ON) and reset current ( I reset) on the set current compliance ( I comp) indicate that the observed resistive switching characteristics of the Ag/ZrO2:Cu/Pt device should be ascribed to the formation and annihilation of localized conductive filaments (CFs). The physical origin of CF was further analyzed by transmission electron microscopy (TEM) and energy dispersive X-ray spectroscopy (EDS). CFs were directly observed by cross-sectional TEM. According to EDS and elemental mapping analysis, the main chemical composition of CF is determined by Ag atoms, coming from the Ag top electrode. On the basis of these experiments, we propose that the set and reset process of the device stem from the electrochemical reactions in the zirconium oxide under different external electrical stimuli.

  15. Combinatorial development of antibacterial Zr-Cu-Al-Ag thin film metallic glasses

    NASA Astrophysics Data System (ADS)

    Liu, Yanhui; Padmanabhan, Jagannath; Cheung, Bettina; Liu, Jingbei; Chen, Zheng; Scanley, B. Ellen; Wesolowski, Donna; Pressley, Mariyah; Broadbridge, Christine C.; Altman, Sidney; Schwarz, Udo D.; Kyriakides, Themis R.; Schroers, Jan

    2016-05-01

    Metallic alloys are normally composed of multiple constituent elements in order to achieve integration of a plurality of properties required in technological applications. However, conventional alloy development paradigm, by sequential trial-and-error approach, requires completely unrelated strategies to optimize compositions out of a vast phase space, making alloy development time consuming and labor intensive. Here, we challenge the conventional paradigm by proposing a combinatorial strategy that enables parallel screening of a multitude of alloys. Utilizing a typical metallic glass forming alloy system Zr-Cu-Al-Ag as an example, we demonstrate how glass formation and antibacterial activity, two unrelated properties, can be simultaneously characterized and the optimal composition can be efficiently identified. We found that in the Zr-Cu-Al-Ag alloy system fully glassy phase can be obtained in a wide compositional range by co-sputtering, and antibacterial activity is strongly dependent on alloy compositions. Our results indicate that antibacterial activity is sensitive to Cu and Ag while essentially remains unchanged within a wide range of Zr and Al. The proposed strategy not only facilitates development of high-performing alloys, but also provides a tool to unveil the composition dependence of properties in a highly parallel fashion, which helps the development of new materials by design.

  16. Combinatorial development of antibacterial Zr-Cu-Al-Ag thin film metallic glasses.

    PubMed

    Liu, Yanhui; Padmanabhan, Jagannath; Cheung, Bettina; Liu, Jingbei; Chen, Zheng; Scanley, B Ellen; Wesolowski, Donna; Pressley, Mariyah; Broadbridge, Christine C; Altman, Sidney; Schwarz, Udo D; Kyriakides, Themis R; Schroers, Jan

    2016-05-27

    Metallic alloys are normally composed of multiple constituent elements in order to achieve integration of a plurality of properties required in technological applications. However, conventional alloy development paradigm, by sequential trial-and-error approach, requires completely unrelated strategies to optimize compositions out of a vast phase space, making alloy development time consuming and labor intensive. Here, we challenge the conventional paradigm by proposing a combinatorial strategy that enables parallel screening of a multitude of alloys. Utilizing a typical metallic glass forming alloy system Zr-Cu-Al-Ag as an example, we demonstrate how glass formation and antibacterial activity, two unrelated properties, can be simultaneously characterized and the optimal composition can be efficiently identified. We found that in the Zr-Cu-Al-Ag alloy system fully glassy phase can be obtained in a wide compositional range by co-sputtering, and antibacterial activity is strongly dependent on alloy compositions. Our results indicate that antibacterial activity is sensitive to Cu and Ag while essentially remains unchanged within a wide range of Zr and Al. The proposed strategy not only facilitates development of high-performing alloys, but also provides a tool to unveil the composition dependence of properties in a highly parallel fashion, which helps the development of new materials by design.

  17. Composition, atomic transport, and chemical stability of ZrAlxOy ultrathin films deposited on Si(001)

    NASA Astrophysics Data System (ADS)

    Morais, J.; da Rosa, E. B. O.; Pezzi, R. P.; Miotti, L.; Baumvol, I. J. R.

    2001-09-01

    The stability of a ZrAlxOy film sputtered on Si upon thermal annealing in vacuum or in O2 was investigated. X-ray diffraction indicated that the as-deposited film was amorphous and remained so after annealing. Rutherford backscattering, narrow nuclear resonance profiling, and low-energy ion scattering provided the average composition of the film and the depth distributions of different elements. Chemical analysis of these elements was accessed by x-ray photoelectron spectroscopy. Annealing in vacuum produced thickness inhomogeneities and/or transport of very small amounts of Si from the substrate into the overlying film, with formation of Si precipitates. Annealing in O2 led to oxygen exchange throughout the film, as well as Si transport in slightly higher amounts than in vacuum. Differently from the observed upon annealing in vacuum, Si was either incorporated into the Zr,Al-O framework or oxidized in SiO2.

  18. Partitioning of Zr and Nb between coexisting opaque phases in lunar rocks _ Determined by quantitative proton microprobe analysis

    NASA Astrophysics Data System (ADS)

    Blank, H.; El Goresy, A.; Janicke, J.; Nobiling, R.; Traxel, K.

    1984-04-01

    The chemical partitioning among coexisting opaque phases of various assemblages in different lunar rocks from several landing sites is studied using electron microprobe techniques for major and minor elements and proton microprobe analyses for trace elements. In Apollo 17 rocks, the partitioning of Zr between armalcolite and ilmenite is determined in rocks showing different crystallization sequences. In olivine porphyritic basalts, Zr partitions in favor of armalcolite, probably due to equilibration between armalcolite and ilmenite achieved by the reactions involving armalcolite. Apollo 15 basalts contain ulvoespinel/ilmenite-bearing assemblages of entirely different origins: (1) subsolidus reactions leading to 'exosolution' of ilmenite from ulvoespinel and (2) isobarically invariant reaction leading to formation of ilmenite + fayalite as a result of the reaction between ulvoespinel + silica.

  19. Optical Properties of Ar Ions Irradiated Nanocrystalline ZrC and ZrN Thin Films

    NASA Technical Reports Server (NTRS)

    Martin, C.; Miller, K. H.; Makino, H.; Craciun, D.; Simeone, D.; Craciun, V.

    2016-01-01

    Thin nanocrystalline ZrC and ZrN films (less than 400 nanometers), grown on (100) Si substrates at a substrate temperature of 500 degrees Centigrade by the pulsed laser deposition (PLD) technique, were irradiated by 800 kiloelectronvolts Ar ion irradiation with fluences from 1 times 10(sup 14) atoms per square centimeter up to 2 times 10(sup 15) atoms per square centimeter. Optical reflectance data, acquired from as-deposited and irradiated films, in the range of 500-50000 per centimeter (0.06–6 electronvolts), was used to assess the effect of irradiation on the optical and electronic properties. Both in ZrC and ZrN films we observed that irradiation affects the optical properties of the films mostly at low frequencies, which is dominated by the free carriers response. In both materials, we found a significant reduction in the free carriers scattering rate, i.e. possible increase in mobility, at higher irradiation flux. This is consistent with our previous findings that irradiation affects the crystallite size and the micro-strain, but it does not induce major structural changes.

  20. Atomic Relaxation and Vacancy-Interstitial Recombination in Zr and Zr3Al

    DTIC Science & Technology

    1988-12-01

    tetragonal (BCT) lattice, which is entirely equivalent to an FCC structure . The crystallite faces are (1 0 0 )FCC = (010)BCT, (011) FC C = ( 0 0 1 )BCT...body centered tetragonal crystal equivalent to the FCC structure which corresponds to Zr3Al. This is evident in Figure B4, which contains the

  1. Towards a Dynamic DES model

    NASA Astrophysics Data System (ADS)

    Subbareddy, Pramod; Candler, Graham

    2009-11-01

    Hybrid RANS/LES methods are being increasingly used for turbulent flow simulations in complex geometries. Spalart's detached eddy simulation (DES) model is one of the more popular ones. We are interested in examining the behavior of the Spalart-Allmaras (S-A) Detached Eddy Simulation (DES) model in its ``LES mode.'' The role of the near-wall functions present in the equations is analyzed and an explicit analogy between the S-A and a one-equation LES model based on the sub-grid kinetic energy is presented. A dynamic version of the S-A DES model is proposed based on this connection. Validation studies and results from DES and LES applications will be presented and the effect of the proposed modification will be discussed.

  2. Nanocrystalline ZrO2 and Pt-doped ZrO2 catalysts for low-temperature CO oxidation

    PubMed Central

    Singhania, Amit

    2017-01-01

    Zirconia (ZrO2) nanoparticles were synthesized by solution combustion using urea as an organic fuel. Brunauer–Emmett–Teller (BET), X-ray diffraction (XRD), thermal gravimetric analysis (TGA), transmission electron microscopy (TEM), UV–vis and Fourier transform infrared (FTIR) measurements were performed in order to characterize the catalyst. The calculated crystallite size of ZrO2, calculated with the help of the Scherrer equation, was around 30.3 nm. The synthesized ZrO2 was scrutinized regarding its role as catalyst in the oxidation of carbon monoxide (CO). It showed 100% CO conversion at 240 °C, which is the highest conversion rate reported for ZrO2 in literature to date. It is found that through solution combustion, Pt2+ ions replace Zr4+ ions in the ZrO2 lattice and because of this, oxygen vacancies are formed due to charge imbalance and lattice distortion in ZrO2. 1% Pt was doped into ZrO2 and yielded excellent CO oxidation. The working temperature was lowered by 150 °C in comparison to pure ZrO2. Further, it is highly stable for the CO reaction (time-on-stream ≈ 40 h). This is because of a synergic effect between Pt and Zr components, which results in an increase of the oxygen mobility and oxygen vacancies and improves the activity and stability of the catalyst. The effects of gas hourly space velocity (GHSV) and initial CO concentration on the CO oxidation over Pt(1%)-ZrO2 were studied. PMID:28243565

  3. Microstructure and Phase Stability of Single Crystal NiAl Alloyed with Hf and Zr

    NASA Technical Reports Server (NTRS)

    Locci, I. E.; Dickerson, R. M.; Garg, A.; Noebe, R. D.; Whittenberger, J. D.; Nathal, M. V.; Darolia, R.

    1996-01-01

    Six near stoichiometric, NiAl single-crystal alloys, with 0.05-1.5 at.% of Hf and Zr additions plus Si impurities, were microstructurally analyzed in the as-cast, homogenized, and aged conditions. Hafnium-rich interdendritic regions, containing the Heusler phase (Ni2AlHf), were found in all the as-cast alloys containing Hf. Homogenization heat treatments partially reduced these interdendritic segregated regions. Transmission electron microscopy (TEM) observations of the as-cast and homogenized microstructures revealed the presence of a high density of fine Hf (or Zr) and Si-rich precipitates. These were identified as G-phase, Nil6X6Si7, or as an orthorhombic NiXSi phase, where X is Hf or Zr. Under these conditions the expected Heusler phase (beta') was almost completely absent. The Si responsible for the formation of the G and NiHfSi phases is the result of molten metal reacting with the Si-containing crucible used during the casting process. Varying the cooling rates after homogenization resulted in the refinement or complete suppression of the G and NiHfSi phases. In some of the alloys studied, long-term aging heat treatments resulted in the formation of Heusler precipitates, which were more stable at the aging temperature and coarsened at the expense of the G-phase. In other alloys, long-term aging resulted in the formation of the NiXSi phase. The stability of the Heusler or NiXSi phases can be traced to the reactive element (Hf or Zr) to silicon ratio. If the ratio is high, then the Heusler phase appears stable after long time aging. If the ratio is low, then the NiHfSi phase appears to be the stable phase.

  4. Plastic Deformation Modes of CuZr/Cu Multilayers

    PubMed Central

    Cui, Yan; Abad, Oscar Torrents; Wang, Fei; Huang, Ping; Lu, Tian-Jian; Xu, Ke-Wei; Wang, Jian

    2016-01-01

    We synthesized CuZr/Cu multilayers and performed nanoindentation testing to explore the dependence of plastic deformation modes on the thickness of CuZr layers. The Cu layers were 18 nm thick and the CuZr layers varied in thickness from 4 nm to 100 nm. We observed continuous plastic co-deformation in the 4 nm and 10 nm CuZr − 18 nm Cu multilayers and plastic-induced shear instability in thick CuZr layers (>20 nm). The plastic co-deformation is ascribed to the nucleation and interaction of shear transformation zones in CuZr layers at the adjacent interfaces, while the shear instability is associated with the nucleation and propagation of shear bands in CuZr layers. Shear bands are initialized in the CuZr layers due to the accumulated glide dislocations along CuZr-Cu interfaces, and propagate into adjacent Cu layers via slips on {111} plane non-parallel to the interface. Due to crystallographic constraint of the Cu layers, shear bands are approximately parallel to {111} plane in the Cu layer. PMID:26984537

  5. Supercoducting property of Zr-Cu-Al-Ni-Nb alloys

    NASA Astrophysics Data System (ADS)

    Okai, D.; Motoyama, G.; Kimura, H.; Inoue, A.

    The superconducting property of Zr55Cu(30-X)Al10Ni5NbX alloys prepared by arc melting and liquid quenching methods was investigated by magnetic susceptibility measurements. The crystalline alloys with X = 0∼25 at.% prepared by arc melting method exhibited superconductivity with maximum Tc,on of 10.1 K. The alloys (X = 10∼23 at.%) with crystalline particles embedded in an amorphous structure, which were fabricated by melt spinning method, showed superconductivity with Tc,on of less than 4.0 K. The superconducting property of the Zr-Cu-Al-Ni-Nb alloys was attributed to superconducting phases of Zr2Cu, Zr2Ni, Zr65Al10Nb25 and Zr-Nb contained in the Zr-Cu-Al-Ni-Nb alloys. The melt-spun Zr55Cu(30-X)Al10Ni5NbX (X = 10∼20 at.%) alloys exhibited glass transition at 718∼743 K and were found to be superconducting metallic glasses.

  6. Thermodynamic properties and amorphization of Zr-Si melts

    NASA Astrophysics Data System (ADS)

    Arutyunyan, N. A.; Zaitsev, A. I.; Dunaev, S. F.; Shaposhnikov, N. G.

    2016-02-01

    The relationship between the thermodynamic properties of Zr-Si liquid alloys and their propensity to amorphization is studied. The temperature-concentration dependences of the thermodynamic properties of melts are presented using the concept of associated solutions. It is shown that the range of amorphization coincides with the range of the predominant concentration of Zr3Si associative groups with low formation entropy.

  7. DENSITY-FUNCTIONAL STUDY OF THE U-ZR SYSTEM

    SciTech Connect

    Landa, A; Soderlind, P; Turchi, P

    2008-06-25

    Density-functional formalism is applied to study the phase equilibria in the U-Zr system. The obtained ground-state properties of the {gamma} (bcc) and {delta} (C32) phases are in good agreement with experimental data. The decomposition curve for the {gamma}-based U-Zr solutions is calculated. Our calculations confirm that experimentally observed 'partial' ordering of the alloy components in the {delta}-UZr{sub 2} (AlB{sub 2}) phase, in which Zr atoms occupy the 'Al' position and the two 'B' sites are randomly shared by the U and Zr atoms, is the most energetically favorable within the C32 structure. We argue that stabilization of the {delta}-UZr{sub 2} phase relative to the {alpha}-Zr (hcp) structure is due to an increase of the Zr d-band occupancy that occurs when U is alloyed with Zr. A comparison with stabilization of the {omega}-phase (also C32) in Zr under compression is made.

  8. Interdiffusion between Zr Diffusion Barrier and U-Mo Alloy

    SciTech Connect

    K. Huang; Y. Park; Y. H. Sohn

    2012-12-01

    U-Mo alloys are being developed as low enrichment uranium fuels under the Reduced Enrichment for Research and Test Reactor (RERTR) program. Significant reactions have been observed between U-Mo fuels and Al or Al alloy matrix. Refractory metal Zr has been proposed as barrier material to reduce the interactions. In order to investigate the compatibility and barrier effects between U-Mo alloy and Zr, solid-to-solid U-10wt.%Mo vs. Zr diffusion couples were assembled and annealed at 600, 700, 800, 900 and 1000 °C for various times. The microstructures and concentration profiles due to interdiffusion and reactions were examined via scanning electron microscopy and electron probe microanalysis, respectively. Intermetallic phase Mo2Zr was found at the interface and its population increased when annealing temperature decreased. Diffusion paths were also plotted on the U-Mo-Zr ternary phase diagrams with good consistency. The growth rate of interdiffusion zone between U-10wt.%Mo and Zr was also calculated under the assumption of parabolic diffusion, and was determined to be about 103 times lower than the growth rate of diffusional interaction layer found in diffusion couples U-10wt.%Mo vs. Al or Al-Si alloy. Other desirable physical properties of Zr as barrier material, such as neutron adsorption rate, melting point and thermal conductivity are presented as supplementary information to demonstrate the great potential of Zr as the diffusion barrier for U-Mo fuel systems in RERTR.

  9. Indirect band gap in alpha-ZrO2

    SciTech Connect

    Kwok, C.K.; Aita, C.R.

    1990-08-01

    Measurements of the absorption coefficient on the fundamental optical absorption edge of alpha ZrO2 show that an indirect interband transition at 4.70 eV precedes two previously reported direct transitions. This result is in agreement with recent theoretical calculations of the alpha ZrO2 band structure. (JS)

  10. Determination of the direct double-β -decay Q value of 96Zr and atomic masses of Zr 90 -92 ,94 ,96 and Mo 92 ,94 -98 ,100

    NASA Astrophysics Data System (ADS)

    Gulyuz, K.; Ariche, J.; Bollen, G.; Bustabad, S.; Eibach, M.; Izzo, C.; Novario, S. J.; Redshaw, M.; Ringle, R.; Sandler, R.; Schwarz, S.; Valverde, A. A.

    2015-05-01

    Experimental searches for neutrinoless double-β decay offer one of the best opportunities to look for physics beyond the standard model. Detecting this decay would confirm the Majorana nature of the neutrino, and a measurement of its half-life can be used to determine the absolute neutrino mass scale. Important to both tasks is an accurate knowledge of the Q value of the double-β decay. The LEBIT Penning trap mass spectrometer was used for the first direct experimental determination of the 96Zr double-β decay Q value: Qβ β=3355.85 (15 ) keV. This value is nearly 7 keV larger than the 2012 Atomic Mass Evaluation [M. Wang et al., Chin. Phys. C 36, 1603 (2012), 10.1088/1674-1137/36/12/003] value and one order of magnitude more precise. The 3-σ shift is primarily due to a more accurate measurement of the 96Zr atomic mass: m (96Zr ) =95.908 277 35 (17 ) u. Using the new Q value, the 2 ν β β -decay matrix element, | M2 ν| , is calculated. Improved determinations of the atomic masses of all other zirconium (Zr 90 -92 ,94 ,96 ) and molybdenum (92 ,94 -98 ,100Mo ) isotopes using both 12C8 and 87Rb as references are also reported.

  11. Concentration of stable elements in food products

    SciTech Connect

    Montford, M.A.; Shank, K.E.; Hendricks, C.; Oakes, T.W.

    1980-01-01

    Food samples were taken from commercial markets and analyzed for stable element content. The concentrations of most stable elements (Ag, Al, As, Au, Ba, Br, Ca, Ce, Cl, Co, Cr, Cs, Cu, Fe, Hf, I, K, La, Mg, Mn, Mo, Na, Rb, Sb, Sc, Se, Sr, Ta, Th, Ti, V, Zn, Zr) were determined using multiple-element neutron activation analysis, while the concentrations of other elements (Cd, Hg, Ni, Pb) were determined using atomic absorption. The relevance of the concentrations found are noted in relation to other literature values. An earlier study was extended to include the determination of the concentration of stable elements in home-grown products in the vicinity of the Oak Ridge National Laboratory. Comparisons between the commercial and local food-stuff values are discussed.

  12. The Zr20Nb-H phase diagram and the characterisation of hydrides in β-Zr

    NASA Astrophysics Data System (ADS)

    Barrow, L.; Barrow, A. T. W.; Almer, J.; Daymond, M. R.

    2013-11-01

    In this work a combination of synchrotron X-ray diffraction, transmission electron microscopy and differential scanning calorimetry have been used to characterise the Zr20Nb-H phase diagram and hydrides in β-Zr. A single hydride phase, termed γ' was found to be present in β-Zr over a wide range of H concentrations up to 1559 wppm. γ'-hydride had an orthorhombic crystal structure with the composition ZrH0.4 ± 0.2, and was found to be stable during heating to 450 °C; it can therefore be considered the equilibrium hydride in β-Zr. Accompanying hydride nucleation is a volumetric strain of 10.4% that is accommodated elastically and plastically by the β-Zr. The body-centre cubic to orthorhombic martensitic transformation is analogous to the Au-Cd system where the basal plane in the hydride is constructed from the (0 1 1)β to give the Bain correspondence. There are strong similarities between the Zr20Nb-H and Nb-H phase diagrams with the former having a lower solubility for H at room temperature, ˜130 wppm and ˜290 wppm respectively. The room temperature solubility difference between body-centre cubic Nb and β-Zr can be attributed to their electron configurations and the reduction in energy associated with the metallic Zr/Nb-H bonding. The hydrides were found to have a plate morphology and consisted of sub-platelets analogous to δ-hydride in α-Zr. The hydride had an orthorhombic crystal structure and the (0‖(0,[0‖[0 and [1‖[ orientation relationship with the β-Zr matrix, consistent with the Au-Cd system. gamma;'-hydride formation was accompanied by a volumetric strain of 10.4% that is accommodated elastically and plastically in the matrix. Sympathetic hydride nucleation occurs in the elastic strain field of the parent hydride. In all instances the long axis of the hydride was consistent with the <0 1 1>β. beta;-Zr has a H solubility of 128 ± 5 wppm at room temperature and considerably higher than α-Zr. The solubility difference between the BCC and

  13. Microstructural analysis of biodegradable Mg-0.9Ca-1.2Zr alloy

    NASA Astrophysics Data System (ADS)

    Istrate, B.; Munteanu, C.; Geanta, V.; Baltatu, S.; Focsaneanu, S.; Earar, K.

    2016-08-01

    Magnesium alloys have applications in aerospace and medical applications as biodegradable orthopedic implants. Alloying with biocompatible elements, such as calcium or zirconium contribute to refining the the microstructure and improves corrosion resistance with the formation of an eutectic compound - Mg2Ca at boundary alpha-Mg grains. The purpose of this paper is to present the microstructure throw optical and scanning electron methods and phase and constituents identification with X-ray analysis. The results showed the presence of alpha-Mg grains with formation of a mechanical compound - Mg2Ca and appearance of alpha- Zr phase relatively uniformly distributed in nests.

  14. A micromechanics constitutive model for pure dilatant martensitic transformation of ZrO2-containing ceramics

    NASA Astrophysics Data System (ADS)

    Qingping, Sun; Shouwen, Yu; Kehchih, Hwang

    1990-05-01

    A new micromechanics constitutive model for pure dilatant transformation plasticity of structure ceramics is proposed in this paper. Based on the thermodynamics, micromechanics and microscale t→m transformation mechanism analysis of the TZP and PSZ ZrO2-containing ceramics, an analytic expressions of the Helmholtz and complementary free energy of the constitutive element for the case of pure dilatant transformation is derived for the first time in a self-consistent manner. By the analysis of energy dissipation in the forward and reverse transformations, the micromechanics constitutive law is derived in the framework of Hill-Rice's internal variable constitutive theory.

  15. Strengthening in rapidly solidified age hardened Cu-Cr and Cu-Cr-Zr alloys

    SciTech Connect

    Correia, J.B.; Davies, H.A.; Sellars, C.M.

    1997-01-01

    Cu-Cr and Cu-Cr-Zr alloy powders were produced by water atomization and consolidated by warm extrusion. Coherent Cr precipitation is associated with the peak hardness condition in these alloys. The mechanical properties obtained after aging treatments, namely the peak hardness, and the corresponding proof stress are related to the concentration of the alloying element initially in solid solution in the powders. The strengthening observed is interpreted in terms of theories of precipitation and dispersion strengthening and compared with similar analyses reported previously in the literature for these alloy systems.

  16. Irradiation induced structural change in Mo2Zr intermetallic phase

    DOE PAGES

    Gan, J.; Keiser, Jr., D. D.; Miller, B. D.; ...

    2016-05-14

    The Mo2Zr phase has been identified as a major interaction product at the interface of U-10Mo and Zr. Transmission electron microscopy in-situ irradiation with Kr ions at 200 °C with doses up to 2.0E+16 ions/cm2 was carried out to investigate the radiation stability of the Mo2Zr. The Mo2Zr undergoes a radiation-induced structural change, from a large cubic (cF24) to a small cubic (cI2), along with an estimated 11.2% volume contraction without changing its composition. The structural change begins at irradiation dose below 1.0E+14 ions/cm2. Furthermore, the transformed Mo2Zr phase demonstrates exceptional radiation tolerance with the development of dislocations without bubblemore » formation.« less

  17. Preparation and Properties of ZrO2/Mo Alloys

    NASA Astrophysics Data System (ADS)

    Cui, Chaopeng; Gao, Yimin; Wei, Shizhong; Zhang, Guoshang; Zhu, Xiangwei; Guo, Songliang

    2017-02-01

    The nano-sized ZrO2 reinforced Mo alloys were prepared by hydrothermal synthesis and subsequent sintering. During preparation, the nano-sized ZrO2 particles were added into the Mo powder via hydrothermal synthesis. This work investigated the differences in mechanical properties and microstructures of the Mo-ZrO2 alloys prepared by hydrothermal synthesis and the other traditional method. As the amount of ZrO2 particles increased, the grain size of the Mo powders reduced obviously. The grains were refined obviously after sintering. The ZrO2 particles added by hydrothermal synthesis can effectively restrain the growth of grains and improve mechanical properties such as strength and hardness.

  18. Luna 16 - Some Li, K, Rb, Sr, Ba, rare-earth, Zr, and Hf concentrations.

    NASA Technical Reports Server (NTRS)

    Philpotts, J. A.; Schnetzler, C. C.; Schuhmann, S.; Thomas , H. H.; Bottino, M. L.

    1972-01-01

    Concentrations of Li, K, Rb, Sr, Na, rare-earths, Zr and Hf have been determined for some Luna 16 core materials by mass-spectrometric isotope-dilution. Two regolith fines samples from different depths in the core, and four rock-chips, including both igneous rocks and breccias, have similar trace-element concentrations. The Luna 16 materials have general lunar trace-element characteristics but differ from other returned lunar samples in a manner that suggests the presence of excess feldspar. Unless the Luna 16 igneous rocks are fused soils, they appear to represent either partial plagioclase cumulates or the least differentiated igneous material yet returned from the moon. The similarity in trace-element concentrations of the igneous rocks and the fines would then suggest largely local derivation of the Luna 16 regolith.

  19. Effects of chemical composition and test conditions on the dynamic tensile response of Zr-based metallic glasses

    NASA Astrophysics Data System (ADS)

    Wang, F.; Laws, K.; Martinez, D.; Trujillo, C. P.; Brown, A. D.; Cerreta, E. K.; Hazell, P. J.; Ferry, M.; Quadir, M. Z.; Jiang, J.; Escobedo, J. P.

    2017-01-01

    The effects of impact velocity and temperature on the dynamic mechanical behavior of two bulk metallic (BMG) alloys with slightly different elemental compositions (Zr55Cu30Ni5Al30 and Zr46Cu38Ag8Al38) have been investigated. Bullet-shaped samples were accelerated by a gas gun to speeds in the 400˜600m/s range and tested at both room temperature and 250°C. The samples impacted steel extrusion dies which subjected the bullets to high strains at relatively high strain-rates. The extruded fragments were subsequently soft recovered by using low density foams and examined by means of optical/scanning electron microscopy and differential scanning calorimetry. It was found that shear banding was the dictating mechanism responsible for the fracture of all BMGs. At room temperature, the Zr55Cu30Ni5Al30 alloy exhibited a higher resistance to fragmentation than the Zr46Cu38Ag8Al38 alloy. At 250°C, significant melting was observed in the recovered fragments of both alloys, which indicates that the BMG glassy structure undergoes a melting process and deformation likely occurs homogeneously.

  20. Magnetic properties of Fe80-xCoxZr7Si13 (x = 0 - 30) amorphous alloys

    NASA Astrophysics Data System (ADS)

    Kopcewicz, M.; Grabias, A.; Latuch, J.

    2011-11-01

    Amorphous Fe80-xCoxZr7Si13 (x = 0 - 30) alloys, in which boron was completely replaced by silicon as a glass forming element, have been prepared by melt quenching. Partial substitution of iron by cobalt causes the increase of the hyperfine fields from about 19 to 27 T for x = 0 and 30, respectively, as revealed by conventional Mössbauer spectroscopy. The specialized rf-Mössbauer technique permitted us to estimate the soft magnetic properties of the alloys. The rf-collapse effect, which is very sensitive to the local anisotropy field, is observed for all amorphous FeCoZrSi alloys revealing that they are magnetically very soft. The rf-sidebands intensities, which are related to the magnetostriction, increase with the increase of Co content in the alloys. In Fe60Co20Zr7Si13 and Fe50Co30Zr7Si13 samples the rf field exposure induced partial crystallization that was attributed to mechanical deformations related to high frequency magnetostrictive vibrations forced by the rf field. The magnetostrictive origin of this effect was supported by the measurements of magnetostriction constants of the studied alloys. Measurements of the hysteresis loops revealed that coercivity increases for higher Co content.

  1. The role of Zr and Nb in oxidation/sulfidation behavior of Fe-Cr-Ni alloys

    SciTech Connect

    Natesan, K. ); Baxter, D.J. INCO Alloy Ltd., Hereford, England )

    1990-11-01

    05Structural Fe-Cr-Ni alloys may undergo rapid degradation at elevated temperatures unless protective surface oxide scales are formed and maintained. The ability of alloys to resist rapid degradation strongly depends on their Cr content and the chemistry of the exposure environment. Normally, 20 wt % Cr is required for service at temperatures up to 1000{degree}C; the presence of sulfur, however, inhibits formation of a protective surface oxide scale. The oxidation and sulfidation behavior of Fe-Cr-Ni alloys is examined over a wide temperature range (650 to 1000{degree}C), with particular emphasis on the effects of alloy Cr content and the radiation of reactive elements such as Nb and Zr. Both Nb and Zr are shown to promote protective oxidation behavior on the 12 wt % Cr alloy in oxidizing environments and to suppress sulfidation in mixed oxygen/sulfur environments. Additions of Nb and Zr at 3 wt % level resulted in stabilization of Cr{sub 2}O{sub 3} scale and led to a barrier layer of Nb- or Zr-rich oxide at the scale/metal interface, which acted to minimize the transport of base metal cations across the scale. Oxide scales were preformed in sulfur-free environments and subsequently exposed to oxygen/sulfur mixed-gas atmospheres. Preformed scales were found to delay the onset of breakaway corrosion. Corrosions test results obtained under isothermal and thermal cycling conditions are presented. 58 refs., 55 figs., 8 tabs.

  2. β-type Ti-10Mo-1.25Si-xZr biomaterials for applications in hard tissue replacements.

    PubMed

    Zhan, Yongzhong; Li, Chunliu; Jiang, Wenping

    2012-08-01

    In order to develop new β-type Ti-based biochemical materials, a series of Ti-10Mo-1.25Si-xZr (x=4-13) alloys were designed and prepared using vacuum arc melting method. Phase analysis and microstructural observation showed that all the as cast samples consisted of equiaxed β-Ti phase. With the increase of Zr content, the structure of grain boundary changed from semi-continuous network to denser granular, and the microstructure was refined. The solid solution effect of the β-phase stabilization elements (i.e. Mo, Zr and Si) predominantly determined the mechanical properties. These β-type Ti-10Mo-1.25Si-xZr biomaterials exhibited a good combination of high compressive strength, high yield stress, good plasticity, as well as rather low Young's modulus (in the range of 23.086 GPa-32.623 GPa), which may offer potential advantages in the applications in hard tissue replacements (HTRs).

  3. Observation of Reliability of HfZrOX Gate Dielectric Devices with Different Zr/Hf Ratios

    NASA Astrophysics Data System (ADS)

    Liao, Jing-Chyi; Fang, Yean-Kuen; Tian Hou, Yong; Hsiung Tseng, Wei; Yang, Chih I.; Hsu, Peng Fu; Chao, Yuen Shun; Lin, Kang Cheng; Huang, Kuo Tai; Lee, Tzu Liang; Liang, Meng Sung

    2008-04-01

    The impact of the Zr/Hf ratio on the reliability of a HfZrOX gate dielectric has been investigated in detail. By a frequency-varied charge-pumping method, we found that the density of bulk traps is reduced with increasing Zr content. Also, a comparable Dit value observed by the rising/falling time-varied charge-pumping method suggests that Zr incorporation does not degrade the interface quality. Consequently, mobility increases with increasing Zr content in the HfZrOX dielectric and ˜25% mobility enhancement compared with that of HfO2 can be observed. However, the bulk trap density reduction reaches saturation at a higher Zr content. The improvement in positive-bias temperature instability (PBTI) was also demonstrated by both DC and pulse techniques. The smaller Vth shift in PBTI is attributed to the reduction of fast trapping and the generation of slow traps. Finally, a reduced gate-induced drain leakage current (GIDL) was also observed with increasing Zr content because of the reduction of trap-assisted tunneling in a high-k film.

  4. Impact of Materials Defects on Engine Structures Integrity (L’Impact des Defauts des Materiaux sur l’Integrite des Structures des Moteurs)

    DTIC Science & Technology

    1993-04-01

    participants ont fait le point des aspects traitement et contr6le des mat~riaux. en mettant I’accent sur les materiaux constitutifs des disques moteur en...adapte. Pour le physicien. un -d~faur’" peut tres bien se resumer A une imperfection de Ia structure rericulaire d’un materiau. En science des materiaux ... materiaux sur l~integrite des structures des moteurs Defence Research Ag~ency Matenials & Structures Department Farnborough. Hants GUt 14 fITD Rovaume-Uni

  5. Mechanism of ZrB2 Formation in Molten Al-V-Zr Alloy During Boron Treatment

    NASA Astrophysics Data System (ADS)

    Khaliq, Abdul; Rhamdhani, Muhammad Akbar; Brooks, Geoffrey A.; Grandfield, John

    2016-02-01

    Smelter-grade aluminum cannot be used for electrical conductor applications without the removal of transition metal impurities including zirconium (Zr) and vanadium (V). These impurities are removed by treating molten aluminum with boron bearing substances in the casthouse. Such procedures are called boron treatment. Transition metal impurities form their borides and settle at bottom of the furnace. Industrially, Al-B (AlB2/AlB12) master alloys are used for this process. Literature review showed that ZrB2 are more stable compared to VB2 and AlB2 in the temperatures ranging from 948 K to 1173 K (675 °C to 900 °C). As a result, ZrB2 will form preferentially in molten aluminum during boron treatment process. In this study, a systematic investigation on formation of the ZrB2 and VB2 borides in Al-V-Zr-B alloys was carried out at 1023 K (750 °C). Experiments showed that the mechanism of ZrB2 and VB2 borides formation in molten aluminum is complex. It involves the possible phenomenon of chemical reactions, mass transfer in liquid phase, diffusion through borides layers, and the dissolution of Al3Zr, AlB2/AlB12 in the molten aluminum. Scanning electron microscopy, Energy-dispersive X-ray, and electron backscattered diffraction analyses revealed the preferential formation of ZrB2 in the Al-Zr-V-B alloys at 1023 K (750 °C). Moreover, ICP-AES analysis showed the higher rate of Zr removal compared to V from Al-Zr-V-B alloys. Overall it was suggested that the kinetics of Zr removal was controlled by the mass transfer of Zr through liquid phase. The calculated mass transfer coefficient ( k m) for Zr was 1.15 × 10-3 m/s which is within the range of those values reported in the literature.

  6. Oxidant effect of La(NO3)3·6H2O solution on the crystalline characteristics of nanocrystalline ZrO2 films grown by atomic layer deposition

    NASA Astrophysics Data System (ADS)

    Oh, Nam Khen; Kim, Jin-Tae; Kang, Goru; An, Jong-Ki; Nam, Minwoo; Kim, So Yeon; Park, In-Sung; Yun, Ju-Young

    2017-02-01

    Nanocrystalline ZrO2 films were synthesized by atomic layer deposition method using CpZr[N(CH3)2]3 (Cp = C5H5) as the metal precursor and La(NO3)3·6H2O solution as the oxygen source. La element in the deposited ZrO2 films could not be detected as its content was below the resolution limit of the X-ray photoelectron spectroscopy. The alternative introduction of La(NO3)3·6H2O solution to conventionally used H2O as the oxidant effectively altered the crystalline structure, grain size, and surface roughness of the grown ZrO2 films. Specifically, the crystalline structure of the ZrO2 film changed from a mixture of tetragonal and monoclinic phases to monoclinic phase. The average grain size also increased, and the resulting film surface became rougher. The average grain sizes of the ZrO2 films prepared from La(NO3)3·6H2O solution at concentrations of 10, 20, 30, and 40% were 280, 256, 208, and 200 nm, respectively, whereas that prepared using H2O oxidant was 142 nm. However, the concentration of La(NO3)3·6H2O solution minimally influenced the crystalline characteristics of the nanocrystalline ZrO2 films i.e., the crystalline structure, grain size, and surface roughness except for crystallite size.

  7. Structural stability of ternary C22–Zr{sub 6}X{sub 2}Co (X=Al, Ga, Sn, As, Sb, Bi, Te) and C22–Zr{sub 6}Sn{sub 2}T′ (T′=Fe, Co, Ni, Cu) compounds

    SciTech Connect

    Colinet, Catherine; Crivello, Jean-Claude; Tedenac, Jean-Claude

    2013-09-15

    The crystal and electronic structures, and the thermodynamic properties of Zr{sub 6}X{sub 2}Co (X=Al, Ga, Sn, As, Sb, Bi, Te) and Zr{sub 6}Sn{sub 2}T′ (T′=Fe, Co, Ni, Cu) ternary compounds in the Fe{sub 2}P-type structure have been investigated by means of first principle calculations. The calculated structural parameters are in good agreement with the experimental data. The total electronic densities of states as well as the Bader charges of the atoms have been computed. Both electronic and size effects allow to explain the stability of the ternary Zr{sub 6}X{sub 2}Co (X=Al, Ga, Sn, As, Sb, Bi, Te) and Zr{sub 6}Sn{sub 2}T′ (T′=Fe, Co, Ni, Cu) compounds. - Graphical abstract: Valence charge electronic localization function (ELF) calculated for Zr{sub 6}Sb{sub 2}Co compound. Display Omitted - Highlights: • Structural stability of Zr{sub 6}X{sub 2}T′ compounds (X: p element, T′: late transition metal) in the Fe{sub 2}P-type structure. • First principles calculation of lattice parameters and enthalpies of formation. • Electronic densities of state in the series Zr{sub 6}Sn{sub 2}T′ (T′=Fe, Co, Ni, Cu). • Electronic densities of state in the series Zr{sub 6}X{sub 2}Co (X=Al, Ga, Sn, As, Sb, Bi, Te)

  8. Elemental ZOO

    NASA Astrophysics Data System (ADS)

    Helser, Terry L.

    2003-04-01

    This puzzle uses the symbols of 39 elements to spell the names of 25 animals found in zoos. Underlined spaces and the names of the elements serve as clues. To solve the puzzle, students must find the symbols that correspond to the elemental names and rearrange them into the animals' names.

  9. Mechanical and thermal behaviors of nitrogen-doped Zr-Cu-Al-Ag-Ta--An alternative class of thin film metallic glass

    NASA Astrophysics Data System (ADS)

    Chen, Pao-Sheng; Chen, Hsien-Wei; Duh, Jenq-Gong; Lee, Jyh-Wei; Shian-Ching Jang, Jason

    2012-10-01

    Super-plasticity and nano-scale surface roughness make thin film metallic glass (TFMG) a candidate for master mold of micro/nano imprint technique. Meanwhile, better mechanical properties of TFMG undoubtedly expand the life time of master mold. In this study, nitrogen is doped into Zr-based TFMG to exhibit the hardness higher than 10 GPa. Different from elements used to be doped into metallic glass, the role of nitrogen atoms plays in metallic glass is distinct and vital owing to its strong electronegativity. From the correlation of thermal and mechanical behavior, the role and effect of nitrogen in Ta-Zr-Cu-Al-Ag TFMG is discussed and proposed.

  10. Modélisation des boucles d'immunisation magnétique des navires

    NASA Astrophysics Data System (ADS)

    Le Dorze, F.; Bongiraud, J. P.; Coulomb, J. L.; Meunier, G.; Brunotte, X.

    1998-02-01

    This paper presents the problem of the three-dimensional modeling of degaussing coils in ships with a finite elements method. We show that these current coils are so close to the ferromagnetic sheets of the ship that they require a local very fine mesh which would be unrealistic for the whole complex structure of a real ship. We propose an alternative to the expensive mesh refinement called "reduced scalar potential jump”. The idea is to previously solve the local problem by another method and to use the result in the whole FEM modelling. We present the method of implementation in the FEM software FLUX3D and comparative results on a simple geometry. Cet article présente le problème de la modélisation en trois dimensions des boucles d'immunisation des navires par la méthode des éléments finis. Nous montrons que ces boucles de courant sont si proches des tôles ferromagnétiques du navire que leur modélisation requiert un maillage localement très fin, ce qui est irréaliste pour la structure complexe d'un navire réel. Nous proposons une alternative à ce coûteux affinage du maillage, appelée "saut de potentiel réduit”. L'idée est de résoudre au préalable le problème local par une autre méthode que les éléments finis et d'utiliser le résultat dans la modélisation globale. Nous présentons la méthode utilisée pour l'implantation de cette technique dans le logiciel d'éléments finis FLUX3D, et des résultats comparatifs sur une géométrie simple.

  11. Special Orientation Relationships of CuZr2 in the Annealed Zr64.5Cu35.5 Metallic Glass

    NASA Astrophysics Data System (ADS)

    Yu, Pengfei; Zhang, Lijun; Cheng, Hu; Zhang, Huan; Jing, Qin; Ma, Mingzhen; Liaw, Peter K.; Li, Gong; Liu, Riping

    2015-05-01

    The amorphous Zr64.5Cu35.5 alloy ribbon was prepared and annealed in a high vacuum furnace at 645 K (372 °C) for different times. It was found that the main crystallization phases in the alloy ribbon are CuZr2 and CuZr3. The grains of CuZr2 show special orientation relationships. The grains in opposite dendrites show the same orientation, and adjacent dendrites behave as a twinlike orientation with a (103) twin plane. The CuZr3 with a superstructure is discovered in annealed ZrCu metallic glasses.

  12. Peste des petits ruminants

    PubMed Central

    Parida, S.; Muniraju, M.; Mahapatra, M.; Muthuchelvan, D.; Buczkowski, H.; Banyard, A.C.

    2015-01-01

    Peste des petits ruminants virus causes a highly infectious disease of small ruminants that is endemic across Africa, the Middle East and large regions of Asia. The virus is considered to be a major obstacle to the development of sustainable agriculture across the developing world and has recently been targeted by the World Organisation for Animal Health (OIE) and the Food and Agriculture Organisation (FAO) for eradication with the aim of global elimination of the disease by 2030. Fundamentally, the vaccines required to successfully achieve this goal are currently available, but the availability of novel vaccine preparations to also fulfill the requisite for differentiation between infected and vaccinated animals (DIVA) may reduce the time taken and the financial costs of serological surveillance in the later stages of any eradication campaign. Here, we overview what is currently known about the virus, with reference to its origin, updated global circulation, molecular evolution, diagnostic tools and vaccines currently available to combat the disease. Further, we comment on recent developments in our knowledge of various recombinant vaccines and on the potential for the development of novel multivalent vaccines for small ruminants. PMID:26443889

  13. Peste des petits ruminants.

    PubMed

    Parida, S; Muniraju, M; Mahapatra, M; Muthuchelvan, D; Buczkowski, H; Banyard, A C

    2015-12-14

    Peste des petits ruminants virus causes a highly infectious disease of small ruminants that is endemic across Africa, the Middle East and large regions of Asia. The virus is considered to be a major obstacle to the development of sustainable agriculture across the developing world and has recently been targeted by the World Organisation for Animal Health (OIE) and the Food and Agriculture Organisation (FAO) for eradication with the aim of global elimination of the disease by 2030. Fundamentally, the vaccines required to successfully achieve this goal are currently available, but the availability of novel vaccine preparations to also fulfill the requisite for differentiation between infected and vaccinated animals (DIVA) may reduce the time taken and the financial costs of serological surveillance in the later stages of any eradication campaign. Here, we overview what is currently known about the virus, with reference to its origin, updated global circulation, molecular evolution, diagnostic tools and vaccines currently available to combat the disease. Further, we comment on recent developments in our knowledge of various recombinant vaccines and on the potential for the development of novel multivalent vaccines for small ruminants.

  14. First-principles quantum molecular dynamics study of TixZr1−xN(111)/SiNy heterostructures and comparison with experimental results

    PubMed Central

    Ivashchenko, Volodymyr; Veprek, Stan; Pogrebnjak, Alexander; Postolnyi, Bogdan

    2014-01-01

    The heterostructures of five monolayers B1–TixZr1−xN(111), x = 1.0, 0.6, 0.4 and 0.0 (where B1 is a NaCl-type structure) with one monolayer of a Si3N4-like Si2N3 interfacial layer were investigated by means of first-principles quantum molecular dynamics and a structure optimization procedure using the Quantum ESPRESSO code. Slabs consisting of stoichiometric TiN and ZrN and random, as well as segregated, B1–TixZr1−xN(111) solutions were considered. The calculations of the B1–TixZr1−xN solid solutions, as well as of the heterostructures, showed that the pseudo-binary TiN–ZrN system exhibits a miscibility gap. The segregated heterostructures in which Zr atoms surround the SiyNz interface were found to be the most stable. For the Zr-rich heterostructures, the total energy of the random solid solution was lower compared to that of the segregated one, whereas for the Ti-rich heterostructures the opposite tendency was observed. Hard and super hard Zr–Ti–Si–N coatings with thicknesses from 2.8 to 3.5 μm were obtained using a vacuum arc source with high frequency stimulation. The samples were annealed in a vacuum and in air at 1200 °C. Experimental investigations of Zr–Ti–N, Zr–Ti–Si–N and Ti–Si–N coatings with different Zr, Ti and Si concentrations were carried out for comparison with results obtained from TixZr1−xN(111)/SiNy systems. During annealing, the hardness of the best series samples was increased from (39.6 ± 1.4) to 53.6 GPa, which seemed to indicate that a spinodal segregation along grain interfaces was finished. A maximum hardness of 40.8 GPa before and 55 GPa after annealing in air at 500 °C was observed for coatings with a concentration of elements of Si≽ (7–8) at.%, Ti ≽ 22 at.% and Zr ⩽ 70 at.%. PMID:27877668

  15. Anion Exchange Behavior Of Ti, Zr, Hf, Nb And Ta As Homologues Of Rf And Db In Mixed HF--Acetone Solutions

    SciTech Connect

    Aksenov, N. V.; Bozhikov, G. A.; Starodub, G. Ya.; Dmitriev, S. N.; Filosofov, D. V.; Sun Jin, Jon; Radchenko, V. I.; Lebedev, N. A.; Novgorodov, A. F.

    2010-04-30

    We studied in detail the sorption behavior of Ti, Zr, Hf, Nb and Ta on AG 1 anion exchange resin in HF-acetone mixed solutions as a function of organic cosolvent and acid concentrations. Anion exchange behavior was found to be strongly acetone concentration dependent. The distribution coefficients of Ti, Zr, Hf and Nb increased and those of Ta decreased with increasing content of acetone in HF solutions. With increasing HF concentration anion exchange equilibrium analysis indicated the formation of fluoride complexes of group 4 elements with charge-3 and Ta---2. For Nb the slope of-2 increased up to-5. Optimal conditions for separation of the elements using AIX chromatography were found. Group 4 elements formed MF{sub 7}{sup 3-} (M = Ti, Zr, Hf) complexes whose sorption decreased Ti>Hf>Zr in reverse order of complex stability. This fact is of particular interest for studying ion exchange behavior of Rf compared to Ti. The advantages of studying chemical properties of Rf and Db in aqueous HF solutions mixed with organic solvents are briefly discussed.

  16. Synthesis, crystal structure, and properties of the rhombohedral modification of the thiospinel CuZr{sub 1.86(1)}S{sub 4}

    SciTech Connect

    Dong, Yongkwan; McGuire, Michael A.; Yun, Hoseop; DiSalvo, Francis J.

    2010-03-15

    The rhombohedral modification of the thiospinel, CuZr{sub 1.86(1)}S{sub 4}, has been synthesized by the reaction of the constituent elements in an alkali metal halide flux and structurally characterized by single crystal X-ray diffraction techniques. The title compound crystallizes in the rhombohedral space group D{sub 3d}{sup 5}-R3-barm (no. 166, a=7.3552(2) A, c=35.832(2) A, V=1678.76(13) A{sup 3}, Z=12, and R/wR=0.0239/0.0624). The structure is composed of close packed S layers, with a stacking order of ...ABCBCABABCACAB....along the c axis. The Zr and Cu atoms occupy the octahedral and tetrahedral holes between S layers, respectively. Three different kinds of S-M-S layers exist in the structure: layer I has fully occupied Zr and Cu sites, layer II has fully occupied Zr sites but no Cu, and layer III has partially occupied Zr and fully occupied Cu sites. Transport and optical properties indicate that the title compound is a small band gap (1.26 eV) n-type semiconductor. - Graphical abstract: The projected view of the rhombohedral modification, CuZr{sub 1.86(1)}S{sub 4}, down the [100] direction. Large letters denote the packing sequence of the S atoms (yellow circles) along the c axis. Zr (black circles) and Cu (red circles) atoms occupy the octahedral and tetrahedral holes, respectively, between close packed S layers.

  17. Producing a compound Nucleus via Inelastic Scattering: The 90Zr(alpha,alpha')90Zr* Case

    SciTech Connect

    Escher, J E; Dietrich, F S

    2008-05-23

    In a Surrogate reaction a compound nucleus is produced via a direct reaction (pickup, stripping, or inelastic scattering). For a proper application of the Surrogate approach it is necessary to predict the resulting angular momentum and parity distribution in the compound nucleus. A model for determining these distributions is developed for the case of inelastic alpha scattering off a spherical nucleus. The focus is on obtaining a first, simple description of the direct-reaction process that produces the compound nucleus and on providing the basis for a more complete treatment of the problem. The approximations employed in the present description are discussed and the extensions required for a more rigorous treatment of the problem are outlined. To illustrate the formalism, an application to {sup 90}Zr({alpha},{alpha}{prime}){sup 90}Zr* is presented.

  18. A comparison of the performance of Zr, Zr + O and N implanted stainless steels

    SciTech Connect

    Oztarhan, A.; Brown, I.G.; Monteiro, O.; Vizir, A.; Alanyalyoglu, T.A.

    1998-12-31

    The authors have carried out some exploratory investigations of the efficacy of Zr ion implantation and Zr+O co-implantation for enhancement of the tribology and corrosion characteristics of 316-L stainless steel. A broad-beam vacuum arc based ion implanter was used for the metal and metal+gas implantations. Implantation dose was in the range (10{sup 16}--10{sup 17}) cm{sup {minus}2}, and the ion energy was typically about 100 keV. The highly polished stainless steel substrates were tested for their wear and friction behavior with a pin-on-disk apparatus, for their hardness with an ultra micro hardness tester, and their corrosion performance were determined by potentiodynamic polarization measurements. Wear and friction behavior of the implanted samples against UHMWPE disk samples were also examined.

  19. Characterization of oxidation products on a ZrFe{sub 2}-type laves intermetallic exposed to 200{degree}C steam.

    SciTech Connect

    Abraham, D. P.; Dietz, N.; Finnegan, N.

    2000-11-20

    The release of radioactive elements from the stainless steel-15 wt% zirconium (SS-15Zr) metal waste form will be governed by the corrosion behavior of ZrFe{sub 2}-type intermetallics phases present in the alloy. In this article, oxidation products that formed on a ZrFe{sub 2}-type intermetallic sample exposed to 200 C steam were characterized by Auger Electron Spectroscopy (AES) and Transmission Electron Microscopy (TEM). The data revealed two oxide layers on the sample surface: an outer crystalline iron-oxide layer and an inner amorphous zirconium-rich layer believed to be zirconium oxide. Thermodynamic considerations indicate that the zirconium-rich layer formed first. The iron-oxide layer appears to have resulted from the diffusion of iron through the zirconium-rich layer to the oxide-vapor interface.

  20. Corrosion resistance and in vitro response of a novel Ti35Nb2Ta3Zr alloy with a low Young's modulus.

    PubMed

    Guo, Yongyuan; Chen, Desheng; Lu, Weijie; Jia, Yuhua; Wang, Liqiang; Zhang, Xianlong

    2013-10-01

    β type titanium alloys have attracted much attention in the biomedical field because they consist of non-cytotoxic elements, show high corrosion resistance, and are biologically compatible. In this study, a novel β type titanium alloy (Ti35Nb3Zr2Ta) with a Young's modulus of 48 GPa was fabricated and the alloy's corrosion resistance and in vitro response were determined. The results indicate that the novel alloy exhibits comparable corrosion resistance when compared with Ti6Al4V, but in vitro experiments show that osteoblasts attach, spread, proliferate, and differentiate better on Ti35Nb2Ta3Zr than on Ti6Al4V. The high corrosion resistance and satisfactory biocompatibility make the novel Ti35Nb3Zr2Ta alloy a promising biomaterial for surgical implants.

  1. Characterization of the Ti-10Nb-10Zr-5Ta Alloy for Biomedical Applications. Part 1: Microstructure, Mechanical Properties, and Corrosion Resistance

    NASA Astrophysics Data System (ADS)

    Vladescu, A.; Braic, V.; Balaceanu, M.; Braic, M.; Parau, A. C.; Ivanescu, S.; Fanara, C.

    2013-08-01

    Ti-10Nb-10Zr-5Ta alloy was investigated as possible material candidate for replacing Ti6Al4V in medical applications. The alloy was prepared in a levitation melting furnace and characterized in terms of elemental and phase composition, microstructure, mechanical properties, and corrosion resistance in simulated body fluid and Fusayama Meyer artificial saliva solutions. The characteristics of the new alloy were compared to those of the Ti6Al4V alloy. The Ti-10Nb-10Zr-5Ta system was found to posses of a polyhedral structure consisting in α' and β phases. X-ray structural analysis revealed a mixture of hexagonal α' martensite (main phase, with grain size of about 21 nm) and β bcc phase. The Ti-10Nb-10Zr-5Ta alloy exhibited some better mechanical properties (Young modulus, tensile properties) and corrosion resistance (polarization resistance, corrosion current density, and corrosion rate), as compared to Ti6Al4V alloy.

  2. A surrogate reaction technique benchmark: ^92Zr(α,α') surrogate for n+^91Zr

    NASA Astrophysics Data System (ADS)

    Church, J. A.; Ahle, L.; Bernstein, L. A.; Dietrich, F.; Escher, J.; Forssen, C.; Ai, H.; Amro, H. A.; Beausang, C.; Caggiano, J. A.; Casten, R. F.; Heinz, A.; McCutchan, E.; Meyer, D.; Plettner, C.; Ressler, J. J.; Zamfir, N. V.

    2004-10-01

    Neutron-induced reaction cross sections are sometimes difficult to measure due to target or beam limitations. For two-step reactions which proceed through a compound nucleus, an alternate, "surrogate reaction" technique (J.D. Cramer and H.C. Britt, Nucl. Sci. Eng., 41), 177 (1970). is applicable, and is undergoing investigation at LLNL. Measured decay probabilities for a compound nucleus formed in a light-ion reaction are combined with optical-model calculations for the formation of the same compound nucleus via the n-induced reaction. The result is an estimation for overall (n, γ/n/2n) cross sections. As a benchmark, the reaction ^92Zr(α,α'), surrogate for n+^91Zr, was studied at Yale (WNSL). Particles were detected in the silicon telescope STARS and γ-rays were measured with YRAST-ball Ge clover detectors. The measurement, benchmarking issues, and existing ^91Zr(n,γ) data (CSISRS) will be discussed. Work performed under the auspices of the U.S. DOE by the Univ. of CA, LLNL contract No. W-7405-Eng-4, and DOE grants DE-FG02-91ER-40609 and DE-FG03-03NA00081.

  3. Field emission properties of ultrasmall Zr spots on W

    SciTech Connect

    Fursey, G.N.; Glazanov, D.V.

    1995-05-01

    The aims of the investigation were to obtain small and supersmall Zr/ZrO spots on W surface, estimating the limit emission capabilities of such systems, and to analyze their physical mechanisms, which determine their stability. Ultrasmall Zr spots with radii of {approximately} 100 {Angstrom} were obtained. For such spots field emission current densities of {approximately} 10{sup 9} A/cm{sup 2} were achieved in stationary regime. The numerical simulation of the emitter heating in the three-dimensional axial-symmetrical model showed good qualitative agreement with the experimental results for both localized and nonlocalized emission. 25 refs., 6 figs.

  4. Al-Ti-Zr master alloys: Structure formation

    NASA Astrophysics Data System (ADS)

    Popova, E. A.; Shubin, A. B.; Kotenkov, P. V.; Pastukhov, E. A.; Bodrova, L. E.; Fedorova, O. M.

    2012-05-01

    The effects of the composition of ternary Al-Ti-Zr master alloys, the overheating of their melts with respect to liquidus, and exposure to low-frequency vibrations on the structure formation in them are studied. It is shown that complex aluminide Al3(Zr x Ti1 - x ) with a metastable L12-type cubic lattice coinciding with the structure type of α Al primarily precipitates during the crystallization of Al-Ti-Zr melts under certain conditions. This fact makes such master alloys promising for modifying aluminum alloys.

  5. Discovery of ferromagnetism with large magnetic anisotropy in ZrMnP and HfMnP

    SciTech Connect

    Lamichhane, Tej N.; Taufour, Valentin; Masters, Morgan W.; Parker, David S.; Kaluarachchi, Udhara S.; Thimmaiah, Srinivasa; Bud'ko, Sergey L.; Canfield, Paul C.

    2016-08-29

    Here, ZrMnP and HfMnP single crystals are grown by a self-flux growth technique, and structural as well as temperature dependent magnetic and transport properties are studied. Both compounds have an orthorhombic crystal structure. ZrMnP and HfMnP are ferromagnetic with Curie temperatures around 370 K and 320 K, respectively. The spontaneous magnetizations of ZrMnP and HfMnP are determined to be 1.9 μB/f.u. and 2.1 μB/f.u., respectively, at 50 K. The magnetocaloric effect of ZrMnP in terms of entropy change (ΔS) is estimated to be –6.7 kJ m–3 K–1 around 369 K. The easy axis of magnetization is [100] for both compounds, with a small anisotropy relative to the [010] axis. At 50 K, the anisotropy field along the [001] axis is ~4.6 T for ZrMnP and ~10 T for HfMnP. Such large magnetic anisotropy is remarkable considering the absence of rare-earth elements in these compounds. The first principle calculation correctly predicts the magnetization and hard axis orientation for both compounds, and predicts the experimental HfMnP anisotropy field within 25%. More importantly, our calculations suggest that the large magnetic anisotropy comes primarily from the Mn atoms, suggesting that similarly large anisotropies may be found in other 3d transition metal compounds.

  6. Discovery of ferromagnetism with large magnetic anisotropy in ZrMnP and HfMnP

    DOE PAGES

    Lamichhane, Tej N.; Taufour, Valentin; Masters, Morgan W.; ...

    2016-08-29

    Here, ZrMnP and HfMnP single crystals are grown by a self-flux growth technique, and structural as well as temperature dependent magnetic and transport properties are studied. Both compounds have an orthorhombic crystal structure. ZrMnP and HfMnP are ferromagnetic with Curie temperatures around 370 K and 320 K, respectively. The spontaneous magnetizations of ZrMnP and HfMnP are determined to be 1.9 μB/f.u. and 2.1 μB/f.u., respectively, at 50 K. The magnetocaloric effect of ZrMnP in terms of entropy change (ΔS) is estimated to be –6.7 kJ m–3 K–1 around 369 K. The easy axis of magnetization is [100] for both compounds,more » with a small anisotropy relative to the [010] axis. At 50 K, the anisotropy field along the [001] axis is ~4.6 T for ZrMnP and ~10 T for HfMnP. Such large magnetic anisotropy is remarkable considering the absence of rare-earth elements in these compounds. The first principle calculation correctly predicts the magnetization and hard axis orientation for both compounds, and predicts the experimental HfMnP anisotropy field within 25%. More importantly, our calculations suggest that the large magnetic anisotropy comes primarily from the Mn atoms, suggesting that similarly large anisotropies may be found in other 3d transition metal compounds.« less

  7. A multi-scale model for texture development in Zr/Nb nanolayered composites processed by accumulative roll bonding

    NASA Astrophysics Data System (ADS)

    Ardeljan, M.; Knezevic, M.; Nizolek, T.; Beyerlein, I. J.; Zheng, S. J.; Carpenter, J. S.; McCabe, R. J.; Mara, N. A.; Pollock, T. M.

    2014-08-01

    Recently it has been demonstrated that nanolayered hcp/bcc Zr/Nb composites can be fabricated with a severe plastic deformation technique called accumulative roll bonding (ARB) [1]. The final layer thickness averaged to approximately 90 nm for both phases. Interestingly, the texture measurements show that the textures in each phase correspond to those of rolled single-phase rolled Zr and Nb for a wide range of layer thickness from the micron to the nanoscales. This is in remarkable contrast to fcc/bcc Cu/Nb layered composites made by the same ARB technique, which developed textures that strongly deviated from theoretical rolling textures of Cu or Nb alone when the layers were refined to submicron and nanoscale dimensions. To model texture evolution and reveal the underlying deformation mechanisms, we developed a 3D multiscale model that combines crystal plasticity finite element with a thermally activated dislocation density based hardening law [2]. For systematic study, the model is applied to a two-phase Zr/Nb polycrystalline laminate and to the same polycrystalline Zr and polycrystalline Nb as single-phase metals. Consistent with the measurement, the model predicts that texture evolution in the phases in the composite and the relative activities of the hcp slip modes are very similar to those in the phases in monolithic form. In addition, the two-phase model also finds that no through-thickness texture gradient develops. This result suggests that neither the nanoscale grain sizes nor the bimetal Zr/Nb interfaces induce deformation mechanisms different from those at the coarse-grain scale.

  8. Synthesis, Crystal Structure, and Properties of the Rhomboheral Modification of the Thiospinel CuZr1.86(1)S4

    SciTech Connect

    Dong, Yongkwan; McGuire, Michael A; Hoseop, Yun; DiSalvo, Francis J.

    2009-01-01

    The rhombohedral modification of the thiospinel, CuZr{sub 1.86(1)}S{sub 4}, has been synthesized by the reaction of the constituent elements in an alkali metal halide flux and structurally characterized by single crystal X-ray diffraction techniques. The title compound crystallizes in the rhombohedral space group D{sub 3d}{sup 5}-R{bar 3}m (166, a=7.3552(2) {angstrom}, c=35.832(2) {angstrom}, V=1678.76(13) {angstrom}{sup 3}, Z=12, and R/wR=0.0239/0.0624). The structure is composed of close packed S layers, with a stacking order of ABCBCABABCACAB along the c axis. The Zr and Cu atoms occupy the octahedral and tetrahedral holes between S layers, respectively. Three different kinds of S-M-S layers exist in the structure: layer I has fully occupied Zr and Cu sites, layer II has fully occupied Zr sites but no Cu, and layer III has partially occupied Zr and fully occupied Cu sites. Transport and optical properties indicate that the title compound is a small band gap (1.26 eV) n-type semiconductor.

  9. Preparation and characterization of Zr-N-codoped TiO2 nano-photocatalyst and its activity enhanced-mechanism.

    PubMed

    Du, Fengwei; Yu, Shuyu

    2014-09-01

    Zr-N-codoped TiO2 nano-photocatalyst was prepared through sol-gel method using ammonia water and zirconium nitrate as the source of N and Zr, respectively. The resulting materials were characterized by X-ray diffraction (XRD), transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS) and ultraviolet-visible diffuse reflectance spectroscopy (UV-vis DRS). XRD results showed that codoping with Zr and N elements could greatly inhibit the phase transformation of TiO2 from anatase to rutile. XPS analysis indicated that Zr4+ was incorporated into the lattice of TiO2 through substituting titanium atoms. Meanwhile, N was also incorporated into the lattice of TiO2 through substituting oxygen atoms and existed in the form of N-Ti-O. DRS revealed that the light absorption edge of Zr-N-TiO2 was significantly red-shifted to visible region, leading to a narrower band gap and higher visible photocatalytic activity. The enhanced visible activity was attributed to the well anatase crystallite, intense light absorbance in visible region and narrow band gap.

  10. Towards atomistic understanding of polymorphism in the solvothermal synthesis of ZrO2 nanoparticles.

    PubMed

    Dippel, Ann Christin; Jensen, Kirsten M Ø; Tyrsted, Christoffer; Bremholm, Martin; Bøjesen, Espen D; Saha, Dipankar; Birgisson, Steinar; Christensen, Mogens; Billinge, Simon J L; Iversen, Bo B

    2016-11-01

    Varying atomic short-range order is correlated with the ratio of the monoclinic (m) to tetragonal (t) phase in ZrO2 nanoparticle formation by solvothermal methods. Reactions from Zr oxynitrate in supercritical methanol and Zr acetate in water (hydrothermal route) were studied in situ by X-ray total scattering. Irrespective of the Zr source and solvent, the structure of the precursor in solution consists of edge-shared tetramer chains. Upon heating, the nearest-neighbor Zr-O and Zr-Zr distances shorten initially while the medium-range connectivity is broken. Depending on the reaction conditions, the disordered intermediate transforms either rapidly into m-ZrO2, or more gradually into mixed m- and t-ZrO2 with a concurrent increase of the shortest Zr-Zr distance. In the hydrothermal case, the structural similarity of the amorphous intermediate and m-ZrO2 favors the formation of almost phase-pure m-ZrO2 nanoparticles with a size of 5 nm, considerably smaller than the often-cited critical size below which the tetragonal is assumed to be favoured. Pair distribution function analysis thus unravels ZrO2 phase formation on the atomic scale and in this way provides a major step towards understanding polymorphism of ZrO2 beyond empirical approaches.

  11. Apatite layer growth on glassy Zr48Cu36Al8Ag8 sputtered titanium for potential biomedical applications

    NASA Astrophysics Data System (ADS)

    Thanka Rajan, S.; Karthika, M.; Bendavid, Avi; Subramanian, B.

    2016-04-01

    The bioactivity of magnetron sputtered thin film metallic glasses (TFMGs) of Zr48Cu36Al8Ag8 (at.%) on titanium substrates was tested for bio implant applications. The structural and elemental compositions of TFMGs were analyzed by XRD, XPS and EDAX. X-ray diffraction analysis displayed a broad hump around the incident angle of 30-50°, suggesting that the coatings possess a glassy structure. An in situ crystal growth of hydroxyapatite was observed by soaking the sputtered specimen in simulated body fluid (SBF). The nucleation and growth of a calcium phosphate (Ca-P) bone-like hydroxyapatite on Zr48Cu36Al8Ag8 (at.%) TFMG from SBF was investigated by using XRD, AFM and SEM. The presence of calcium and phosphorus elements was confirmed by EDAX and XPS. In vitro electrochemical corrosion studies indicated that the Zr-based TFMG coating sustain in the stimulated body-fluid (SBF), exhibiting superior corrosion resistance with a lower corrosion penetration rate and electrochemical stability than the bare crystalline titanium substrate.

  12. The ab initio calculations of the doping Zr's influence on the electronic structure of AlCo2Ti

    NASA Astrophysics Data System (ADS)

    Fu, Hongzhi; Peng, Feng; Cheng, Dong; Gao, Tao; Cheng, Xinlu; Yang, Xiangdong

    2007-08-01

    The electronic structures of the ternary (Hume Rothery) L21-phase compound AlCo2Ti are calculated by first-principles using full potential linearized augmented plane wave (FLAPW) method with the generalized gradient approximation (GGA). The ab initio results are analyzed with a simplified model for Al-based compounds containing transition metal (TM) atoms. The results show that the total DOS depends strongly on the positions of TM atoms, and the TM d DOS plays a crucial role in hybridization with other element valence electrons. However, the Al 3s states are repelled far away from the Fermi energy in studied sample, and the Al 3d states are far more extended-like in the character than the d states. Furthermore, the total DOSs are modulated by Al 3p states and the Al 3p states are more sensitive than d states to change in the electronic interactions. Then, the Al 3p is also important for the ternary stability of the intermetallic compound. The Co Ti interaction becomes stronger by the doping element Zr in the Al4Co8Ti3Zr structure. Especially, the doping Al4Co8Ti3Zr alloy has a larger value DOS at the Fermi level and makes the total DOS gap smaller than the AlCo2Ti.

  13. First principles investigations of structural, elastic, dielectric and piezoelectric properties of { Ba,Sr,Pb } TiO3, { Ba,Sr,Pb } ZrO3 and { Ba,Sr,Pb } { Zr,Ti } O3 ceramics

    NASA Astrophysics Data System (ADS)

    Akgenc, Berna; Tasseven, Cetin; Cagin, Tahir

    2015-03-01

    We use first-principle density-functional study of structural, anisotropic mechanical, dielectric and piezoelectric properties of {Ba,Sr,Pb}TiO3, {Ba,Sr,Pb}ZrO3 and {Ba,Sr,Pb}{Zr,Ti}O3 alloys in cubic perovskite structures at zero temperature. Because there is significant interest in finding new piezoelectrics that do not contain toxic elements such as lead. In this study, we compare piezoelectric response of those alloys to synthesize outstanding piezoelectric materials. In perovskite structures, the spontaneous polarization is due to enormous values of Born effective charges computed by linear response within density functional perturbation theory, which are much larger than predicted nominal charge. We deeply investigated the effects of composition, order and site defects structure on piezoelectric constants.

  14. Classification of 8 DES Supernova with OzDES

    NASA Astrophysics Data System (ADS)

    King, A.; Moller, A.; Sommer, N. E.; Tucker, B. E.; Childress, M. J.; Lewis, G. F.; Lidman, C.; OâNeill, C.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; Gladney, L.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; D'Andrea, C.; Prajs, S.; Smith, M.; Sullivan, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.

    2016-09-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  15. Classification of 17 DES Supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Hoormann, J. K.; Asorey, J.; Carollo, D.; Moller, A.; Sharp, R.; Sommer, N. E.; Tucker, B. E.; Zhang, B.; Lidman, C.; Brout, D. J.; D'Andrea, C.; Gladney, L.; March, M.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Macaulay, E.; Nichol, R.; Childress, M.; Prajs, S.; Smith, M.; Sullivan, M.; Maartens, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Gupta, R.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Papadopoulos, A.; Morganson, E.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Yuan, F.; Davis, T. M.; Hinton, S.; Muthukrishna, D.; Parkinson, D.; Lewis, G. F.; Uddin, S.; Kessler, R.; Lasker, J.; Scolnic, D.

    2016-12-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  16. Classification of 13 DES supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Sommer, N.; Tucker, B. E.; Moller, A.; Zhang, B.; Macualay, E.; Lidman, C.; Gshwend, J.; Martini, P.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; Gladney, L.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; Childress, M.; D'Andrea, C.; Prajs, S.; Smith, M.; Sullivan, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.

    2016-09-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  17. Classification of 11 DES supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Sharp, R.; Zhang, B.; Sommer, N. E.; Tucker, B. E.; Lidman, C.; Davis, T. M.; Asorey, J.; Mould, J.; Smith, M.; Macaulay, E.; Nichol, R.; Childress, M.; Prajs, S.; Sullivan, M.; Maartens, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Gupta, R.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Papadopoulos, A.; Morganson, E.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Carollo, D.; Moller, A.; Yuan, F.; Hinton, S.; Muthukrishna, D.; Parkinson, D.; Lewis, G. F.; Uddin, S.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; D'Andrea, C.; Gladney, L.; March, M.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.

    2017-01-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  18. Classification of 2 DES supernova with OzDES

    NASA Astrophysics Data System (ADS)

    O'Neill, C. R.; Moller, A.; Sommer, N. E.; Tucker, B. E.; Childress, M. J.; Lewis, G. F.; Lidman, C.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; D'Andrea, C.; Gladney, L.; March, M.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Macaulay, E.; Nichol, R.; Prajs, S.; Smith, M.; Sullivan, M.; Maartens, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Gupta, R.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Papadopoulos, A.; Morganson, E.

    2016-10-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  19. Classification of 3 DES Supernovae with OzDES

    NASA Astrophysics Data System (ADS)

    Moller, A.; Tucker, B. E.; Yuan, F.; Lewis, G.; Lidman, C.; Macaulay, E.; Nichol, R.; Papadopoulos, A.; Childress, M.; D'Andrea, C.; Smith, M.; Sullivan, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; Gladney, L.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.

    2016-02-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  20. Classification of 20 DES Supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Davis, T. M.; Kim, A. G.; Macualay, E.; Lidman, C.; Sharp, R.; Tucker, B. E.; Yuan, F.; Zhang, B.; Lewis, G. F.; Sommer, N. E.; Martini, P.; Mould, J.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; Gladney, L.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; Childress, M.; D'Andrea, C.; Smith, M.; Sullivan, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.

    2015-12-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  1. Classification of 14 DES Supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Tucker, B. E.; Sharp, R.; Yuan, F.; Zhang, B.; Lidman, C.; Davis, T. M.; Hinton, S.; Mould, J.; Smith, R. C.; Schubnell, M.; Kessler, R.; Scolnic, D.; Covarrubias, R. A.; Brout, D. J.; Fischer, J. A.; Gladney, L.; March, M.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; D'Andrea, C.; Smith, M.; Sullivan, M.; Childress, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Castander, F. J.; Desai, S.; Paech, K.

    2015-10-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey. The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  2. Classification of 4 DES supernovae by OzDES

    NASA Astrophysics Data System (ADS)

    Glazebrook, K.; Amon, A.; Lidman, C.; Martini, P.; Tucker, B. E.; Yuan, F.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; Gladney, L.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; Childress, M.; D'Andrea, C.; Smith, M.; Sullivan, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.

    2015-12-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  3. Classification of 6 DES Supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Lewis, G. F.; Mould, J.; Lidman, C.; Tucker, B. E.; Sharp, R.; Yuan, F.; Martini, P.; Kessler, R.; Scolnic, D.; Covarrubias, R. A.; Brout, D. J.; Fischer, J. A.; Gladney, L.; March, M.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; D'Andrea, C.; Smith, M.; Sullivan, M.; Childress, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.

    2015-10-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  4. Classification of 15 DES supernovae by OzDES

    NASA Astrophysics Data System (ADS)

    Yuan, F.; Tucker, B. E.; Lidman, C.; Martini, P.; Gshwend, Julia; Moller, A.; Zhang, B.; Smith, R. C.; Schubnell, M.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; Gladney, L.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Nichol, R.; Papadopoulos, A.; Childress, M.; D'Andrea, C.; Smith, M.; Sullivan, M.; Maartens, R.; Gupta, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Desai, S.; Paech, K.

    2015-12-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  5. Classification of 17 DES supernova with OzDES

    NASA Astrophysics Data System (ADS)

    Mudd, D.; Martini, P.; Lewis, G. F.; Moller, A.; Sharp, R. G.; Sommer, N. E.; Tucker, B. E.; Yuan, F.; Zhang, B.; Asorey, J.; Davis, T. M.; Hinton, S.; Muthukrishna, D.; Parkinson, D.; Carnero, A.; King, A.; Lidman, C.; Webb, S.; Uddin, S.; Kessler, R.; Lasker, J.; Scolnic, D.; Brout, D. J.; D'Andrea, C.; Gladney, L.; March, M.; Sako, M.; Wolf, R. C.; Brown, P. J.; Krisciunas, K.; Suntzeff, N.; Macaulay, E.; Nichol, R.; Childress, M.; Prajs, S.; Smith, M.; Sullivan, M.; Maartens, R.; Kovacs, E.; Kuhlmann, S.; Spinka, H.; Ahn, E.; Finley, D. A.; Frieman, J.; Marriner, J.; Wester, W.; Aldering, G.; Gupta, R.; Kim, A. G.; Thomas, R. C.; Barbary, K.; Bloom, J. S.; Goldstein, D.; Nugent, P.; Perlmutter, S.; Foley, R. J.; Pan, Y.-C.; Casas, R.; Castander, F. J.; Papadopoulos, A.; Morganson, E.; Desai, S.; Paech, K.; Smith, R. C.; Schubnell, M.

    2016-11-01

    We report new spectroscopic classifications by OzDES of supernovae discovered by the Dark Energy Survey (ATEL #4668). The spectra (370-885nm) were obtained with the AAOmega Spectrograph (Saunders et al. 2004, SPIE, 5492, 389) and the 2dF fibre positioner at the Anglo-Australian Telescope (AAT).

  6. Sintering and characterization of (Pu,Zr)N

    NASA Astrophysics Data System (ADS)

    Pukari, Merja; Takano, Masahide; Nishi, Tsuyoshi

    2014-01-01

    Nitride fuel, with the composition of (Pu0.4Zr0.6)N, is fabricated for studying the sinterability of nitride fuel as a function of oxygen concentration in the material. Oxygen concentration of up to 0.6 wt% evidently enhances the densification of the material. Increasing the sintering temperature from 1923 to 1973 K improves the sintered pellet densities by up to 3.8%TD. In addition, the measured thermophysical and electrical properties of (Pu0.4Zr0.6)N reveal that the values are close to those of PuN. Elevated oxygen concentration in the material decreases its thermal conductivity. Oxygen concentration of 0.34 wt% in (Pu,Zr)N is a consequence of the fabrication process, considering the relatively pure ZrN (0.03 wt% O) and PuN (0.08 wt% O) powders initially fabricated.

  7. Preparation and thermal properties of Zr-intercalated clays

    SciTech Connect

    Figueras, F.; Mattrod-Bashi, A.; Fetter, G.; Thrierr, A. ); Zanchetta, J.V. )

    1989-09-01

    Montmorillonites intercalated by zirconium macrocations have been prepared. Diffusion of the Zr cations within the particles of clay controls the rate of ion exchange, and hence the distribution of the Zr pillars. This effect accounts for the influence of particle size on the degree of exchange, the surface area, and the thermal stability of the pillared clay. The thermal stability of the Zr clays prepared under these conditions is limited to 973 K in dry air. The changes in microporosity, evaluated from nitrogen adsorption using the equation of Dubinin, show that collapse of the structure occurs by sintering of the pillars. This sintering can be decreased by doping the pillars with rare earth cations. The resulting material then retains a surface area of 180 m{sup 2}/g after calcination at 1023 K in dry air, and is more acidic than the corresponding Zr-clay.

  8. DFT STUDY REVISES INTERSTITIAL CONFIGURATIONS IN HCP Zr

    SciTech Connect

    Samolyuk, German D; Golubov, Stanislav I; Osetskiy, Yury N; Stoller, Roger E

    2012-06-01

    Analysis of experimental result on microstructure evolution in irradiated Zr and alloys has demonstrated that available knowledge on self-interstitial defects in Zr is in contradiction. We therefore have initiated an extensive theoretical and modeling program to clarify this issue. In this report we present first ab initio calculations results of single SIA configurations in Zr. We demonstrate importance of simulations cell size, applied exchange-correlation functional and simulated c/a ratio. The results obtained demonstrate clearly that the most stable configurations are in basal plane and provide some evidences for enhanced interstitial transport along basal planes. The results obtained will be used in generation a new interatomic potential for Zr to be used in large-scale atomistic modeling of mechanisms relevant for radiation-induced microstructure evolution.

  9. Interstitial site occupation in ZrNiH

    SciTech Connect

    Westlake, D.G.; Shaked, H.; Mason, P.R.; McCart, B.R.; Mueller, M.H.; Matsumoto, T.; Amano, M.

    1981-12-01

    In-situ x-ray diffraction measurements during step-wise hydrogenation of the intermetallic compound ZrNi have confirmed the existence of a stable compound ZrNiH. Neutron diffraction measurements on ZrNiD have allowed a determination of the site occupied by D. This site is tetrahedrally coordinated by four Zr atoms as predicted earlier from a model based solely on geometric considerations. Occupation of this site causes the lattice to distort from an orthorhombic to a triclinic structure. The trihydride is formed when two completely different types of sites are filled, to the exclusion of the sites occupied originally, causing reversion of the lattice to an orthorhombic structure. Other confirmed predictions of the geometric model are discussed. 3 figures.

  10. Elemental health

    SciTech Connect

    Tonneson, L.C.

    1997-01-01

    Trace elements used in nutritional supplements and vitamins are discussed in the article. Relevant studies are briefly cited regarding the health effects of selenium, chromium, germanium, silicon, zinc, magnesium, silver, manganese, ruthenium, lithium, and vanadium. The toxicity and food sources are listed for some of the elements. A brief summary is also provided of the nutritional supplements market.

  11. Response to letter "Electron correlation and relativity of the 5f electrons in the Usbnd Zr alloy system"

    NASA Astrophysics Data System (ADS)

    Xie, Wei; Marianetti, Chris A.; Morgan, Dane

    2016-08-01

    In the Letter [Söderlind et al., J. Nucl. Mater. 444, 356 (2014)], Söderlind et al. state their interpretation that 1) we view electron correlation to be strong and including spin-orbit coupling (SOC) to be necessary for U metal and Usbnd Zr alloy in our article [Xiong et al., J. Nucl. Mater. 443, 331 (2013)]. Further, they argue that 2) density functional theory (DFT) without adding the Hubbard U potential, especially when solved using all electron methods, already models U and Usbnd Zr accurately, and 3) adding the Hubbard U potential to DFT in DFT + U models U and Usbnd Zr worse than DFT according to volume, bulk modulus, and magnetic moments predicted from their calculations of the γU phase of elemental U metal. With respect to Söderlind et al.'s interpretation 1), we clarify that our opinions are that U and Usbnd Zr are not strongly, but weakly to moderately correlated and that including SOC is beneficial but not necessary for modeling most ground state properties of U and Usbnd Zr. With respect to Söderlind et al.'s argument 2) we demonstrate that previously neglected and very recent experimental data suggest that DFT in Söderlind's full-potential linear muffin-tin orbital calculations [Söderlind, Phys. Rev. B 66, 085113 (2002)] in fact models the bulk modulus and elastic constants of αU with errors considerably larger than other related elements, e.g., most transition metals. With respect to Söderlind et al.'s argument 3) we argue that they have inappropriately focused on just one phase (the BCC γU phase of U metal), neglecting the other phases which represent the majority of our evidence, and made overgeneralizations based on results at only one Ueff value of 2 eV. We therefore maintain our original conclusion that the accuracy of DFT for modeling U and Usbnd Zr has room for improvement and DFT + U can be of value for this purpose on at least some ground state properties.

  12. Elevated Temperature Compressive Properties of Zr-Modified Nial

    NASA Technical Reports Server (NTRS)

    Whittenberger, J. Daniel; Noebe, R. D.

    1996-01-01

    Small Zr additions are known to substantially affect the deformation behavior and strength of polycrystalline NiAl, yet little information is currently available regarding the high-temperature properties of such alloys. Utilizing prealloyed powder technology, a series of four NiAl alloys have been produced containing from 0.05 to 0.7 at. pct Zr. The creep behavior of these alloys was characterized in compression between 1000 and 1400 K at strain rates ranging from approx. O.1 to 10(exp -9)/ sec. All the Zr-modified alloys were significantly stronger than binary NiAl under lower temperature and faster strain-rate conditions; however, the single-phase materials (Zr less than or equal to 0.1 at. pct) and binary NiAl had similar strengths at high temperatures and slow strain rates. The two-phase NiAl-Ni, AlZr alloys containing 0.3 and 0.7 at. pct Zr had nearly identical strengths. While the two-phase alloys were stronger than the single-phase materials at all test conditions, the degree of microstructural damage in the two-phase alloys due to internal oxidation during testing appeared to increase with Zr level. Balancing the poor oxidation behavior with the consistent strength advantage of the two-phase alloys, it is concluded that optimum elevated-temperature properties could be obtained in Heusler-strengthened NiAl containing between 0.1 and 0.3 at. pct Zr.

  13. Ab initio molecular dynamics simulations of short-range order in Zr50Cu45Al5 and Cu50Zr45Al5 metallic glasses

    DOE PAGES

    Huang, Yuxiang; Huang, Li; Wang, C. Z.; ...

    2016-02-01

    Comparative analysis between Zr-rich Zr50Cu45Al5 and Cu-rich Cu50Zr45Al5 metallic glasses (MGs) is extensively performed to locate the key structural motifs accounting for their difference of glass forming ability. Here we adopt ab initio molecular dynamics simulations to investigate the local atomic structures of Zr50Cu45Al5 and Cu50Zr45Al5 MGs. A high content of icosahedral-related (full and distorted) orders was found in both samples, while in the Zr-rich MG full icosahedrons < 0,0,12,0 > is dominant, and in the Cu-rich one the distorted icosahedral orders, especially < 0,2,8,2 > and < 0,2,8,1 >, are prominent. And the < 0,2,8,2 > polyhedra in Cu50Zr45Al5more » MG mainly originate from Al-centered clusters, while the < 0,0,12,0 > in Zr50Cu45Al5 derives from both Cu-centered clusters and Al-centered clusters. These difference may be ascribed to the atomic size difference and chemical property between Cu and Zr atoms. Lastly, the relatively large size of Zr and large negative heat of mixing between Zr and Al atoms, enhancing the packing density and stability of metallic glass system, may be responsible for the higher glass forming ability of Zr50Cu45Al5.« less

  14. Biocompatible Ni-free Zr-based bulk metallic glasses with high-Zr-content: compositional optimization for potential biomedical applications.

    PubMed

    Hua, Nengbin; Huang, Lu; Chen, Wenzhe; He, Wei; Zhang, Tao

    2014-11-01

    The present study designs and prepares Ni-free Zr60+xTi2.5Al10Fe12.5-xCu10Ag5 (at.%, x=0, 2.5, 5) bulk metallic glasses (BMGs) by copper mold casting for potential biomedical application. The effects of Zr content on the in vitro biocompatibility of the Zr-based BMGs are evaluated by investigating mechanical properties, bio-corrosion behavior, and cellular responses. It is found that increasing the content of Zr is favorable for the mechanical compatibility with a combination of low Young's modulus, large plasticity, and high notch toughness. Electrochemical measurements demonstrate that the Zr-based BMGs are corrosion resistant in a phosphate buffered saline solution. The bio-corrosion resistance of BMGs is improved with the increase in Zr content, which is attributed to the enrichment in Zr and decrease in Al concentration in the surface passive film of alloys. Regular cell responses of mouse MC3T3-E1 cells, including cell adhesion and proliferation, are observed on the Zr-Ti-Al-Fe-Cu-Ag BMGs, which reveals their general biosafety. The high-Zr-based BMGs exhibit a higher cell proliferation activity in comparison with that of pure Zr and Ti-6Al-4V alloy. The effects of Zr content on the in vitro biocompatibility can be used to guide the future design of biocompatible Zr-based BMGs.

  15. Interdiffusion in amorphous AlxZr1-x alloys

    NASA Astrophysics Data System (ADS)

    Noah, Martin A.; Wang, Zumin; Mittemeijer, Eric J.

    2017-01-01

    Interdiffusion in amorphous Alx Zr1 -x compositionally modulated multilayers was investigated by Auger electron spectroscopy sputter-depth profiling. Microstructural characterisation was performed by X-ray diffraction and cross-sectional transmission electron microscopy. The temperature-dependent chemical diffusion coefficient could be deduced at a series of temperatures in the range of 356 °C to 415 °C and was found to be weakly dependent on composition. The activation enthalpy for the chemical diffusion coefficients is slightly smaller at the composition of the Al-rich am- Al0.62 Zr0.38 sublayer (1.6 eV) than at the composition of the Zr-rich am- Al0.27 Zr0.73 sublayer (1.8 eV), which is not related to the concentration dependence of the excess free volume but to the smaller atomic size and mass of Al as compared to Zr. The smaller activation enthalpy for interdiffusion in partially crystallised specimens than in entirely amorphous Alx Zr1 -x multilayers is ascribed to the relatively large excess free volume in the grain boundaries of the nanocrystalline sublayers, as compared to the amorphous phase, at large Al concentrations. On the basis of an evaluation of the role of diffusion-induced stress in amorphous systems, it is shown that stresses induced by interdiffusion relax relatively fast by viscous flow and do not affect the determined diffusion coefficients.

  16. Mechanical and thermal properties of bulk ZrB2

    NASA Astrophysics Data System (ADS)

    Nakamori, Fumihiro; Ohishi, Yuji; Muta, Hiroaki; Kurosaki, Ken; Fukumoto, Ken-ichi; Yamanaka, Shinsuke

    2015-12-01

    ZrB2 appears to have formed in the fuel debris at the Fukushima Daiichi nuclear disaster site, through the reaction between Zircaloy cladding materials and the control rod material B4C. Since ZrB2 has a high melting point of 3518 K, the ceramic has been widely studied as a heat-resistant material. Although various studies on the thermochemical and thermophysical properties have been performed for ZrB2, significant differences exist in the data, possibly due to impurities or the porosity within the studied samples. In the present study, we have prepared a ZrB2 bulk sample with 93.1% theoretical density by sintering ZrB2 powder. On this sample, we have comprehensively examined the thermal and mechanical properties of ZrB2 by the measurement of specific heat, ultrasonic sound velocities, thermal diffusivity, and thermal expansion. Vickers hardness and fracture toughness were also measured and found to be 13-23 GPa and 1.8-2.8 MPa m0.5, respectively. The relationships between these properties were carefully examined in the present study.

  17. On the estimation of climatological Z-R relationships

    NASA Technical Reports Server (NTRS)

    Krajewski, Witold F.; Smith, James A.

    1991-01-01

    A statistical framework for climatological Z-R parameter estimation is developed and simulation experiments are conducted to examine sampling properties of the estimators. Both parametric and nonparametric models are considered. For parametric models, it is shown that Z-R parameters can be estimated by maximum likelihood, a procedure with optimal large sample properties. A general nonparametric framework for climatological Z-R estimation is also developed. Nonparametric procedures are attractive because of their flexibility in dealing with certain types of measurement errors common to radar data. Simulation experiments show that even under favorable assumptions on error characteristics of radar and raingages, large datasets are required to obtain accurate Z-R parameter estimates. Another important conclusion is that estimation results are generally quite sensitive to radar and raingage measurement thresholds. For fixed sample size, the simulation results can be used to provide quantitative assessments of the accuracy of Z-R model parameter estimates. These results are particularly useful for error analysis of precipitation products that are derived using climatological Z-R relations. One example is the large-area rainfall estimates derived using the height-area rainfall threshold (HART) technique.

  18. PET Imaging with 89Zr: From Radiochemistry to the Clinic

    PubMed Central

    Deri, Melissa A.; Zeglis, Brian M.; Francesconi, Lynn C.; Lewis, Jason S.

    2012-01-01

    The advent of antibody-based cancer therapeutics has led to the concomitant rise in the development of companion diagnostics for these therapies, particularly nuclear imaging agents. A number of radioisotopes have been employed for antibody-based PET and SPECT imaging, notably 64Cu, 124I, 111In, and 99mTc; in recent years, however, the field has increasingly focused on 89Zr, a radiometal with near ideal physical and chemical properties for immunoPET imaging. In the review at hand, we seek to provide a comprehensive portrait of the current state of 89Zr radiochemical and imaging research, including work into the production and purification of the isotope, the synthesis of new chelators, the development of new bioconjugation strategies, the creation of novel 89Zr-based agents for preclinical imaging studies, and the translation of 89Zr-labeled radiopharmaceuticals to the clinic. Particular attention will also be dedicated to emerging trends in the field, 89Zr-based imaging applications using vectors other than antibodies, the comparative advantages and limitations of 89Zr-based imaging compared to that with other isotopes, and areas that would benefit from more extensive investigation. At bottom, it is hoped that this review will provide both the experienced investigator and new scientist with a full and critical overview of this exciting and fast-developing field. PMID:22998840

  19. Latina Voices of Des Moines.

    ERIC Educational Resources Information Center

    Taylor, P. Dawn

    This dissertation examines the lives of Hispanic women living in Des Moines and includes their views of problems and opportunities involved in living in that city. Interviews were conducted with 24 Latino women over the age of 17 who had been in the area for over 2 years. Findings indicate that learning to speak English was the single most…

  20. Enhanced flux pinning in GdBaCuO bulk superconductors by Zr dopants

    NASA Astrophysics Data System (ADS)

    Xu, C.; Hu, A.; Ichihara, M.; Sakai, N.; Izumi, M.; Hirabayashi, I.

    2007-10-01

    We, respectively, fabricated GdBa2Cu3O7-δ (Gd123) single domain superconductors by melt growth process in air with Gd2Ba4CuZrOx (GdZr2411) and nanosize ZrO2 dopants. The microstructures and superconducting properties were investigated by scanning/transmission electron microscopy (SEM/TEM) and SQUID. GdZr2411 and BaZrO3 particles with the average size of 50 nm were observed in the GdZr2411 and nanosize ZrO2 doped Gd123 bulks by TEM, respectively. Critical current density (Jc) was enhanced up to 100,000 A/cm2 at 77 K and self-field with 0.4 mol% nano-sized ZrO2. The present study also showed that small amount GdZr2411 dopants (8 mol%, ratio to Gd123) were effective to induce a δTc-type pinning.

  1. Increasing Ti-6Al-4V brazed joint strength equal to the base metal by Ti and Zr amorphous filler alloys

    SciTech Connect

    Ganjeh, E.; Sarkhosh, H.; Bajgholi, M.E.; Khorsand, H.; Ghaffari, M.

    2012-09-15

    Microstructural features developed along with mechanical properties in furnace brazing of Ti-6Al-4V alloy using STEMET 1228 (Ti-26.8Zr-13Ni-13.9Cu, wt.%) and STEMET 1406 (Zr-9.7Ti-12.4Ni-11.2Cu, wt.%) amorphous filler alloys. Brazing temperatures employed were 900-950 Degree-Sign C for the titanium-based filler and 900-990 Degree-Sign C for the zirconium-based filler alloys, respectively. The brazing time durations were 600, 1200 and 1800 s. The brazed joints were evaluated by ultrasonic test, and their microstructures and phase constitutions analyzed by metallography, scanning electron microscopy and X-ray diffraction analysis. Since microstructural evolution across the furnace brazed joints primarily depends on their alloying elements such as Cu, Ni and Zr along the joint. Accordingly, existence of Zr{sub 2}Cu, Ti{sub 2}Cu and (Ti,Zr){sub 2}Ni intermetallic compounds was identified in the brazed joints. The chemical composition of segregation region in the center of brazed joints was identical to virgin filler alloy content which greatly deteriorated the shear strength of the joints. Adequate brazing time (1800 s) and/or temperature (950 Degree-Sign C for Ti-based and 990 Degree-Sign C for Zr-based) resulted in an acicular Widmanstaetten microstructure throughout the entire joint section due to eutectoid reaction. This microstructure increased the shear strength of the brazed joints up to the Ti-6Al-4V tensile strength level. Consequently, Ti-6Al-4V can be furnace brazed by Ti and Zr base foils produced excellent joint strengths. - Highlights: Black-Right-Pointing-Pointer Temperature or time was the main factors of controlling braze joint strength. Black-Right-Pointing-Pointer Developing a Widmanstaetten microstructure generates equal strength to base metal. Black-Right-Pointing-Pointer Brittle intermetallic compounds like (Ti,Zr){sub 2}Ni/Cu deteriorate shear strength. Black-Right-Pointing-Pointer Ti and Zr base filler alloys were the best choice for brazing Ti

  2. Ordered Structures and Thermoelectric Properties of MNiSn (M = Ti, Zr, Hf)-Based Half-Heusler Compounds Affected by Close Relationship with Heusler Compounds

    NASA Astrophysics Data System (ADS)

    Kimura, Yoshisato; Chai, Yaw-Wang

    2015-01-01

    Half-Heusler compounds are excellent thermoelectric materials. A characteristic of the half-Heusler-type ordered structure is the vacancy site that occupies one-fourth of all the lattice points. Therefore, a half-Heusler ABX phase (where A and B are typically transition metal elements, such as Ti, Zr, and Hf, and X represents a half-metal element such as Sn or Sb) has a crystallographically close relationship with a Heusler AB2X phase in the sense that the vacancy site in the half-Heusler phase is filled with B atoms in the Heusler phase. The thermoelectric properties are improved or affected by point lattice defects related to the vacancy site and the B site, such as the antisite atom B in the vacancy site, vacancies in the B site, and vacancy-site occupancy by quaternary C atoms. A modulated-like nanostructure due to point defects regarding vacancies and Ni atoms is formed for an instance in ZrNiSn alloys even close to the stoichiometric composition. Ni-rich nanoclusters are locally formed by excessive Ni antisite atoms in the vacancy site, which work as precursors of Heusler precipitates (TiNi2Sn, ZrNi2Sn, and so forth). The vacancy-site occupation in ZrNiSn with Co and Ir results in the drastic conversion of thermoelectric properties from n type to p type, and the effective reduction of the lattice thermal conductivity.

  3. Saturation and forced volume magnetostrictions of Fe-rich FeZr and FeNiZr amorphous alloys

    NASA Astrophysics Data System (ADS)

    Tange, H.; Kamimori, T.; Goto, M.; Fukamichi, K.

    1990-12-01

    The saturation and forced volume magnetostrictions, ac susceptibility have been investigated for Fe 90Zr 10 and Fe 90-xNi xZr 10 amorphous alloys. The linear magnetostriction in the re-entrant spin glass state exhibits a hysteresis due to a remarkable magnetic after effect. The temperature dependence of the forced volume magnetostriction shows a peak at the spin freezing temperature.

  4. Structural and electronic properties of SrZrO3 and Sr(Ti,Zr)O3 alloys

    NASA Astrophysics Data System (ADS)

    Weston, L.; Janotti, A.; Cui, X. Y.; Himmetoglu, B.; Stampfl, C.; Van de Walle, C. G.

    2015-08-01

    Using hybrid density functional calculations, we study the electronic and structural properties of SrZrO3 and ordered Sr (Ti ,Zr )O3 alloys. Calculations were performed for the ground-state orthorhombic (P n m a ) and high-temperature cubic (P m 3 m ) phases of SrZrO3. The variation of the lattice parameters and band gaps with Ti addition was studied using ordered SrTixZr1 -xO3 structures with x =0 , 0.25, 0.5, 0.75, and 1. As Ti is added to SrZrO3, the lattice parameter is reduced and closely follows Vegard's law. On the other hand, the band gap shows a large bowing and is highly sensitive to the Ti distribution. For x =0.5 , we find that arranging the Ti and Zr atoms into a 1 ×1 SrZrO3/SrTiO3 superlattice along the [001] direction leads to interesting properties, including a highly dispersive single band at the conduction-band minimum (CBM), which is absent in both parent compounds, and a band gap close to that of pure SrTiO3. These features are explained by the splitting of the lowest three conduction-band states due to the reduced symmetry of the superlattice, lowering the band originating from the in-plane Ti 3 dx y orbitals. The lifting of the t2 g orbital degeneracy around the CBM suppresses scattering due to electron-phonon interactions. Our results demonstrate how short-period SrZrO3/SrTiO3 superlattices could be exploited to engineer the band structure and improve carrier mobility compared to bulk SrTiO3.

  5. Realisation de composants tout-fibre passifs bases sur des fibres optiques a deux coeurs

    NASA Astrophysics Data System (ADS)

    Jacob Poulin, Anne C.

    2002-01-01

    Les composants passifs tout-optique sont des elements de choix dans les systemes de communications optiques. Cette these presente l'utilisation experimentale de fibres a deux coeurs dissimilaires pour la realisation de filtres passe-bande. Les fibres a deux coeurs ont la particularite de favoriser un couplage d'un coeur a l'autre a intervalles reguliers lorsque les coeurs sont exactement identiques. Dans le cas ou une legere difference apparait, ce couplage est rapidement reduit a zero. La premiere partie de la these montre comment, par l'emploi d'une geometrie de fibre appropriee, il est possible de compenser cette desyntonisation et de fabriquer des coupleurs 100%. Les filtres obtenus ayant toutefois une largeur de bande trop grande pour les besoins du marche des communications optiques, il est montre dans la deuxieme partie de la these comment, en alliant la technologie des reseaux de Bragg avec celle des coupleurs, il est possible de realiser des filtres operant en transmission et possedant d'excellentes caracteristiques spectrales, toujours avec ces memes fibres a deux coeurs.

  6. Modified ring stretch tensile testing of Zr-1Nb cladding

    SciTech Connect

    Cohen, A.B.; Majumdar, S.; Ruther, W.E.; Billone, M.C.; Chung, H.M.; Neimark, L.A.

    1998-03-01

    In a round robin effort between the US Nuclear Regulatory Commission, Institut de Protection et de Surete Nucleaire in France, and the Russian Research Centre-Kurchatov Institute, Argonne National Laboratory conducted 16 modified ring stretch tensile tests on unirradiated samples of zr-1Nb cladding, which is used in Russian VVER reactors. Test were conducted at two temperatures (25 and 400 C) and two strain rates (0.001 and 1 s{sup {minus}1}). At 25 C and 0.001 s{sup {minus}1}, the yield strength (YS), ultimate tensile strength (UTS), uniform elongation (UE), and total elongation (TE) were 201 MPa, 331 MPa, 18.2%, and 57.6%, respectively. At 400 C and 0.001 s{sup {minus}1}, the YS, UTS, UE, and TE were 109 MPa, 185 MPa, 15.4%, and 67.7%, respectively. Finally, at 400 C and 1 s{sup {minus}1}, the YS, UTS, UE, and TE were 134 MPa, 189 MPa, 18.9%, and 53.4%, respectively. The high strain rate tests at room temperature were not successful. Test results proved to be very sensitive to the amount of lubrication used on the inserts; because of the large contact area between the inserts and specimen, too little lubrication leads to significantly higher strengths and lower elongations being reported. It is also important to note that only 70 to 80% of the elongation takes place in the gauge section, depending on specimen geometry. The appropriate percentage can be estimated from a simple model or can be calculated from finite-element analysis.

  7. An experimental study of Ti and Zr partitioning among zircon, rutile, and granitic melt

    NASA Astrophysics Data System (ADS)

    Hofmann, Amy E.; Baker, Michael B.; Eiler, John M.

    2013-07-01

    In order to evaluate the effect of trace and minor elements (e.g., P, Y, and the REEs) on the high-temperature solubility of Ti in zircon (zrc), we conducted 31 experiments on a series of synthetic and natural granitic compositions [enriched in TiO2 and ZrO2; Al/(Na + K) molar 1.2] at a pressure of 10 kbar and temperatures of 1,400 to 1,200 °C. Thirty of the experiments produced zircon-saturated glasses, of which 22 are also saturated in rutile (rt). In seven experiments, quenched glasses coexist with quartz (qtz). SiO2 contents of the quenched liquids range from 68.5 to 82.3 wt% (volatile free), and water concentrations are 0.4-7.0 wt%. TiO2 contents of the rutile-saturated quenched melts are positively correlated with run temperature. Glass ZrO2 concentrations (0.2-1.2 wt%; volatile free) also show a broad positive correlation with run temperature and, at a given T, are strongly correlated with the parameter (Na + K + 2Ca)/(Si·Al) (all in cation fractions). Mole fraction of ZrO2 in rutile ( {Xnolimits_{{{{ZrO}}_{ 2} }}^{{rt}} } ) in the quartz-saturated runs coupled with other 10-kbar qtz-saturated experimental data from the literature (total temperature range of 1,400 to 675 °C) yields the following temperature-dependent expression: {{ln}}( {mathop X{{{{ZrO}}_{ 2} }}^{{rt}} } ) + {{ln}}( {a_{{{{SiO}}2 }} } ) = 2.638(149) - 9969(190)/T({{K}}) , where silica activity a_{{{{SiO}}2 }} in either the coexisting silica polymorph or a silica-undersaturated melt is referenced to α-quartz at the P and T of each experiment and the best-fit coefficients and their uncertainties (values in parentheses) reflect uncertainties in T and Xnolimits_{{{{ZrO}}2 }}^{{rt}} . NanoSIMS measurements of Ti in zircon overgrowths in the experiments yield values of 100 to 800 ppm; Ti concentrations in zircon are positively correlated with temperature. Coupled with values for a_{{{{SiO}}2 }} and a_{{{{TiO}}2 }} for each experiment, zircon Ti concentrations (ppm) can be related to

  8. L'astronomie des Anciens

    NASA Astrophysics Data System (ADS)

    Nazé, Yaël

    2009-04-01

    Quelle que soit la civilisation à laquelle il appartient, l'être humain cherche dans le ciel des réponses aux questions qu'il se pose sur son origine, son avenir et sa finalité. Le premier mérite de ce livre est de nous rappeler que l'astronomie a commencé ainsi à travers les mythes célestes imaginés par les Anciens pour expliquer l'ordre du monde et la place qu'ils y occupaient. Mais les savoirs astronomiques passés étaient loin d'être négligeables et certainement pas limités aux seuls travaux des Grecs : c'est ce que l'auteur montre à travers une passionnante enquête, de Stonehenge à Gizeh en passant par Pékin et Mexico, fondée sur l'étude des monuments anciens et des sources écrites encore accessibles. Les tablettes mésopotamiennes, les annales chinoises, les chroniques médiévales, etc. sont en outre d'une singulière utilité pour les astronomes modernes : comment sinon remonter aux variations de la durée du jour au cours des siècles, ou percer la nature de l'explosion qui a frappé tant d'observateurs en 1054 ? Ce livre offre un voyage magnifiquement illustré à travers les âges, entre astronomie et archéologie.

  9. Influence of electronegativity on the electronic structures and stabilities of microclusters of carbides MC_n (M : transition, rare-earth or normal element, n < 10)

    NASA Astrophysics Data System (ADS)

    Leleyter, M.

    1991-10-01

    infer a likely electronic configuration of the MC_n clusters and 2 tables give the compared electronic structures of these clusters for normal or transition elements. Such a kind of structure is only able to explain the parity effect origin of the MC_n clusters and even enable to foreknow for transition or rare-earth metal carbides which are not studied yet if the alternations will be “even" (EN le 1.7) or “odd". Les agrégats MC_n obtenus à partir de carbures par diverses méthodes expérimentales (SIMS, SSMS, vaporisation laser, effusion de Knudsen à haute température, etc.) présentent des alternances dans leurs intensités d'émission I(MC^+_n) avec maximums pour n impair si M = H, F, CI ou Fe, Ni, Rh, Ir, Pt ou au contraire pour n pair si M = B, Si, Ba, Ge ou Sc, Ti, V, Cr, Y, Zr, La, Ce, W, Th, U ou même n'existent que pour n pair (Nd, Dy, Ho, Er). D'autre part, seuls sont connus CO, C_3O, CN et C_3N pour l'oxygène et l'azote. Ces phénomènes sont interprétés tout d'abord à l'aide de la règle bien connue de correspondance qui relie de fortes (resp. faibles) intensités ou fréquences d'émissions d'ions MC^+_n à de fortes (resp. faibles) stabilités des amas correspondants. En second lieu, ces résultats s'expliquent dans le cadre du modèle de Pitzer et Clementi (hybridation sp en théorie de Hückel) corroboré par des calculs CNDO: on suppose que les amas MC^+_n sont des chaînes linéaires C^+_n portant un atome d'impureté M en bout de chaîne. Dans ces conditions, les alternances de stabilités relatives des MC_n proviennent de ce que l'orbitale moléculaire la plus élevée (“ HOMO ”) se trouve dans une bande niveaux π doublement dégénérés et qu'à une orbitale π complète (4 électrons) correspond une plus forte stabilité de l'amas que si l'orbitale est incomplète. Or le nombre d'électrons π d'une chaîne MC_n est gouverné par le nombre de niveaux σ liants et en outre pour les éléments de transition ou de terres rares, par

  10. Mechanical and dynamical behaviors of ZrSi and ZrSi{sub 2} bulk metallic glasses: A molecular dynamics study

    SciTech Connect

    Ju, Shin-Pon; Wu, Tsang-Yu; Liu, Shih-Hao

    2015-03-14

    The mechanical and dynamical properties of ZrSi and ZrSi{sub 2} bulk metallic glasses (BMGs) have been investigated by molecular dynamics simulation. The Honeycutt-Anderson (HA) index analysis indicates that the major indexes in ZrSi and ZrSi{sub 2} bulk metallic glasses are 1551, 1541, and 1431, which refers to the liquid structure. For uniaxial tension, the results show that the ZrSi and ZrSi{sub 2} BMGs are more ductile than their crystal counterparts. The evolution of the distribution of atomic local shear strain clearly shows the initialization of shear transformation zones (STZs), the extension of STZs, and the formation of shear bands along a direction 45° from the tensile direction when the tensile strain gradually increases. The self-diffusion coefficients of ZrSi and ZrSi{sub 2} BMGs at temperatures near their melting points were calculated by the Einstein equation according to the slopes of the MSD profiles at the long-time limit. Because the HA fraction summation of icosahedral-like structures of ZrSi BMG is higher than that of ZrSi{sub 2} BMG, and these local structures are more dense, the self-diffusion coefficients of the total, Zr, and Si atoms of ZrSi{sub 2} BMG are larger than those of ZrSi BMG. This can be attributed to the cage effect, where a denser local structure has a higher possibility of atoms jumping back to form a backflow and then suppress atomic diffusivity. For ZrSi{sub 2} BMG, the self-diffusion coefficient of Si increases with temperature more significantly than does that of Zr, because more open packing rhombohedra structures are formed by the Si-Si pair.

  11. Effect of Zr + ion irradiation on the mechanical anisotropy of Zr-2.5%Nb pressure tube material

    NASA Astrophysics Data System (ADS)

    Bose, B.; Klassen, R. J.

    2010-10-01

    Constant load pyramidal indentation creep tests were performed to study the effect of Zr + ion irradiation on the anisotropy of the local plastic deformation of Zr-2.5%Nb pressure tube material at 25 °C. The ratio of the average indentation stress σ on the transverse normal (TN) plane relative to that on the axial-normal (AN) and radial-normal (RN) planes is 1.3 and 1.2 respectively. After Zr + ion irradiation the ratio of σ on the TN plane relative to σ on the AN and RN planes is 1.04 and 1.08 respectively indicating that the anisotropy of the yield stress is decreased as a result of irradiation hardening. The relative change in indentation stress Δσˆ, as a result of irradiation damage, decreases with increasing resolved basal pole fraction in the indentation direction. This suggests that the Zr + ion irradiation damage has a greater effect on blocking the movement of dislocations on prismatic slip systems compared to pyramidal slip systems in the Zr-2.5%Nb pressure tubing. The activation energy Δ G0 of the obstacles that limit the rate of dislocation glide during indentation creep at 25 °C does not change with indentation direction but does increase with increasing levels of Zr + ion irradiation damage.

  12. Atomic-Scale Structure of Al2O3-ZrO2 Mixed Oxides Prepared by Laser Ablation

    SciTech Connect

    Yang Xiuchun; Dubiel, M.; Hofmeister, H.; Riehemann, W.

    2007-02-02

    By means of x-ray diffractometry (XRD) and X-ray absorption fine structure spectroscopy, the phase composition and atomic structure of laser evaporated ZrO2 and ZrO2-Al2O3 nanopowders have been studied. The results indicate that pure ZrO2 exists in the form of tetragonal structure, Al2O3 doped ZrO2 nanoparticles, however, have cubic structure. Compared to bulk tetragonal ZrO2, pure tetragonal ZrO2 nanoparticles have a shorter Zr-O- and Zr-Zr shell, indicating that the lattice contracts with decreasing particle size. For Al2O3 doped ZrO2 solid solution, the distances of first Zr-O and Zr-Zr (Al) coordination decrease with increasing solid solubility. The disorder degree of the ZrO2 lattice increases with increasing solid solubility. The coevaporated ZrO2-Al2O3 is quickly solidified into amorphous phase when it is ablated in a higher pressure. The amorphous phase contains Zr-O-Zr (Al) clusters and has shorter Zr-O distance and tower Zr-O coordination number.

  13. Multistatic Surveillance and Reconnaissance: Sensor, Signals and Data Fusion (Surveillance et Reconnaissance Multistatiques : Fusion des capteurs, des signaux et des donnees)

    DTIC Science & Technology

    2009-04-01

    capteurs , des signaux et des données) Research and Technology Organisation (NATO) BP 25, F-92201 Neuilly-sur-Seine Cedex, France RTO-EN-SET-133...Multistatiques : Fusion des capteurs , des signaux et des données) The material in this publication was assembled to support a Lecture Series under the...Surveillance et Reconnaissance Multistatiques : Fusion des capteurs , des signaux et des données (RTO-EN-SET-133) Synthèse Les systèmes radar

  14. Elemental Education.

    ERIC Educational Resources Information Center

    Daniel, Esther Gnanamalar Sarojini; Saat, Rohaida Mohd.

    2001-01-01

    Introduces a learning module integrating three disciplines--physics, chemistry, and biology--and based on four elements: carbon, oxygen, hydrogen, and silicon. Includes atomic model and silicon-based life activities. (YDS)

  15. Superheavy Elements

    ERIC Educational Resources Information Center

    Tsang, Chin Fu

    1975-01-01

    Discusses the possibility of creating elements with an atomic number of around 114. Describes the underlying physics responsible for the limited extent of the periodic table and enumerates problems that must be overcome in creating a superheavy nucleus. (GS)

  16. Element 117

    ScienceCinema

    None

    2016-09-30

    An international team of scientists from Russia and the United States, including two Department of Energy national laboratories and two universities, has discovered the newest superheavy element, element 117. The team included scientists from the Joint Institute of Nuclear Research (Dubna, Russia), the Research Institute for Advanced Reactors (Dimitrovgrad), Lawrence Livermore National Laboratory, Oak Ridge National Laboratory, Vanderbilt University, and the University of Nevada, Las Vegas.

  17. Element 117

    SciTech Connect

    2010-04-08

    An international team of scientists from Russia and the United States, including two Department of Energy national laboratories and two universities, has discovered the newest superheavy element, element 117. The team included scientists from the Joint Institute of Nuclear Research (Dubna, Russia), the Research Institute for Advanced Reactors (Dimitrovgrad), Lawrence Livermore National Laboratory, Oak Ridge National Laboratory, Vanderbilt University, and the University of Nevada, Las Vegas.

  18. Electrochemical deoxidation of ZrSiO4 in molten calcium chloride

    NASA Astrophysics Data System (ADS)

    Lee, Min-Jae; Noh, Jae-Soo; Kim, Ki-Young; Lee, Jong-Hyun

    2014-12-01

    The electrochemical deoxidation of ZrSiO4 pellets in molten CaCl2 at 850°C in an argon atmosphere was studied. The sintered ZrSiO4 pellet was cathodically polarized against a graphite counter electrode under a constant applied potential. XRD and EDX analyses revealed that ZrSiO4 became ZrSi. Reduction from ZrSiO4 to ZrSi started at the location on the surface around the cathodic current-collector Mo wire and extended to the entire surface. As the electro-deoxidation reaction continued, the oxygen content in the product decreased.

  19. Determination of Ti, Zr, Nb, V, W and Mo in seawater by a new online-preconcentration method and subsequent ICP-MS analysis

    NASA Astrophysics Data System (ADS)

    Poehle, Sandra; Schmidt, Katja; Koschinsky, Andrea

    2015-04-01

    We present a new method for the determination of Ti, Zr, Nb, V, W and Mo in seawater by adapting the online-preconcentration procedure with the system SeaFAST and subsequent analysis by ICP-MS to these metals. The trace elements Ti, Zr, Nb and W are present in seawater in ultratrace concentrations in the range of pmol kg-1, whereas Mo and V, which are biologically essential elements, are present in the concentration range of nmol kg-1. The online-preconcentration system we used consists of an autosampler, a sample loop, a preconcentration column and two valves controlling the sample loop and the preconcentration processes. The pre-packed preconcentration column contains a chelating resin with two functional groups, ethylenediamine triacetic acid (EDTriA) and iminodiacetic acid (IDA), immobilized on a polymer backbone. The preconcentration process was optimized for loading the sample and subsequent rinsing to remove residues of seawater matrix prior to elution with the optimized elution acid (0.5 M HNO3-0.002 M HF). We used acidified North Sea seawater (0.02 M HCl-0.002 M HF) for the method development. Samples and calibration standards were loaded onto the preconcentration column and after elution directly transferred to the quadrupole ICP-MS and measured immediately. Best results were achieved with matrix-matched calibration standards (0.6 M NaCl-0.02 M HCl-0.002 M HF) simulating acidified seawater samples. Titanium, Zr, Nb and W are measured simultaneously in one run, whereas V and Mo are determined simultaneously in a separate run. Low procedure blanks were calculated for Ti, Zr, Nb, W (635, 14.5, 1.35, 10.2 pmol kg-1) and for V and Mo, 9.79 and 5.61 nmol kg-1, respectively. Very good spike recoveries achieved with spiked North Sea water demonstrate the applicability for all six elements. Analysis of the seawater standard NASS-6 gave recoveries of 97-99% (0.9-2.2% standard deviation, SD) for Mo and V. We also provide Zr, Nb and W data for this reference standard

  20. Initial stages of oxide formation on the Zr surface at low oxygen pressure: An in situ FIM and XPS study

    PubMed Central

    Bespalov, I.; Datler, M.; Buhr, S.; Drachsel, W.; Rupprechter, G.; Suchorski, Y.

    2015-01-01

    An improved methodology of the Zr specimen preparation was developed which allows fabrication of stable Zr nanotips suitable for FIM and AP applications. Initial oxidation of the Zr surface was studied on a Zr nanotip by FIM and on a polycrystalline Zr foil by XPS, both at low oxygen pressure (10−8–10−7 mbar). The XPS data reveal that in a first, fast stage of oxidation, a Zr suboxide interlayer is formed which contains three suboxide components (Zr+1, Zr+2 and Zr+3) and is located between the Zr surface and a stoichiometric ZrO2 overlayer that grows in a second, slow oxidation stage. The sole suboxide layer has been observed for the first time at very early states of the oxidation (oxygen exposure ≤4 L). The Ne+ FIM observations are in accord with a two stage process of Zr oxide formation. PMID:25766998

  1. Active Control Technology for Enhanced Performance Operational Capabilities of Military Aircraft, Land Vehicles and Sea Vehicles (Technologies des systemes a commandes actives pour l’amelioration des performances operationnelles des aeronefs militaires, des vehicules terrestres et des vehicules maritimes)

    DTIC Science & Technology

    2001-06-01

    d’améliorer le comportement global des systèmes et des sous- systèmes. Il s’agit de matériaux intelligents, de technologies informatiques, de capteurs ...des servocommandes rapides et fiables, ainsi que des capteurs de fonctionnement fiable même dans des environnements défavorables, et en particulier...des sous-systèmes. Il s’agit de matériaux intelligents, de technologies de fabrication novatrices, de technologies informatiques, de capteurs et de

  2. Synthesis and characterization of the layered zirconium arsenate Zr{sub 2}O{sub 3}(HAsO{sub 4}){center_dot}nH{sub 2}O

    SciTech Connect

    Bortun, A.I.; Bortun, L.N.; Clearfield, A.; Trobajo, C.; Garcia, J.R.

    1998-04-01

    Layered sodium zirconium arsenate of composition Zr{sub 2}O{sub 3}(NaAsO{sub 4}){center_dot}3H{sub 2}O was prepared by the reaction between Zr(OC{sub 3}H{sub 7}){sub 4} and sodium arsenate in alkaline media (pH > 12) under mild hydrothermal conditions (180--200 C). Two hydrogen forms of the zirconium arsenate ({psi}-ZrAs) Zr{sub 2}O{sub 3}(HAsO{sub 4}){center_dot}3H{sub 2}O and Zr{sub 2}O{sub 3}(HAsO{sub 4}){center_dot}H{sub 2}O, were prepared by acid treatment of the sodium form. The intercalation of n-alkylamines into the {psi}-ZrAs from the gas phase was studied. The synthesized materials were characterized by elemental analysis, thermogravimetric analysis, infrared spectroscopy and powder X-ray diffraction. The data indicate that the zirconium arsenate is isostructural to {psi}-Zr{sub 2}O{sub 3}(HPO{sub 4}){center_dot}nH{sub 2}O (n = 0.5, 1.5). The new compounds exhibit high hydrolytic stability in alkaline media. The ion exchange behavior of the {psi}-Zr{sub 2}O{sub 3}(HAsO{sub 4}){center_dot}3H{sub 2}O towards alkali, alkaline-earth, and some di- and tri-valent metal cations in different solutions was studied over a wide pH range (2--14) by the batch technique.

  3. Li2ZrO3-coated Li4Ti5O12 with nanoscale interface for high performance lithium-ion batteries

    NASA Astrophysics Data System (ADS)

    Zhang, Han; Liu, Yang; Wang, Ting; Yang, Yang; Shi, Shaojun; Yang, Gang

    2016-04-01

    Zr doped sample of Li4Ti4.99Zr0.01O12 (LZTO) and Li2ZrO3 (LZO) coated Li4Ti5O12 (LTO) are prepared by a solid-state method. The lattice structure of LTO is remained after doping element of Zr and coating layer of LZO. The crystal structure and electrochemical performance of the material are investigated by X-ray diffractometry (XRD), high-resolution transmission electron microscopy (HRTEM), cyclic voltammetry (CV), galvanostatic intermittent titration technique (GITT) and charge-discharge tests, respectively. Zr-doping and LZO coating play the positive role in improving the diffusion ability of lithium cations. LZTO and LZO-LTO show much improved specific capacity and rate capability compared with pristine sample of LTO. LZO-LTO has the smallest voltage differential (ΔV) of the redox peaks because the coating of Li2ZrO3 is helpful for the diffusion ability of lithium ions during charge/discharge processes. LZTO and LZO-LTO as electrode deliver the initial capacities of 164.8, 168.1 mAh g-1, respectively, which are much higher than 150.2 mAh g-1 of intrinsic sample of LTO. Even at the current density of 2 A g-1, LTZO and LZO-LTO offer capacity of 96 and 106 mAh g-1, which are much higher than 33 mAh g-1 of LTO. The improved electrochemical performance is attributed to the improved diffusion ability of lithium. During the whole discharge process, the lowest value of LTO is 5.97 × 10-17 cm2 s-1 that is much lower than 7.80 × 10-16 cm2 s-1 in LZTO and 1.85 × 10-15 cm2 s-1 in LZO-LTO, respectively.

  4. In vitro degradation behavior and cytocompatibility of Mg–Zn–Zr alloys

    PubMed Central

    Huan, Z. G.; Leeflang, M. A.; Fratila-Apachitei, L. E.; Duszczyk, J.

    2010-01-01

    Zinc and zirconium were selected as the alloying elements in biodegradable magnesium alloys, considering their strengthening effect and good biocompatibility. The degradation rate, hydrogen evolution, ion release, surface layer and in vitro cytotoxicity of two Mg–Zn–Zr alloys, i.e. ZK30 and ZK60, and a WE-type alloy (Mg–Y–RE–Zr) were investigated by means of long-term static immersion testing in Hank’s solution, non-static immersion testing in Hank’s solution and cell-material interaction analysis. It was found that, among these three magnesium alloys, ZK30 had the lowest degradation rate and the least hydrogen evolution. A magnesium calcium phosphate layer was formed on the surface of ZK30 sample during non-static immersion and its degradation caused minute changes in the ion concentrations and pH value of Hank’s solution. In addition, the ZK30 alloy showed insignificant cytotoxicity against bone marrow stromal cells as compared with biocompatible hydroxyapatite (HA) and the WE-type alloy. After prolonged incubation for 7 days, a stimulatory effect on cell proliferation was observed. The results of the present study suggested that ZK30 could be a promising material for biodegradable orthopedic implants and worth further investigation to evaluate its in vitro and in vivo degradation behavior. PMID:20532960

  5. MRI compatible Nb-Ta-Zr alloys used for vascular stents: optimization for mechanical properties.

    PubMed

    Li, Hui-Zhe; Xu, Jian

    2014-04-01

    With the increased usage of magnetic resonance imaging (MRI) as a diagnostic tool in clinic, the currently-used metals for vascular stents, such as 316L stainless steel (SS), Co-Cr alloys and Ni-Ti alloys, are challenged by their unsatisfactory MRI compatibility, due to their constituents containing ferromagnetic elements. To provide more MRI compatible vascular stents, the Nb-xTa-2Zr (30≤x≤70) series alloys were selected in the current work. Several key properties of these alloys were optimized in terms of stent requirements, including magnetic susceptibility, elastic modulus and tensile properties. In the as-cast state, a single-phase solid solution with bcc structure was formed in the alloys. The volume magnetic susceptibility (χv) and Young's modulus (E) of the alloys scaled linearly with the Ta content. Increasing the Ta content gave rise to the decreased χv and the increased E, together with the elevated yield strength but less-changed elongation. From multiple requirements for the stents, the Nb-60Ta-2Zr alloy exhibits an optimal properties, including the χv of about 3% of the 316L SS, the E of 142GPa superior to pure niobium, high mass density of 12.03g/cm(3) favored to the X-ray visibility, yield strength of ~330MPa comparable to the 316L SS and a elongation of ~24%. These remarkable advantages make it quite promising as a new candidate of stent metals.

  6. Signature spectrale des grains interstellaires.

    NASA Astrophysics Data System (ADS)

    Léger, A.

    Notre connaissance de la nature des grains interstellaires reposait sur un nombre très restreint de signatures spectrales dans la courbe d'extinction du milieu interstellaire. Une information considérable est contenue dans les 40 bandes interstellaires diffuses dans le visible, mais reste inexploitée. L'interprétation récente des cinq bandes IR en émission, en terme de molécules d'hydrocarbures aromatiques polycycliques, est développée. Elle permet l'utilisation d'une information spectroscopique comparable, à elle seule, à ce sur quoi était basée jusqu'alors notre connaissance de la matière interstellaire condensée. Différentes implications de cette mise en évidence sont proposées.

  7. ZrCoCe Getter Films for MEMS Vacuum Packaging

    NASA Astrophysics Data System (ADS)

    Xu, Yaohua; Cui, Jiandong; Cui, Hang; Zhou, Hao; Yang, Zhimin; Du, Jun

    2016-01-01

    In order to specifically support the technology trend of increased miniaturization of micro electro mechanical systems (MEMS) devices, highly porous ZrCoCe non-evaporable getter (NEG) film has been produced by direct current magnetron sputtering from a preformed ZrCoCe alloy target. Scanning electron microscopy and x-ray diffraction analysis indicated that the ZrCoCe film is constructed with porous columnar crystals, which are further built up with assembled ZrCoCe amorphous or nanocrystalline grains with an average grain size of 5 nm. Gas sorption investigation shows that this film can be activated at a low temperature of 300°C for 30 min and has excellent stable sorption characteristics. Sorption properties can be further improved with elevating activation temperatures due to nanocrystals growing and amorphous regions crystallizing. The capability of ZrCoCe films to withstand wafer physical or chemical cleaning processes is investigated, indicating their compatibility with MEMS vacuum packaging and the appropriate way to store them.

  8. An experimental thermodynamic study of the Pd-Zr system

    SciTech Connect

    Selhaoui, N.; Gachon, J.C. . Lab. de Thermodynamique Metallurgique)

    1991-01-01

    The four solid intermediate compounds in the PdZr system have been submitted to direct reaction calorimetry to determine their enthalpies of formation. Results are as follows: Pd[sub 0.33]Zr[sub 0.67] [Delta]H[sub f] (1,273 K) [minus]48,000 J/mol of atoms; Pd[sub 0.50]Zr[sub 0.50] [Delta]H[sub f] (1,667 K) = [minus]62,000 J/mol of atoms; Pd[sub 0.76]Zr[sub 0.33] [Delta]H[sub f] (1,573 K) = [minus]85,000 J/mol of atoms; and Pd[sub 0.75]Zr[sub 0.25] [Delta]H[sub f] (1,573 K) = [minus]82,800 J/mol of atoms. Experiments are briefly described and the results are given and compared to those of the literature.

  9. Spin-dependent tunnel junctions with ZrOx barriers

    NASA Astrophysics Data System (ADS)

    Wang, Jianguo; Freitas, P. P.; Snoeck, E.; Wei, P.; Soares, J. C.

    2001-12-01

    Spin-dependent tunnel junctions with crystalline ZrOx barriers were fabricated, with tunnel magnetoresistance (TMR) reaching 20% and a resistance×area product of 24 k Ω μm2, after annealing at 260 °C. Effective barrier height and thickness are 1.6 eV and 10.6 Å, respectively. The ZrOx barriers were fabricated by rf plasma oxidation of a 5 Å thick Zr layer. High-resolution transmission electron microscopy and Rutherford backscattering spectrometry were used to characterize the as-deposited barrier. Both ZrO and ZrO2 phases are present, together with (CoFe)Ox. Upon annealing, the interfacial oxygen moves into the barrier, resulting in an increase of TMR from 2% to 19.2%, an increase of barrier height from 0.3 to 1.6 eV, and a reduction of barrier thickness from 18.5 to 10.5 Å.

  10. Hydriding of TiZrNiFe nanocompounds

    NASA Astrophysics Data System (ADS)

    Żywczak, A.; Shinya, Daigo; Gondek, Ł.; Takasaki, Akito; Figiel, H.

    2010-01-01

    Ti-based quasicrystals belong to the second largest group of the stable quasicrystals, showing attractive properties as hydrogen storage materials. The Ti 45Zr 38Ni 17 intermetallic compound forms an icosahedral ( i-phase) structure, in which Ti and Zr atoms possess very good chemical affinity for hydrogen absorption. We modified the Ti 45Zr 38Ni 17 compounds by substituting 3d metals (iron) for Ni to obtain amorphous phase. The samples were produced by mechanical alloying. The 3d metal atoms are located in the same positions as nickel. The structural characterization was made by means of XRD measurements. Thermodynamic properties were studied by differential scanning calorimetry (DSC) and thermal desorption spectroscopy (TDS). The obtained amorphous phases Ti 45Zr 38Ni (9,13)Fe (8,4) transform to the i-phase at the similar temperature range as Ti 45Zr 38Ni 17. The final concentration of absorbed hydrogen depends on the amount of Fe. When increasing the amount of iron, the hydrogen release temperature becomes lower. After hydriding, the samples decompose into simple metal hydrides.

  11. Microstructure and Mechanical Properties of Microwave Sintered ZrO2 Bioceramics with TiO2 Addition

    PubMed Central

    Chou, Jyh-Horng

    2016-01-01

    The microwave sintered zirconia ceramics with 0, 1, 3, and 5 wt% TiO2 addition at a low sintering temperature of 1300°C and a short holding time of 1 hour were investigated. Effect of contents of TiO2 addition on microstructure and mechanical properties of microwave sintered zirconia bioceramics was reported. In the sintered samples, the main phase is monoclinic zirconia (m-ZrO2) phase and minor phase is tetragonal zirconia (t-ZrO2) phase. The grain sizes increased with increasing the TiO2 contents under the sintering temperature of 1300°C. Although the TiO2 phase was not detected in the XRD pattern, Ti and O elements were detected in the EDS analysis. The presence of TiO2 effectively improved grain growth of the ZrO2 ceramics. The Vickers hardness was in the range of 125 to 300 Hv and increased with the increase of TiO2 contents. Sintering temperature dependence on the Vickers hardness was also investigated from 1150°C to 1300°C, showing the increase of Vickers hardness with the increase of the sintering temperature as well as TiO2 addition. PMID:27504072

  12. Microstructure and Mechanical Properties of Microwave Sintered ZrO2 Bioceramics with TiO2 Addition.

    PubMed

    Kuo, Hsien-Nan; Chou, Jyh-Horng; Liu, Tung-Kuan

    2016-01-01

    The microwave sintered zirconia ceramics with 0, 1, 3, and 5 wt% TiO2 addition at a low sintering temperature of 1300°C and a short holding time of 1 hour were investigated. Effect of contents of TiO2 addition on microstructure and mechanical properties of microwave sintered zirconia bioceramics was reported. In the sintered samples, the main phase is monoclinic zirconia (m-ZrO2) phase and minor phase is tetragonal zirconia (t-ZrO2) phase. The grain sizes increased with increasing the TiO2 contents under the sintering temperature of 1300°C. Although the TiO2 phase was not detected in the XRD pattern, Ti and O elements were detected in the EDS analysis. The presence of TiO2 effectively improved grain growth of the ZrO2 ceramics. The Vickers hardness was in the range of 125 to 300 Hv and increased with the increase of TiO2 contents. Sintering temperature dependence on the Vickers hardness was also investigated from 1150°C to 1300°C, showing the increase of Vickers hardness with the increase of the sintering temperature as well as TiO2 addition.

  13. Investigations in the phase system Li-MgO-Y-Zr with respect to defect forming and catalytic performance

    NASA Astrophysics Data System (ADS)

    Berthold, A.; Mitdank, R.; Simon, U.; Arndt, S.; Schubert, H.

    2013-07-01

    The phase systems Li-MgO-Zr and Li-MgO-Y-Zr have been investigated in order to determine the influence of transition metal ion doping (TMI) and additional doping with high ion- radius ion, and their effect on the defect concentration as well as the Li fixation in the lattice. Many investigation methods have been used and just the combination of these methods enabled a complete understanding. So, with respect to similar publications only by the combination of UV-VIS and Rutherford Backscattered spectroscopy (RBS) separate bands for Li, ZrO2 and MgO could be identified. This work is a first approach to investigate the material from physical and chemical point of view. The incorporation of TMI stabilizes the Li in the structure whereas the addition of a rare earth element seems to cause a reduced Li solubility.Due to the incorporation of higher valent ions vacancies in the lattice are formed and thus the amount of Li can be increased. Thus the catalytic activity and performance can be enhanced. Long time stability of the catalytic performance was tested up to 40 h on stream.

  14. Influence of bilayer period on the characteristics of nanometre-scale ZrN/TiAIN multilayers.

    PubMed

    Vladescu, A; Kiss, A; Popescu, A; Braic, M; Balaceanu, M; Braic, V; Tudor, I; Logofatu, C; Negrila, C C; Rapeanu, R

    2008-02-01

    In the last decade, considerable research effort was directed to the deposition of multilayer films with layer thicknesses in the nanometer range (superlattice coatings), in order to increase the performance of various cutting tools and machine parts. The goal of the present work was to investigate the main microstructural, mechanical and wear resistance characteristics of a superlattice coating, consisting of alternate multilayer ZrN/TiAIN films, with various bilayer periods (5 / 20 nm). The coatings were deposited by the cathodic arc method on Si, plain carbon steel and high speed steel substrates to be used as wear resistance surfaces. The multilayer structures were prepared by using shutters placed in front of each cathode (Zr and Ti+Al). The characteristics of multilayer structures (elemental and phase composition, texture, Vickers microhardness, thickness, adhesion, and wear resistance) were determined by using various techniques (AES, XPS, XRD, microhardness measurements, scratch, and tribological tests). A comparison with the properties of ZrN and TiAIN single-layer coatings was carried out.

  15. Mechanical characterization and modeling of brazed tungsten and Cu-Cr-Zr alloy using stress relief interlayers

    NASA Astrophysics Data System (ADS)

    Qu, Dandan; Zhou, Zhangjian; Yum, Youngjin; Aktaa, Jarir

    2014-12-01

    A rapidly solidified foil-type Ti-Zr based amorphous filler with a melting temperature of 850 °C was used to braze tungsten to Cu-Cr-Zr alloy for water cooled divertors and plasma facing components application. Brazed joints of dissimilar materials suffer from a mismatch in coefficients of thermal expansion. In order to release the residual stress caused by the mismatch, brazed joints of tungsten and Cu-Cr-Zr alloy using different interlayers were studied. The shear strength tests of brazed W/Cu joints show that the average strength of the joint with a W70Cu30 composite plate interlayer reached 119.8 MPa, and the average strength of the joint with oxygen free high conductivity copper (OFHC Cu)/Mo multi-interlayers reached 140.8 MPa, while the joint without interlayer was only 16.6 MPa. Finite element method (FEM) has been performed to investigate the stress distribution and effect of stress relief interlayers. FEM results show that the maximum von Mises stress occurs in the tungsten/filler interface and that the filler suffers the peak residual stresses and becomes the weakest zone. And the use of OFHC Cu/Mo multi-interlayers can reduce the residual stress significantly, which agrees with the mechanical experiment data.

  16. The effect of heat treatment on amorphous Fe74Zr19Ta7 and Fe90Y10 alloys

    NASA Astrophysics Data System (ADS)

    Prater, J. T.; Merz, M. D.

    1981-03-01

    Magnetic measurements are reported for two iron-based amorphous alloys: Fe90Y10 and Fe74Zr19Ta7. Each is prepared by sputter deposition. X-tay diffraction is used to established the amorphous structure and X-ray fluorescence analysis to confirm the composition. Fe74Zr19Ta7 has a Curie temperature of 195 K and a crystallization temperature of 733 K (460 °C). Annealing studies on Fe74Zr19Ta7 indicate that this alloy does not show the dramatic increases in Curie temperature that are commonly observed in amorphous alloys that contain metalloid elements. Rather, this alloy exhibits small irreversible decreases in the Curie temperature following heat treatments up to 733 K (460 °C), the crystallization temperature. The amorphous Fe90Y10 alloy shows only short range order and has a large anisotropy field that prevents the saturation of the magnetic moment in a 10 kOe field at 78 K. The anisotropy decreases upon crystallization to a bcc iron structure, but ferromagnetism is observed only after annealing the alloy at elevated temperatures.

  17. Microstructures and Stability Origins of β-(Ti,Zr)-(Mo,Sn)-Nb Alloys with Low Young's Modulus

    NASA Astrophysics Data System (ADS)

    Wang, Qing; Li, Qun; Li, Xiaona; Zhang, Ruiqian; Gao, Xiaoxia; Dong, Chuang; Liaw, Peter K.

    2015-09-01

    The present work investigates the microstructural evolution and β-phase stability of a multi-component [(Mo,Sn)-(Ti,Zr)14]-Nb alloy series developed using the cluster-plus-glue-atom model. Low Young's modulus ( E) can be reached, when both low- E elements, Sn and Zr, and β-Ti stabilizers, Mo and Nb, are properly incorporated in the so-called cluster formulas. After the X-ray diffraction and transmission electron microscopy analysis, and in combination with the β-Ti stability measured by the Mo equivalent, the Young's modulus of β-Ti alloys is found to increase with increasing β stabilities and is closely related to both the microstructures of the β matrix and the precipitated phases. More importantly, the morphologies of the β matrix change with β stabilities apparently so that high- E ( E >70 GPa) and low- E ( E ≤70 GPa) β-Ti alloys can be distinguished with the microstructures of the β matrix. The quinary alloy, formulated as [(Mo0.5Sn0.5)-(Ti13Zr1)]Nb1, owns its lowest E of 48 GPa among the present alloy series to the mixed thin-lamellar and rod-shaped morphology of the β structure with the lowest stability for the β formation.

  18. Doping Li and K into Na2ZrO3 Sorbent to Improve Its CO2 Capture Capability

    NASA Astrophysics Data System (ADS)

    Duan, Yuhua

    Carbon dioxide is one of the major combustion products which once released into the air can contribute to global climate change. Solid sorbents have been reported in several previous studies to be promising candidates for CO2 sorbent applications due to their high CO2 absorption capacities at moderate working temperatures. However, at a given CO2 pressure, the turnover temperature (Tt) of an individual solid capture CO2 reaction is fixed and may be outside the operating temperature range (ΔTo) for a particularly capture technology. In order to shift such Tt for a solid into the range of ΔTo, its corresponding thermodynamic property must be changed by changing its structure by reacting (mixing) with other materials or doping with other elements. As an example, by combining thermodynamic database searching with ab initio thermodynamics calculations, in this work, we explored the Li- and K-doping effects on the Tt shifts of Na2ZrO3 at different doping levels. The obtained results showed that compared to pure Na2ZrO3, the Li- and K-doped mixtures Na2-αMαZrO3 (M =Li, K) have lower Tt and higher CO2 capture capacities.

  19. Synthesis of Carboxylate Cp*Zr(IV) Species: Toward the Formation of Novel Metallocavitands.

    PubMed

    Daigle, Maxime; Bi, Wenhua; Légaré, Marc-André; Morin, Jean-François; Fontaine, Frédéric-Georges

    2015-06-01

    With the intent of generating metallocavitands isostructural to species [(CpZr)3(μ(3)-O)(μ(2)-OH)3(κO,O,μ(2)-O2C(R))3](+), the reaction of Cp*2ZrCl2 and Cp*ZrCl3 with phenylcarboxylic acids was carried out. Depending on the reaction conditions, five new complexes were obtained, which consisted of Cp*2ZrCl(κ(2)-OOCPh) (1), (Cp*ZrCl(κ(2)-OOCPh))2(μ-κ(2)-OOCPh)2 (2), [(Cp*Zr(κ(2)-OOCPh))2(μ-κ(2)-OOCPh)2(μ(2)-OH)2]·Et2O (3·Et2O), [[Cp*ZrCl2](μ-Cl)(μ-OH)(μ-O2CC6H5)[Cp*Zr

  20. Transmission electron microscopy study of the microstructure of a Ti–Fe–Zr alloy

    SciTech Connect

    Cao, G.H.; Liu, N.; Peng, J.C.; Li, X.; Shen, G.J.; Russell, A.M.

    2013-09-15

    A Ti–35Fe–30Zr (at.%) alloy was prepared by cold crucible levitation melting, and its microstructure was characterized. Electron microscope observations revealed a microstructure with a bi-modal phase size distribution. One phase was identified as a monoclinic TiFeZr compound with lattice parameters a = 0.895 nm, b = 0.502 nm, c = 0.969 nm, and α = 119.4° in C2 (space group). A bcc β-TiZr phase with lattice parameter a = 0.341 nm coexisted with the monoclinic phase. The mechanisms of phase formation are discussed. - Highlights: • Monoclinic TiFeZr phase was observed in as-cast Ti–35Fe–30Zr (at.%) alloy. • The space group of monoclinic TiFeZr phase is C2. • The β-TiZr phase formed in as-cast Ti–35Fe–30Zr alloy.

  1. Microstructure changes caused by annealing of U-Pu-Zr alloys

    NASA Astrophysics Data System (ADS)

    Janney, Dawn E.; Sencer, Bulent H.

    2017-04-01

    Thermally induced microstructural changes in five uranium-plutonium-zirconium alloys (38U-22Pu-40Zr, 49U-19Pu-32Zr, 33U-27Pu-40Zr, 19U-41Pu-40Zr, and 20U-12Pu-68Zr, compositions in at%) were examined by comparing as-cast alloys with alloys that had been annealed at 500 °C for 168 h using scanning electron microscopy. All of the as-cast and annealed alloys had high-Zr inclusions not predicted from currently available phase diagrams. Microstructures in all alloys except U-12Pu-68Zr demonstrate increasing development of irregularly shaped polygons with high-actinide, low-Zr boundaries as a result of annealing.

  2. Effect of Zr, Nb and Ti addition on injection molded 316L stainless steel for bio-applications: Mechanical, electrochemical and biocompatibility properties.

    PubMed

    Gulsoy, H Ozkan; Pazarlioglu, Serdar; Gulsoy, Nagihan; Gundede, Busra; Mutlu, Ozal

    2015-11-01

    The research investigated the effect of Zr, Nb and Ti additions on mechanical, electrochemical properties and biocompatibility of injection molded 316L stainless steel. Addition of elemental powder is promoted to get high performance of sintered 316L stainless steels. The amount of additive powder plays a role in determining the sintered microstructure and all properties. In this study, 316L stainless steel powders used with the elemental Zr, Nb and Ti powders. A feedstock containing 62.5 wt% powders loading was molded at different injection molded temperature. The binders were completely removed from molded components by solvent and thermal debinding at different temperatures. The debinded samples were sintered at 1350°C for 60 min. Mechanical, electrochemical property and biocompatibility of the sintered samples were performed mechanical, electrochemical, SBF immersion tests and cell culture experiments. Results of study showed that sintered 316L and 316L with additives samples exhibited high corrosion properties and biocompatibility in a physiological environment.

  3. Mercury, elemental

    Integrated Risk Information System (IRIS)

    Mercury , elemental ; CASRN 7439 - 97 - 6 Human health assessment information on a chemical substance is included in the IRIS database only after a comprehensive review of toxicity data , as outlined in the IRIS assessment development process . Sections I ( Health Hazard Assessments for Noncarcinoge

  4. Element Research.

    ERIC Educational Resources Information Center

    Herald, Christine

    2001-01-01

    Describes a research assignment for 8th grade students on the elements of the periodic table. Students use web-based resources and a chemistry handbook to gather information, construct concept maps, and present the findings to the full class using the mode of their choice: a humorous story, a slideshow or gameboard, a brochure, a song, or skit.…

  5. B Removal by Zr Addition in Electromagnetic Solidification Refinement of Si with Si-Al Melt

    NASA Astrophysics Data System (ADS)

    Lei, Yun; Ma, Wenhui; Sun, Luen; Dai, Yongnian; Morita, Kazuki

    2016-02-01

    This study investigated a new process of enhancing B removal by adding small amounts of Zr in the electromagnetic solidification refinement of Si with Si-Al melt. B in Si was removed by as much as 97.2 pct by adding less than 1057 ppma Zr, and the added Zr was removed by as much as 99.7 pct. In addition, Zr is more effective in enhancing B removal than Ti in the same electromagnetic solidification refining process.

  6. Effects of hydroxyapatite/Zr and bioglass/Zr coatings on morphology and corrosion behaviour of Rex-734 alloy.

    PubMed

    Say, Y; Aksakal, B

    2016-06-01

    To improve corrosion resistance of metallic implant surfaces, Rex-734 alloy was coated with two different bio-ceramics; single-Hydroxyapatite (HA), double-HA/Zirconia(Zr) and double-Bioglass (BG)/Zr by using sol-gel method. Porous surface morphologies at low crack density were obtained after coating and sintering processes. Corrosion characteristics of coatings were determined by Open circuit potential and Potentiodynamic polarization measurements during corrosion tests. Hardness and adhesion strength of coating layers were measured and their surface morphologies before and after corrosion were characterized by scanning electron microscope (SEM), XRD and EDX. Through the SEM analysis, it was observed that corrosion caused degradation and sphere-like formations appeared with dimples on the coated surfaces. The coated substrates that exhibit high crack density, the corrosion was more effective by disturbing and transmitting through the coating layer, produced CrO3 and Cr3O8 oxide formation. It was found that the addition of Zr provided an increase in adhesion strength and corrosion resistance of the coatings. However, BG/Zr coatings had lower adhesion strength than the HA/Zr coatings, but showed higher corrosion resistance.

  7. An automated system for production of 89Zr

    NASA Astrophysics Data System (ADS)

    Wooten, A. L.; Schweitzer, G. D.; Lawrence, L. A.; Madrid, E.; Lapi, S. E.

    2012-12-01

    We have developed an automated system for routine production of 89Zr. This system has automated a separation process from the literature that uses a hydroxamate resin column to purify 89Zr from an 89Y target. We have designed this system to give production personnel control over every step in the process through an easy to-use graphical user interface (GUI) that also gives step-by-step instructions for the process. This system is currently transitioning from its testing phase at low activities, so further testing and improvements are planned to increase product recovery and to improve the consistency of its product. To date production runs on the order of 10 mCi of 89Zr have been tested, and effective specific activities of 545 mCi/μmol and radionuclidic purity greater than 99.99% have been achieved.

  8. Light-Controlled ZrO2 Surface Hydrophilicity

    PubMed Central

    Rudakova, Aida V.; Maevskaya, Maria V.; Emeline, Alexei V.; Bahnemann, Detlef W.

    2016-01-01

    In recent years many works are aimed at finding a method of controllable switching between hydrophilicity and hydrophobicity of a surface. The hydrophilic surface state is generally determined by its energy. Change in the surface energy can be realized in several different ways. Here we report the ability to control the surface wettability of zirconium dioxide nano-coatings by changing the composition of actinic light. Such unique photoinduced hydrophilic behavior of ZrO2 surface is ascribed to the formation of different active surface states under photoexcitation in intrinsic and extrinsic ZrO2 absorption regions. The sequential effect of different actinic lights on the surface hydrophilicity of zirconia is found to be repeatable and reversibly switchable from a highly hydrophilic state to a more hydrophobic state. The observed light-controllable reversible and reproducible switching of hydrophilicity opens new possible ways for the application of ZrO2 based materials. PMID:27703174

  9. Isotopic composition of a sample enriched in 93Zr

    DOE PAGES

    Fujii, Toshiyuki; Hori, Jun-ichi; Du, Miting; ...

    2015-10-22

    A project to determine the neutron-capture cross section of long lived fission products and minor actinides has been started by using a beam-line at Japan Proton Accelerator Research Complex (J-PARC). We prepared one of the target nuclides is Zr-93, which in Oak Ridge National Laboratory. Qualitative and quantitative analyses on the sample were performed at Kyoto University. The isotopic composition of (m) Zr (m 90, 91, 92, 93, 94, and 96) was precisely determined by multi-collector thermal ionization mass spectrometry with < 0.1 % of 2 sigma uncertainty. We determined that the atomic abundance of Zr-93 in the sample tomore » be 18.86 ± A 0.05 %.« less

  10. Glass forming in La2O3-TiO2-ZrO2 ternary system by containerless processing

    NASA Astrophysics Data System (ADS)

    Kaneko, Masashi; Kentei Yu, Yu; Kumar, Vijaya; Masuno, Atsunobu; Inoue, Hiroyuki; Odawara, Osamu; Yoda, Shinichi

    The containerless processing is an appropriate method to create new glasses, because it sup-presses nucleation at the boundary between liquid and crucible during solidification and it enables molten samples to be solidified without crystallization. Recently, we have succeeded in forming BaTi2 O5 glass in the bulk state by using an aerodynamic levitation furnace. BaTi2 O5 glass includes no traditional glass network former and it possesses high electric permittivity [1, 2]. From the point of view of optical application, BaTi2 O5 glass has high refractive indices over 2.1. BaTi2 O5 glass, however, vitrify only in a small sphere, and it crystallize when its diameter exceed 1.5 mm. In order to synthesize new titanate oxide glasses which possess higher refractive indices and larger diameter than BaTi2 O5 , La and Zr can be used as substitutive components. When Ba is replaced with La, refractive indices are expected to increase because of the heavier element. The addition of a third element is thought to be effective for enhance-ment of glass formation ability and Zr can be a candidate because Ti and Zr are homologous. In this research, we have succeeded in forming new bulk glass in La2 O3 -TiO2 -ZrO2 ternary system by means of the aerodynamic levitation furnace. We investigated the glass forming region, thermal properties and optical properties of La2 O3 -TiO2 -ZrO2 glass. Glass transition temperature, crystallization temperature, density, refractive indices and transmittance spectra were varied depending on the chemical composition. Reference [1] J. Yu et al, "Fabrication of BaTi2O5 Glass-Ceramics with Unusual Dielectric Properties during Crystallization", Chem-istry of Materials, 18 (2006) 2169-2173. [2] J. Yu et al., "Comprehensive Structural Study of Glassy and Metastable Crystalline BaTi2O5", Chemistry of Materials, 21 (2009) 259-263.

  11. Dimensionality variations in new zirconium iodates: hydrothermal syntheses, structural determination, and characterization of BaZr(IO₃)₆ and K₂Zr(IO₃)₆.

    PubMed

    Ahn, Hyun Sun; Lee, Dong Woo; Ok, Kang Min

    2014-07-21

    Two new quaternary zirconium iodates, BaZr(IO3)6 and K2Zr(IO3)6, have been synthesized through hydrothermal reactions using BaCO3 (or K2CO3), ZrO2, and HIO3 as reagents. Single crystal and powder X-ray diffraction were used to determine crystal structures of the compounds. BaZr(IO3)6 exhibits infinite bands that are composed of ZrO7 pentagonal bipyramids and IO3 trigonal pyramids, in which Ba(2+) cations are sandwiched by the bands. K2Zr(IO3)6 exhibits a molecular structure that is composed of ZrO6 octahedra and IO3 groups. The dimensionality variations seem to be attributable to the flexible coordination numbers of Zr(4+) cations with large ionic radii as well as the number of counter cations. Both of the materials are thermally stable up to approximately 440-450 °C and decompose to the corresponding metal zirconium oxides above these temperatures. The band gaps for BaZr(IO3)6 and K2Zr(IO3)6 are calculated to be 3.1 and 3.0 eV, respectively, using the (K/S)-versus-E plots obtained from the UV-vis diffuse reflectance spectra. Infrared spectra and local dipole moment calculations are also presented.

  12. Mechanical Properties Evaluation of Zr Addition in L12-Al3(Sc1- x Zr x ) Using First-Principles Calculation

    NASA Astrophysics Data System (ADS)

    Qian, Yi; Xue, Jilai; Wang, Zengjie; Yang, Zhenhai; Qian, Ping

    2016-05-01

    L12-Al3(Sc1- x Zr x ) can be used as a grain refiner and recrystallization inhibitor in forming and heat-treatment of wrought aluminum alloy. In this work, the mechanical properties of L12-Al3(Sc1- x Zr x ) (0 < x< 0.5) have been systematically evaluated using first principles calculations. The optimized structural parameters obtained through the virtual crystal approximation were in good agreement with available experimental and calculated data. The computed bulk modulus of L12-Al3(Sc1- x Zr x ) increased while the shear modulus and Young's modulus decreased with increasing Zr addition. The ductility of L12-Al3(Sc1- x Zr x ) estimated by Pugh empirical criterion and Cauchy pressure were improved with Zr addition. The calculated ideal strength of L12-Al3(Sc1- x Zr x ) along the [001], [110] and { 111} [1bar{1}0] directions increased linearly with Zr additions. The addition of Zr gave great improvements in the ideal strength along the [110] direction and the ductility in the [001] direction, respectively. The calculated electronic density of states and the charge density distribution revealed that the valence electron increased with Zr addition and hence strengthened the p-d covalent bonding and d-d bonding, resulting in the improvements in ideal strength and ductility. The evaluation data would be useful in materials design and process optimization for Al alloys in forming and heat treatment.

  13. In situ studies of oxidation of ZrB2 and ZrB2-SiC composites at high temperatures

    SciTech Connect

    Sarin, P; Driemeyer, P E; Haggerty, R P; Kim, D -K; Bell, J L; Apostolov, Z D; Kriven, W M

    2010-08-27

    High temperature oxidation of ZrB2 and the effect of SiC on controlling the oxidation of ZrB2 in ZrB2-SiC composites were studied in situ, in air, using X-ray diffraction. Oxidation was studied by quantitatively analyzing the crystalline phase changes in the samples, both non-isothermally, as a function of temperature, up to ~1650 ºC, as well as isothermally, as a function of time, at ~1300 ºC. During the non-isothermal studies, the formation and transformation of intermediate crystalline phases of ZrO2 were also observed. The change in SiC content, during isothermal oxidation studies of ZrB2-SiC composites, was similar in the examined temperature range, regardless of sample microstructure and composition. Higher SiC content, however, markedly retarded the oxidation rate of the ZrB2 phase in the composites. A novel approach to quantify the extent of oxidation by estimating the thickness of the oxidation layer formed during oxidation of ZrB2 and ZrB2-SiC composites, based on fractional conversion of ZrB2 to ZrO2 in situ, is presented.

  14. Antennes imprimées multicouches : choix des fonctions de base dans la méthode des moments

    NASA Astrophysics Data System (ADS)

    Bennegueouche, J.; Damiano, J. P.; Papiernik, A.

    1993-03-01

    We present a theoretical method applied to the analysis of multilayered printed antennas with disc radiating elements, fed by coaxial probe. The method is based on a reaction integral equation solved in the spectral domain using the method of moments (Galerkin's method). The choice of the basis functions is crucial. We study the theoretical ponderation of these functions in a wide frequency band is done to yield more precise numerical results with a reduced computational time. Finally, it shows better agreement with the experimental data. Nous présentons une méthode théorique pour l'étude des antennes imprimées multicouches à éléments rayonnants de forme circulaire, alimentés par sonde coaxiale. La méthode est basée sur une équation intégrale de réaction, résolue dans le domaine spectral, à l'aide d'une méthode des moments (méthode de Galerkin). L'objectif est d'obtenir les caractéristiques radioélectriques de l'antenne : impédance d'entrée, diagrainme de rayonnement, gain, etc. Le choix des fonctions de base est un critère important. Nous avons réalisé une étude théorique de la pondération de ces fonctions sur une large bande de fréquence, d'où des résultats théoriques plus précis, un temps de calcul réduit et un accord théorie-expérience meilleur.

  15. First-principles study on the effect of alloying elements on the elastic deformation response in β-titanium alloys

    NASA Astrophysics Data System (ADS)

    Gouda, Mohammed K.; Nakamura, Koichi; A. H. Gepreel, Mohamed

    2015-06-01

    Theoretical deformation response of hypothetical β-titanium alloys was investigated using first-principles calculation technique under periodic boundary conditions. Simulation was carried out on hypothetical 54-atom supercell of Ti-X (X = Cr, Mn, Fe, Zr, Nb, Mo, Al, and Sn) binary alloys. The results showed that the strength of Ti increases by alloying, except for Cr. The most effective alloying elements are Nb, Zr, and Mo in the current simulation. The mechanism of bond breaking was revealed by studying the local structure around the alloying element atom with respect to volume change. Moreover, the effect of alloying elements on bulk modulus and admissible strain was investigated. It was found that Zr, Nb, and Mo have a significant effect to enhance the admissible strain of Ti without change in bulk modulus.

  16. First-principles study on the effect of alloying elements on the elastic deformation response in β-titanium alloys

    SciTech Connect

    Gouda, Mohammed K. Gepreel, Mohamed A. H.; Nakamura, Koichi

    2015-06-07

    Theoretical deformation response of hypothetical β-titanium alloys was investigated using first-principles calculation technique under periodic boundary conditions. Simulation was carried out on hypothetical 54-atom supercell of Ti–X (X = Cr, Mn, Fe, Zr, Nb, Mo, Al, and Sn) binary alloys. The results showed that the strength of Ti increases by alloying, except for Cr. The most effective alloying elements are Nb, Zr, and Mo in the current simulation. The mechanism of bond breaking was revealed by studying the local structure around the alloying element atom with respect to volume change. Moreover, the effect of alloying elements on bulk modulus and admissible strain was investigated. It was found that Zr, Nb, and Mo have a significant effect to enhance the admissible strain of Ti without change in bulk modulus.

  17. Transport quantique dans des nanostructures

    NASA Astrophysics Data System (ADS)

    Naud, C.

    2002-09-01

    structure des oscillations de conductance en fonction du flux du champ magnétique de période h/e dont l'amplitude est beaucoup plus importante que celle mesurée sur un réseau carré de même dimension. Cette différence constitue une signature d'un effet de localisation induit par le champ magnétique sur la topologie mathcal{T}3. Pour des valeurs spécifiques du champ magnétique, du fait des interférences destructives Aharonov-Bohm, la propagation des fonctions d'ondes est limitée à un ensemble fini de cellule du réseau appelé cage. De la dépendance en température des oscillations de période h/e mesurées sur le réseau mathcal{T}3 nous avons tiré une longueur caractéristique qui peut être rattachée au périmètre des cages. Un phénomène inattendu fut l'observation, pour des champs magnétiques plus importants, d'un doublement de fréquence des oscillations. Ces oscillations de période h/2e pouvant avoir une amplitude supérieure aux oscillations de période h/e, une interprétation en terme d'harmonique n'est pas possible. Enfin, l'influence de la largeur électrique des fils constituant le réseau et donc celle du nombre de canaux par brin a été étudiée en réalisant des grilles électrostatique. Les variations de l'amplitude des signaux en h/e et h/2e en fonction de la tension de grille ont été mesurés.

  18. Crystallization Kinetics and Phase Transformation Mechanisms in Cu56Zr44 Glassy Alloy

    NASA Astrophysics Data System (ADS)

    Kalay, Ilkay; Kramer, Matthew J.; Napolitano, Ralph E.

    2015-08-01

    The kinetics and phase selection mechanisms involved in the crystallization of an amorphous Cu-Zr alloy of eutectic composition (Cu56Zr44) were investigated using in situ high-energy X-ray diffraction (HEXRD), transmission electron microscopy (TEM), and differential scanning calorimetry (DSC) under isothermal and constant heating rate conditions. In situ HEXRD results for 10 K/min (10 °C/min) heating indicate that the amorphous alloy devitrifies into CuZr2 and mainly Cu10Zr7 at the crystallization temperature of 725 K (452 °C). The sequence continues with the precipitation of CuZr (B2) at 1004 K (731 °C), where these three phases coexist until the decomposition of CuZr2 is observed at 1030 K (757 °C). The two equilibrium phases Cu10Zr7 and CuZr (B2) remain present on further heating until melting at the eutectic temperature for the Cu56Zr44 alloy. TEM investigation of the isothermal [705 K (432 °C)] crystallization sequence reveals primary nucleation and growth of the Cu10Zr7 phase, where growth of the Cu10Zr7 crystals is initially planar with a transition to a cellular morphology, associated with partitioning of Zr at the growth front. Related cellular structures and composition profiles are quantified.

  19. Evaluation of corrosion resistance of implant-use Ti-Zr binary alloys with a range of compositions.

    PubMed

    Akimoto, Teisuke; Ueno, Takeshi; Tsutsumi, Yusuke; Doi, Hisashi; Hanawa, Takao; Wakabayashi, Noriyuki

    2016-11-18

    Although titanium-zirconium (Ti-Zr) alloy has been adopted for clinical applications, the ideal proportion of Zr in the alloy has not been identified. In this study, we investigated the biocompatibility of Ti-Zr alloy by evaluating its corrosion resistance to better understand whether there is an optimal range or value of Zr proportion in the alloy. We prepared pure Ti, Ti-30Zr, Ti-50Zr, Ti-70Zr, and pure Zr (mol% of Zr) samples and subjected them to anodic polarization and immersion tests in a lactic acid + sodium chloride (NaCl) solution and artificial saliva. We observed pitting corrosion in the Ti-70Zr and Zr after exposure to both solutions. After the immersion test, we found that pure Ti exhibited the greatest degree of dissolution in the lactic acid + NaCl solution, with the addition of Zr dramatically reducing Ti ion dissolution, with the reduction ultimately exceeding 90% in the case of the Ti-30Zr. Hence, although the localized corrosion resistance under severe conditions was compromised when the Zr content was more than 70%, metal ion release reduced owing to Zr addition and the corresponding formation of a stable passive layer. The results suggest that Ti-30Zr or a Zr proportion of less than 50% would offer an ideal level of corrosion resistance for clinical applications. © 2016 Wiley Periodicals, Inc. J Biomed Mater Res Part B: Appl Biomater, 2016.

  20. Site preference of ternary alloying additions to NiTi: Fe, Pt, Pd, Au, Al, Cu, Zr and Hf

    NASA Technical Reports Server (NTRS)

    Bozzolo, Guillermo; Noebe, Ronald D.; Mosca, Hugo O.

    2004-01-01

    Atomistic modeling of the site substitution behavior of Pd in NiTi (J. Alloys and Comp. (2004), in press) has been extended to examine the behavior of several other alloying additions, namely, Fe, Pt, Au, Al, Cu, Zr and Hf in this important shape memory alloy. It was found that all elements, to a varying degree, displayed absolute preference for available sites in the deficient sublattice. How- ever, the energetics of the different substitutional schemes, coupled with large scale simulations indicate that the general trend in all cases is for the ternary addition to want to form stronger ordered structures with Ti.

  1. Impact de la preparation des anodes crues et des conditions de cuisson sur la fissuration dans des anodes denses

    NASA Astrophysics Data System (ADS)

    Amrani, Salah

    La fabrication de l'aluminium est realisee dans une cellule d'electrolyse, et cette operation utilise des anodes en carbone. L'evaluation de la qualite de ces anodes reste indispensable avant leur utilisation. La presence des fissures dans les anodes provoque une perturbation du procede l'electrolyse et une diminution de sa performance. Ce projet a ete entrepris pour determiner l'impact des differents parametres de procedes de fabrication des anodes sur la fissuration des anodes denses. Ces parametres incluent ceux de la fabrication des anodes crues, des proprietes des matieres premieres et de la cuisson. Une recherche bibliographique a ete effectuee sur tous les aspects de la fissuration des anodes en carbone pour compiler les travaux anterieurs. Une methodologie detaillee a ete mise au point pour faciliter le deroulement des travaux et atteindre les objectifs vises. La majorite de ce document est reservee pour la discussion des resultats obtenus au laboratoire de l'UQAC et au niveau industriel. Concernant les etudes realisees a l'UQAC, une partie des travaux experimentaux est reservee a la recherche des differents mecanismes de fissuration dans les anodes denses utilisees dans l'industrie d'aluminium. L'approche etait d'abord basee sur la caracterisation qualitative du mecanisme de la fissuration en surface et en profondeur. Puis, une caracterisation quantitative a ete realisee pour la determination de la distribution de la largeur de la fissure sur toute sa longueur, ainsi que le pourcentage de sa surface par rapport a la surface totale de l'echantillon. Cette etude a ete realisee par le biais de la technique d'analyse d'image utilisee pour caracteriser la fissuration d'un echantillon d'anode cuite. L'analyse surfacique et en profondeur de cet echantillon a permis de voir clairement la formation des fissures sur une grande partie de la surface analysee. L'autre partie des travaux est basee sur la caracterisation des defauts dans des echantillons d'anodes crues

  2. 89 Zr(n, γ) from a surrogate reaction approach

    NASA Astrophysics Data System (ADS)

    Ota, Shuya; Burke, J. T.; Casperson, R. J.; Escher, J. E.; Hughes, R. O.; Ressler, J. J.; Scielzo, N. D.; Thompson, I.; Austin, R. A. E.; McCleskey, E.; McCleskey, M.; Saastamoinen, A.; Benstead, J.; Ross, T.

    2014-09-01

    While recent studies have demonstrated the validity of the surrogate reaction approach for studying fission cross sections of short-lived actinides, its applicability for (n, γ) is still under investigation. We studied the γ-decay of 90Zr produced by 91Zr(p,d) in order to infer the 89Zr(n, γ) cross sections. The experiments were carried out at the K150 Cyclotron facility at Texas A&M University with a 28.5-MeV proton beam. The reaction deuterons were measured at forward angles of 30-60° with the STARS (Silicon Telescope Array for Reaction Studies) array of three segmented Micron S2 silicon detectors. Compound nuclei with energies up to a few MeV above the neutron separation thresholds were populated. The coincident γ-rays were measured with the LiTeR (Livermore Texas Richmond) array of five Compton-suppressed HPGe clovers. We will present results of γ-emission probabilities of 89Zr(n, γ) and some theoretical discussions. While recent studies have demonstrated the validity of the surrogate reaction approach for studying fission cross sections of short-lived actinides, its applicability for (n, γ) is still under investigation. We studied the γ-decay of 90Zr produced by 91Zr(p,d) in order to infer the 89Zr(n, γ) cross sections. The experiments were carried out at the K150 Cyclotron facility at Texas A&M University with a 28.5-MeV proton beam. The reaction deuterons were measured at forward angles of 30-60° with the STARS (Silicon Telescope Array for Reaction Studies) array of three segmented Micron S2 silicon detectors. Compound nuclei with energies up to a few MeV above the neutron separation thresholds were populated. The coincident γ-rays were measured with the LiTeR (Livermore Texas Richmond) array of five Compton-suppressed HPGe clovers. We will present results of γ-emission probabilities of 89Zr(n, γ) and some theoretical discussions. This work was performed under the auspices of the US Department of Energy by Lawrence Livermore National Laboratory

  3. Modellierung und Simulation des Substrat-Rauschens in integrierten RF CMOS-Schaltungen

    NASA Astrophysics Data System (ADS)

    Lin, L.; Xiong, J.; Mathis, W.

    2009-05-01

    Im integrierten CMOS-Schaltungsentwurf kann das Substrat-Rauschen, das vom digitalen Teil entsteht, die Funktionalität des analogen Teils stark beeinflussen. Es wird daher immer wichtiger, das Substrat als ein Medium der Rauschen-Propagation genau zu modellieren. Im vorliegenden Artikel wird ein auf der Finite Elemente Methode (FEM) und Modellordnungsreduktion (MOR) basiertes Modellierungsverfahren zur Admittanzen-Extraktion im Halbleitersubstrat vorgestellt. Nach der Diskretisierung mit FEM wird das Substrat im Allgemeinen als ein resistives/kapazitives Netz angesehen. Durch Bestimmung der Admittanz-Matrix und MOR ist es möglich ein äquivalentes Dreipol-Modell zwischen digitalem und analogem Teil über das Substrat zu bilden. Das Ergebnis der Modellierung wird dargestellt und mit numerischer Simulation des Substrat-Rauschens verglichen. Die Modellierung ermöglicht es, die Einflüsse des Substrat-Rauschens im Schaltungsentwurf zu berücksichtigen und so bestehende CMOS-Schaltungsarchitekturen zu optimieren.

  4. Multiscale Modeling of Grain Boundaries in ZrB2: Structure, Energetics, and Thermal Resistance

    NASA Technical Reports Server (NTRS)

    Lawson, John W.; Daw, Murray S.; Squire, Thomas H.; Bauschlicher, Charles W., Jr.

    2012-01-01

    A combination of ab initio, atomistic and finite element methods (FEM) were used to investigate the structures, energetics and lattice thermal conductance of grain boundaries for the ultra high temperature ceramic ZrB2. Atomic models of idealized boundaries were relaxed using density functional theory. Information about bonding across the interfaces was determined from the electron localization function. The Kapitza conductance of larger scale versions of the boundary models were computed using non-equilibrium molecular dynamics. The interfacial thermal parameters together with single crystal thermal conductivities were used as parameters in microstructural computations. FEM meshes were constructed on top of microstructural images. From these computations, the effective thermal conductivity of the polycrystalline structure was determined.

  5. Magnetic leverage effects in amorphous SmCo/CoAlZr heterostructures

    SciTech Connect

    Procter, R. A. Hase, T. P. A.; Magnus, F.; Andersson, G.; Hjörvarsson, B.; Sánchez-Hanke, C.

    2015-08-10

    Although magnetic heterostructures are the basis of many magnetic technologies, the mechanisms involved in magnetization reversals in such structures are not fully understood, especially in amorphous multilayers. Here, we report on the SmCo/CoAlZr system and exploit resonant magnetic x-ray scattering to probe the element specific magnetization reversals. When combined into a tri-layer structure, two different switching fields and reversal mechanisms are observed for the Sm and Co sub-lattices. We argue that the decoupling of the sub-lattices arises from the local distribution of atomic species within the amorphous matrix leading to a strong magnetic leverage effect and exchange pinning. The decoupling arises due to strong interactions between regions of high Co density which span the interface. The relatively sparse interactions between Sm and Co induce a localized pinning of the Co-rich areas, resulting in an exchange bias in minor loops and an enhanced coercivity.

  6. Element speciation during nuclear glass alteration

    NASA Astrophysics Data System (ADS)

    Galoisy, L.; Calas, G.; Bergeron, B.; Jollivet, P.; Pelegrin, E.

    2011-12-01

    Assessing the long-term behavior of nuclear glasses implies the prediction of their long-term performance. An important controlling parameter is their evolution during interaction with water under conditions simulating geological repositories. After briefly recalling the major characteristics of the local and medium-range structure of borosilicate glasses of nuclear interest, we will present some structural features of this evolution. Specific structural tools used to determine the local structure of glass surfaces include synchrotron-radiation x-ray absorption spectroscopy with total electron yield detection. The evolution of the structure of glass surface has been determined at the Zr-, Fe-, Si- and Al-K edges and U-LIII edge. During alteration in near- or under-saturated conditions, some elements such as Fe change coordination, as other elements such as Zr only suffer structural modifications in under-saturated conditions. Uranium exhibits a modification of its speciation from an hexa-coordinated U(VI) in the borosilicate glass to an uranyl group in the gel. These structural modifications may explain the chemical dependence of the initial alteration rate and the transition to the residual regime. They also illustrate the molecular-scale origin of the processes at the origin of the glass-to-gel transformation. Eventually, they explain the provisional trapping of U by the alteration gel: the uranium retention factors in the gel depend on the alteration conditions, and thus on the nature of the resulting gel and on the trapping conditions.

  7. Zr4+ doping in Li4Ti5O12 anode for lithium-ion batteries: open Li+ diffusion paths through structural imperfection.

    PubMed

    Kim, Jae-Geun; Park, Min-Sik; Hwang, Soo Min; Heo, Yoon-Uk; Liao, Ting; Sun, Ziqi; Park, Jong Hwan; Kim, Ki Jae; Jeong, Goojin; Kim, Young-Jun; Kim, Jung Ho; Dou, Shi Xue

    2014-05-01

    One-dimensional nanomaterials have short Li(+) diffusion paths and promising structural stability, which results in a long cycle life during Li(+) insertion and extraction processes in lithium rechargeable batteries. In this study, we fabricated one-dimensional spinel Li4Ti5O12 (LTO) nanofibers using an electrospinning technique and studied the Zr(4+) doping effect on the lattice, electronic structure, and resultant electrochemical properties of Li-ion batteries (LIBs). Accommodating a small fraction of Zr(4+) ions in the Ti(4+) sites of the LTO structure gave rise to enhanced LIB performance, which was due to structural distortion through an increase in the average lattice constant and thereby enlarged Li(+) diffusion paths rather than changes to the electronic structure. Insulating ZrO2 nanoparticles present between the LTO grains due to the low Zr(4+) solubility had a negative effect on the Li(+) extraction capacity, however. These results could provide key design elements for LTO anodes based on atomic level insights that can pave the way to an optimal protocol to achieve particular functionalities.

  8. Bone bonding bioactivity of Ti metal and Ti-Zr-Nb-Ta alloys with Ca ions incorporated on their surfaces by simple chemical and heat treatments.

    PubMed

    Fukuda, A; Takemoto, M; Saito, T; Fujibayashi, S; Neo, M; Yamaguchi, S; Kizuki, T; Matsushita, T; Niinomi, M; Kokubo, T; Nakamura, T

    2011-03-01

    Ti15Zr4Nb4Ta and Ti29Nb13Ta4.6Zr, which do not contain the potentially cytotoxic elements V and Al, represent a new generation of alloys with improved corrosion resistance, mechanical properties, and cytocompatibility. Recently it has become possible for the apatite forming ability of these alloys to be ascertained by treatment with alkali, CaCl2, heat, and water (ACaHW). In order to confirm the actual in vivo bioactivity of commercially pure titanium (cp-Ti) and these alloys after subjecting them to ACaHW treatment at different temperatures, the bone bonding strength of implants made from these materials was evaluated. The failure load between implant and bone was measured for treated and untreated plates at 4, 8, 16, and 26 weeks after implantation in rabbit tibia. The untreated implants showed almost no bonding, whereas all treated implants showed successful bonding by 4 weeks, and the failure load subsequently increased with time. This suggests that a simple and economical ACaHW treatment could successfully be used to impart bone bonding bioactivity to Ti metal and Ti-Zr-Nb-Ta alloys in vivo. In particular, implants heat treated at 700 °C exhibited significantly greater bone bonding strength, as well as augmented in vitro apatite formation, in comparison with those treated at 600 °C. Thus, with this improved bioactive treatment process these advantageous Ti-Zr-Nb-Ta alloys can serve as useful candidates for orthopedic devices.

  9. Comment on “Correlation and relativistic effects in U metal and U-Zr alloy: Validation of ab initio approaches”

    SciTech Connect

    Söderlind, P.; Landa, A.; Turchi, P. E. A.

    2014-10-01

    In a recent paper, Xie et al. [Phys. Rev. B 88, 235128 (2013)], report that the density-functional theory (DFT) with the so-called DFT plus Hubbard U (DFT+U) modification improves energetics, volumes, and formation enthalpies over the standard form of DFT for uranium metal and U-Zr alloys. Also, spin-orbit coupling (SOC) was argued to advance the aforementioned properties in these systems. We demonstrate, contrarily, that neither the Hubbard U approach nor SOC is necessary for a correct description of uranium metal and U-Zr alloys. We further illustrate that the combination of DFT+U and SOC in the projector augmented-wave calculations by Xie et al. results in unrealistically large volume expansions, particularly for γ-U, in stark contrast to all previous calculations for elemental uranium. This in turn may also explain why the DFT+U with SOC model predicts negative enthalpy of mixing in the U-Zr alloy system contradicting conventional DFT as well as one of the main features of the experimental U-Zr phase diagram. The assertion by Xie et al. that DFT+U is an improvement over DFT for these systems is illustrated to be incorrect.

  10. Examination of Multiphase (Zr,Ti)(V,Cr,Mn,Ni)2 Ni-MH Electrode Alloys: Part I. Dendritic Solidification Structure

    NASA Astrophysics Data System (ADS)

    Boettinger, W. J.; Newbury, D. E.; Wang, K.; Bendersky, L. A.; Chiu, C.; Kattner, U. R.; Young, K.; Chao, B.

    2010-08-01

    The solidification microstructures of three nine-element Zr-Ni-based AB2 type C14/C15 Laves hydrogen storage alloys are determined. The selected compositions represent a class of alloys being examined for usage as an MH electrode in nickel metal-hydride batteries that often have their best properties in the cast state. Solidification is accomplished by dendritic growth of hexagonal C14 Laves phase, peritectic solidification of cubic C15 Laves phase, and formation of cubic B2 phase in the interdendritic regions. The B2 phase decomposes in the solid state into a complex multivariate platelike structure containing Zr-Ni-rich intermetallics. The observed sequence C14/C15 upon solidification agrees with predictions using effective compositions and thermodynamic assessments of the ternary systems, Ni-Cr-Zr and Cr-Ti-Zr. Experimentally, the closeness of the compositions of the C14 and C15 phases required the use of compositional mapping with an energy dispersive detector capable of processing a very high X-ray flux to locate regions in the microstructure for quantitative composition measurement and transmission electron microscope examination.

  11. FUEL ELEMENT

    DOEpatents

    Fortescue, P.; Zumwalt, L.R.

    1961-11-28

    A fuel element was developed for a gas cooled nuclear reactor. The element is constructed in the form of a compacted fuel slug including carbides of fissionable material in some cases with a breeder material carbide and a moderator which slug is disposed in a canning jacket of relatively impermeable moderator material. Such canned fuel slugs are disposed in an elongated shell of moderator having greater gas permeability than the canning material wherefore application of reduced pressure to the space therebetween causes gas diffusing through the exterior shell to sweep fission products from the system. Integral fission product traps and/or exterior traps as well as a fission product monitoring system may be employed therewith. (AEC)

  12. Interdiffusion and Reaction between Zr and Al Alloys from 425 degrees to 625 degrees C

    SciTech Connect

    J. Dickson; L. Zhou; A. Ewh; M. Fu; D. D. Keiser, Jr.; Y. H. Sohn; A. Paz y Puente

    2014-06-01

    Zirconium has recently garnered attention for use as a diffusion barrier between U–Mo nuclear fuels and Al cladding alloys. Interdiffusion and reactions between Zr and Al, Al-2 wt.% Si, Al-5 wt.% Si or AA6061 were investigated using solid-to-solid diffusion couples annealed in the temperature range of 425 degrees to 625 degrees C. In the binary Al and Zr system, the Al3Zr and Al2Zr phases were identified, and the activation energy for the growth of the Al3Zr phase was determined to be 347 kJ/mol. Negligible diffusional interactions were observed for diffusion couples between Zr vs. Al-2 wt.% Si, Al-5 wt.% Si and AA6061 annealed at or below 475 degrees C. In diffusion couples with the binary Al–Si alloys at 560 degrees C, a significant variation in the development of the phase constituents was observed including the thick t1 (Al5SiZr2) with Si content up to 12 at.%, and thin layers of (Si,Al)2Zr, (Al,Si)3Zr, Al3SiZr2 and Al2Zr phases. The use of AA6061 as a terminal alloy resulted in the development of both T1 (Al5SiZr2) and (Al,Si)3Zr phases with a very thin layer of (Al,Si)2Zr. At 560 degrees C, with increasing Si content in the Al–Si alloy, an increase in the overall rate of diffusional interaction was observed; however, the diffusional interaction of Zr in contact with multicomponent AA6061 with 0.4–0.8 wt.% Si was most rapid.

  13. Positive effect of Sc and Zr on globular microstructure formation in AA7075 thixoforming feedstock

    NASA Astrophysics Data System (ADS)

    Rogal, Ł.; Dutkiewicz, J.; Lityńska-Dobrzańska, L.; Olszowska-Sobieraj, B.; Modigell, M.

    2011-05-01

    One of methods of obtaining a fine globular microstructure in a semi-solid range, necessary for thixoforming process, is modifiers additions. For this purpose 0.5 weight percent of modifying elements-scandium and zirconium-was added to 7075 alloy. The microstructure of such alloy consisted of homogeneously distributed globular grains of solid solution with the following chemical composition: Mg - 1.9%, Al - 91.6%, Cu - 1.0%, Zn - 5.5% (all in wt.%). Quantitative metallographic analysis showed that the average grain size was 23.5 μm, much smaller than in the alloy without additions and 3.08% volume fraction of precipitates in the form of a layer between spherical α(Al) grains. X-ray phase analysis of the 7075 alloy with Sc and Zr additions confirmed the dominant presence of aluminum solid solution and the intermetallic hexagonal phase MgZn2. Electron diffraction pattern confirmed location of η MgZn2 phase at the grain boundaries. EDS chemical analysis of the η MgZn2 phase showed following content of elements: Mg - 17.2%, Al - 20.4%, Cu - 27.8%, Zn - 34.6%. The larger amount of Cu and Al indicated non-stoichiometry of the η phase, which can be presented with a formula [Mg(Zn,Al,Cu)2]. Additionally, inside the aluminum solution, small, square-shaped precipitations enriched with Sc and Zr were observed. Electron diffraction pattern allowed identification of the precipitates as cubic Al3(Sc,Zr) phase. The average hardness of feedstock was 105 HV5. DSC analysis during heating of the alloy enabled the estimation of a solidus line, at temperature of 548° C and a liquidus line at temperature: 656° C. For cooling, the temperatures for solidus and liquidus were 545° C and 636° C respectively. Additionally, the relation of liquid phase as a function of temperature was determined. Measurements of rheological properties in the semi-solid range, using the Searl system indicated that an increase of a particle size leads to an observable decrease of viscosity during

  14. Impact of the oxygen defects and the hydrogen concentration on the surface of tetragonal and monoclinic ZrO2 on the reduction rates of stearic acid on Ni/ZrO2

    SciTech Connect

    Foraita, Sebastian D.; Fulton, John L.; Chase, Zizwe A.; Vjunov, Aleksei; Xu, Pinghong; Barath, Eszter; Camaioni, Donald M.; Zhao, Chen; Lercher, Johannes A.

    2015-02-02

    The effect of the physicochemical properties of ZrO2 phases on the activity of Ni/ZrO2 catalysts for hydrodeoxygenation of stearic acid are described. A synergistic interaction between Ni and ZrO2 support was found. The effect is greatest for the monoclinic phase of ZrO2.

  15. Microstructure development and hydrogen gas interaction of oxidized Zr65Pd35 and Zr60Pd35Ce5 amorphous alloys

    NASA Astrophysics Data System (ADS)

    Ozawa, Masakuni; Kato, Shiro; Kobayashi, Katsutoshi; Yogo, Toshinobu; Yamamura, Shin-ichi

    2016-01-01

    The microstructure of composites derived from amorphous Zr65Pd35 and Zr65Pd35Ce5 alloys was studied. X-ray diffractograms, Raman spectroscopy profiles and scanning electron micrographs indicated that the mixtures containing ZrO2, metallic Pd, and PdO were formed for both amorphous alloys after heat treatment in air. The amorphous Zr60Pd35Ce5 alloy at temperatures of 280-400 °C changed to the composites in which very small Pd precipitates with a diameter less than 100 nm were embedded in a ZrO2 matrix. The hydrogen-temperature-programmed reduction was applied to study the reactivity of hydrogen gas with the oxidized Zr60Pd35Ce5 material. A rapid hydrogen absorption and release behavior was observed on the composite derived from the amorphous alloy.

  16. Thermally induced Zr incorporation into Si from zirconium silicate thin films

    NASA Astrophysics Data System (ADS)

    Quevedo-Lopez, M.; El-Bouanani, M.; Addepalli, S.; Duggan, J. L.; Gnade, B. E.; Wallace, R. M.; Visokay, M. R.; Douglas, M.; Bevan, M. J.; Colombo, L.

    2001-10-01

    Monochromatic x-ray photoelectron spectroscopy, time-of-flight secondary ion mass spectrometry, and Rutherford backscattering spectrometry are used to study the outdiffusion of Zr from the alternate gate dielectric candidate ZrSixOy thin films deposited on Si(100). We find that Zr incorporation into Si from ZrSixOy appears to occur at annealing temperatures higher than 1000 °C. Incorporation of Zr to depths of up to 23 nm into the silicon substrate is observed. A diffusion coefficient of D0˜2×10-15cm2/s is estimated from the associated depth profiles.

  17. Bond strength and electronic structures of coherent Ir /Ir3Zr interfaces

    NASA Astrophysics Data System (ADS)

    Gong, H. R.; Liu, Yong; Tang, Hui Ping; Xiang, Chang Shu

    2008-05-01

    First principles calculation reveals that the coherent Ir /Ir3Zr interfaces possess high values of bond strength and that interface orientation and atomic configuration have important effects on interface bonding and interface energy. Calculation also shows that the interface dipole is formed in the Ir /Ir3Zr interface due to an unequal loss of the electrons from Ir and Ir3Zr atoms, and density of states suggests that a stronger covalent bonding is formed in the interface than corresponding Ir or Ir3Zr bulks, which results in the strengthening effect of the Ir3Zr precipitation in the Ir-base superalloys from experimental observations in the literature.

  18. Volcanic sanidinites: an example for the mobilization of high field strength elements (HFSE) in magmatic systems

    NASA Astrophysics Data System (ADS)

    Aßbichler, Donjá; Heuss-Aßbichler, Soraya; Müller, Dirk; Kunzmann, Thomas

    2016-04-01

    In earth science the mobility of high field strength elements (HFSE) is generally discussed in context of hydrothermal processes. Recent investigations mainly address processes in (late) magmatic-, metamorphic- and submarine hydrothermal systems. They have all in common that H2O is main solvent. The transport of HFSE is suggested to be favored by volatiles, like boron, fluorine, phosphate and sulfate (Jiang et al., 2005). In this study processes in magmatic system are investigated. Sanidinites are rare rocks of igneous origin and are found as volcanic ejecta of explosive volcanoes. They consist mainly of sanidine and minerals of the sodalite group. The very porous fabric of these rocks is an indication of their aggregation from a gaseous magmatic phase. The large sanidine crystals (up to several centimeters) are mostly interlocking, creating large cavities between some crystals. In these pores Zr crystallizes as oxide (baddeleyite, ZrO2) or silicate (zircon, ZrSiO4). The euhedral shape of these minerals is a further indication of their formation out of the gas phase. Furthermore, bubbles in glass observed in some samples are evidence for gas-rich reaction conditions during the formation of the sanidinites. The formation of sanidinites is suggested to be an example for solvothermal processes in natural systems. Solvothermal processes imply the solvation, transport and recrystallization of elements in a gas phase. Results obtained from whole rock analysis from sanidinites from Laacher See (Germany) show a positive correlation between LOI, sulfate, Cl, and Na with the HFSE like Zr. Na-rich conditions seem to ameliorate the solvothermal transport of Zr. All these features point to the formation of sanidinites in the upper part of a magma chamber, where fluid consisting of SO3 and Cl compounds in addition to H2O, CO2 and HFSE (high field strength elements) like Zr accumulate.

  19. Reduction of chromium in Ni-base superalloys through element substitution and rapid solidification processing

    NASA Technical Reports Server (NTRS)

    Fraser, H. D.; Muddl, B. C.

    1982-01-01

    The reduction in the use of Cr in Ni base superalloys by the combined approaches of both elemental substitution and rapid solidification processing is studied. The elements Si, Zr, Y and Hf were chosen as potential partial substitutes for Cr in Waspaloy and IN 713LC sine their separate addition to other alloys has previously resulted in enhanced oxidation resistance. The roles of Cr and these replacement elements in determining the microstructure and properties are evaluated. The elements Si, Zr, and Y and Hf are used as partial replacements for Cr in the base superalloys and these resultant alloys are processed using rapid solidification techniques. The mechanical properties and oxidation resistance of the processed materials are evaluated. The microstructure is characterized using state of the art techniques (e.g. analytical transmission electron microscopy), and the mechanism by which these structures are produced is determined.

  20. Amorphous Ti-Zr; Base Metglas brazing filler metals

    SciTech Connect

    Rabinkin, A.; Liebermann, H.; Pounds, S.; Taylor, T. )

    1991-01-01

    This paper is the first report on processing, properties and potential application of amorphous titanium/zirconium-base alloys produced in the form of a good quality continuous and ductile ribbon having up to 12.5 mm width. To date, the majority of titanium brazing is accomplished using cooper and aluminum-base brazing filler metals. The brazements produced with these filler metals have rather low ({approximately}300{degrees} C) service temperature, thus impeding progress in aircraft and other technologies and industries. The attempt to develop a generation of high temperature brazing filler metals was made in the late sixties-early seventies studies in detail were a large number of Ti-, Zr-Ti-Zr, Ti-V and Zr-V-Ti based alloys. The majority of these alloys has copper and nickel as melting temperature depressants. The presence of nickel and copper converts them into eutectic alloys having (Ti(Zr)) (Cu(Ni)), intermetallic phases as major structural constituents. This, in turn, results in high alloy brittleness and poor, if any, processability by means of conventional, i.e. melting-ingot casting-deformation technology. In spite of good wettability and high joint strength achieved in dozens of promising alloys, only Ti-15Cu-15Ni is now widely used as a brazing filler metal for high service temperature. Up until now this material could not be produced as a homogeneous foil and is instead applied as a clad strip consisting of three separate metallic layers.

  1. Transition strengths in 86Nb and 86Zr

    NASA Astrophysics Data System (ADS)

    Kaye, R. A.; Adams, J. B.; Hale, A.; Smith, C.; Solomon, G. Z.; Tabor, S. L.; García-Bermúdez, G.; Cardona, M. A.; Filevich, A.; Szybisz, L.

    1998-05-01

    Mean lifetimes of states in 86Nb and 86Zr produced by the 58Ni(32S,3pn)86Nb and 58Ni(32S,4p)86Zr reactions at 130 MeV have been measured using the recoil-distance method. The B(E2) strength of 11(2) W.u. for the 8+-->6+ transition in 86Nb implies weak collectivity at low excitation energies for the π=+yrast band. The weak dipole transition strength of the 8+-->7 decay suggests that the configuration for the 7ħ state is different from that of the other yrast states. In general, the B(E2) rates obtained for transitions in 86Zr agree with those previously published, thus supporting the suggestion of a weakly collective structure based on shell-model excitations at low energies. Hartree-Fock-Bogolyubov cranking calculations indicate a spherical shape for low-spin vacuum configuration states in 86Zr.

  2. Microstructure evolution in Zr under equal channel angular pressing

    NASA Astrophysics Data System (ADS)

    Choi, W. S.; Ryoo, H. S.; Hwang, S. K.; Kim, M. H.; Kwun, S. I.; Chae, S. W.

    2002-03-01

    Pure polycrystalline Zr was deformed by equal channel angular pressing (ECAP), and the microstructural characteristics were analyzed. By repeated alternating ECAP, it was possible to refine the grain size from 200 to 0.2 µm. Subsequent annealing heat treatment at 550 °C resulted in a grain growth of up to 6 µm. Mechanical twinning was an important deformation mechanism, particularly during the early stage of deformation. The most active twinning system was identified as 85.2 deg {10bar 12} tensile twinning, followed by 57.1 deg {10bar 11} compressive twinning. Crystal texture as well as grain-boundary misorientation distribution of deformed Zr were analyzed by X-ray diffraction (XRD) and electron backscattered diffraction (EBSD). The ECAP-deformed Zr showed a considerable difference in the crystallographic attributes from those of cold-rolled Zr or Ti, in that texture and boundary misorientation-angle distribution tend toward more even distribution with a slightly preferential distribution of boundaries of a 20 to 30 deg misorientation angle. Furthermore, unlike the case of cold rolling, the crystal texture was not greatly altered by subsequent annealing heat treatment. Overall, the present work suggests ECAP as a viable method to obtain significant grain refining in hexagonal close-packed (hcp) metals.

  3. Accommodation of tin in tetragonal ZrO{sub 2}

    SciTech Connect

    Bell, B. D. C.; Grimes, R. W.; Wenman, M. R.; Murphy, S. T.; Burr, P. A.

    2015-02-28

    Atomic scale computer simulations using density functional theory were used to investigate the behaviour of tin in the tetragonal phase oxide layer on Zr-based alloys. The Sn{sub Zr}{sup ×} defect was shown to be dominant across most oxygen partial pressures, with Sn{sub Zr}{sup ″} charge compensated by V{sub O}{sup ••} occurring at partial pressures below 10{sup −31 }atm. Insertion of additional positive charge into the system was shown to significantly increase the critical partial pressure at which Sn{sub Zr}{sup ″} is stable. Recently developed low-Sn nuclear fuel cladding alloys have demonstrated an improved corrosion resistance and a delayed transition compared to Sn-containing alloys, such as Zircaloy-4. The interaction between the positive charge and the tin defect is discussed in the context of alloying additions, such as niobium and their influence on corrosion of cladding alloys.

  4. FUEL ELEMENT

    DOEpatents

    Howard, R.C.; Bokros, J.C.

    1962-03-01

    A fueled matrlx eontnwinlng uncomblned carbon is deslgned for use in graphlte-moderated gas-cooled reactors designed for operatlon at temperatures (about 1500 deg F) at which conventional metallic cladding would ordlnarily undergo undesired carburization or physical degeneratlon. - The invention comprlses, broadly a fuel body containlng uncombined earbon, clad with a nickel alloy contalning over about 28 percent by' weight copper in the preferred embodlment. Thls element ls supporirted in the passageways in close tolerance with the walls of unclad graphite moderator materlal. (AEC)

  5. Synthesis of MAX Phases in the Zr-Ti-Al-C System.

    PubMed

    Tunca, Bensu; Lapauw, Thomas; Karakulina, Olesia M; Batuk, Maria; Cabioc'h, Thierry; Hadermann, Joke; Delville, Rémi; Lambrinou, Konstantina; Vleugels, Jozef

    2017-03-20

    This study reports on the synthesis and characterization of MAX phases in the (Zr,Ti)n+1AlCn system. The MAX phases were synthesized by reactive hot pressing and pressureless sintering in the 1350-1700 °C temperature range. The produced ceramics contained large fractions of 211 and 312 (n = 1, 2) MAX phases, while strong evidence of a 413 (n = 3) stacking was found. Moreover, (Zr,Ti)C, ZrAl2, ZrAl3, and Zr2Al3 were present as secondary phases. In general, the lattice parameters of the hexagonal 211 and 312 phases followed Vegard's law over the complete Zr-Ti solid solution range, but the 312 phase showed a non-negligible deviation from Vegard's law around the (Zr0.33,Ti0.67)3Al1.2C1.6 stoichiometry. High-resolution scanning transmission electron microscopy combined with X-ray diffraction demonstrated ordering of the Zr and Ti atoms in the 312 phase, whereby Zr atoms occupied preferentially the central position in the close-packed M6X octahedral layers. The same ordering was also observed in 413 stackings present within the 312 phase. The decomposition of the secondary (Zr,Ti)C phase was attributed to the miscibility gap in the ZrC-TiC system.

  6. Investigations of the mechanical properties of the Zr8Ti8 random alloy

    NASA Astrophysics Data System (ADS)

    Huang, Sunchao; Zhang, Xiaoli; Zhang, Yongsheng; Hou, Songjun; Yangi, Xiaoyu; Zeng, Zhi

    2016-01-01

    The mechanical property of alloys plays a vital role in applications. In order to probe the mechanical property of the Zr-Ti alloy, we have successfully generated a 16-atom special quasi-random structure (SQS) at concentration 0.5 for the Zr-Ti alloy (Zr8Ti8) with supercell (2×2×2) based on the hcp Bravais cell, which has the same shape with the hcp Bravais cell. Such an SQS can be used as a good template at the 0.5 concentration of all binary hcp random alloys as the initial step for the further description of their alloy properties. Our calculated bulk modulus of Zr8Ti8 is 101.7GPa, falling within the region for the extreme two constituents (B0Zr< B0Zr8Ti8< B0Ti). Obtained B/G of Zr8Ti8 (3.60) is significantly larger than those of Zr (2.75) and Ti (2.64), which means that the ductility of Zr8Ti8 alloy is better than those of its constituents. The maximum Cauchy stress of Zr8Ti8 is 20.53GPa at strain (ɛ)=0.43 in [0001] direction. In addition, this SQS template for Zr8Ti8 has been proved to be mechanically stable.

  7. Microstructure, mechanical property, corrosion behavior, and in vitro biocompatibility of Zr-Mo alloys.

    PubMed

    Zhou, F Y; Wang, B L; Qiu, K J; Li, L; Lin, J P; Li, H F; Zheng, Y F

    2013-02-01

    In this study, the microstructure, mechanical properties, corrosion behaviors, and in vitro biocompatibility of Zr-Mo alloys as a function of Mo content after solution treatment were systemically investigated to assess their potential use in biomedical application. The experimental results indicated that Zr-1Mo alloy mainly consisted of an acicular structure of α' phase, while ω phase formed in Zr-3Mo alloy. In Zr-5Mo alloy, retained β phase and a small amount of precipitated α phase were observed. Only the retained β phase was obtained in Zr-10Mo alloy. Zr-1Mo alloy exhibited the greatest hardness, bending strength, and modulus among all experimental Zr-Mo alloys, while β phase Zr-10Mo alloy had a low modulus. The results of electrochemical corrosion indicated that adding Mo into Zr improved its corrosion resistance which resulted in increasing the thermodynamic stability and passivity of zirconium. The cytotoxicity test suggested that the extracts of the studied Zr-Mo alloys produced no significant deleterious effect to fibroblast cells (L-929) and osteoblast cells (MG 63), indicating an excellent in vitro biocompatibility. Based on these facts, certain Zr-Mo alloys potentially suitable for different biomedical applications were proposed.

  8. Assembly Mechanism of Zr-Containing and Other TM-Containing Polyoxometalates.

    PubMed

    Jiménez-Lozano, Pablo; Solé-Daura, Albert; Wipff, Georges; Poblet, Josep M; Chaumont, Alain; Carbó, Jorge J

    2017-04-03

    The mechanism by which Zr-substituted and other transition metal-substituted polyoxometalates (POMs) form covalently linked dimers has been analyzed by means of static density functional theory (DFT) calculations with a continuous solvent model as well as Car-Parrinello molecular dynamics (CPMD) simulations with explicit solvent molecules. The study includes different stages of the process: the formation of the active species by alkalination of the solution and formation of intercluster linkages. CPMD simulations show that the Zr-triaqua precursor, [W5O18Zr(H2O)3](2-), under basic conditions, reacts with hydroxide anions to form Zr-aqua-hydroxo active species, [W5O18Zr(OH)(H2O)](3-). We computed the DFT potential energy profile for dimerization of [W5O18TM(OH)](n-) [TM = Zr(IV)(H2O), Zr(IV), Ti(IV), and W(VI)] anions. The resulting overall energy barrier is low for Zr(IV), moderate for Ti(IV), and high for W(VI). The computed thermodynamic balance favors the dibridged (μOH)2 linkages for Zr(IV), the monobridged (μOH) linkage for Ti(IV), and the monomeric forms for W(VI), in agreement with experimentally observed trends. The lowest energy barrier and largest coordination number of Zr-substituted POMs are both a consequence of the flexible coordination environment and larger radius of Zr.

  9. Local vibrations and negative thermal expansion in ZrW2O8.

    PubMed

    Bridges, F; Keiber, T; Juhas, P; Billinge, S J L; Sutton, L; Wilde, J; Kowach, Glen R

    2014-01-31

    We present an x-ray pair distribution function (XPDF) analysis and extended x-ray absorption fine structure (EXAFS) data for ZrW2O8 (10-500 K) with a focus on the stiffness of the Zr-O-W linkage. The XPDF is highly sensitive to W-Zr and W-W correlations, but much less so to O-O or W-O correlations. The Zr-W peak in the XPDF data has a weak temperature dependence and, hence, this linkage is relatively stiff and does not permit bending of the Zr-O-W link. We propose that the low energy vibrational modes that lead to negative thermal expansion involve correlated rotations of ZrO6 octahedra that produce large <111> translations of the WO4 tetrahedra, rather than a transverse motion of O atoms that imply a flexible Zr-O-W linkage.

  10. Pressure and tension effects on mechanical properties of ZrAl{sub 2}

    SciTech Connect

    Zhang, Pinliang; Tang, Xiuzhang; Meng, Fanchen; Gong, Zizheng; Ji, Guangfu; Yang, Jinke

    2014-11-15

    Structural, elastic, thermodynamic of ZrAl{sub 2} under pressure, ideal strength and deformation mode under tension are investigated by the first-principles method. The calculated structural parameters at zero pressure are in consistent with experiments. Under pressure, elastic constants and their pressure dependence are obtained using the static finite strain technique. ZrAl{sub 2} exhibits lower elastic anisotropy. The linear thermal expansion coefficient shows greater effects of temperature at lower pressure. The ideal tensile have been investigated by stress–strain calculations. Finally, the microscopic mechanism that determines the structural stability is studied using the results of electronic structure calculations. We propose that the weakening of Zr-Zr leads to the significant change of stress–strain curve at strain ∼0.27, and the breaking of Zr{sub 2}-Zr{sub 3} leads to the structural instability of ZrAl{sub 2} under large tensile strains.

  11. Neutron capture on Zr94: Resonance parameters and Maxwellian-averaged cross sections

    NASA Astrophysics Data System (ADS)

    Tagliente, G.; Milazzo, P. M.; Fujii, K.; Abbondanno, U.; Aerts, G.; Álvarez, H.; Alvarez-Velarde, F.; Andriamonje, S.; Andrzejewski, J.; Audouin, L.; Badurek, G.; Baumann, P.; Bečvář, F.; Belloni, F.; Berthoumieux, E.; Bisterzo, S.; Calviño, F.; Calviani, M.; Cano-Ott, D.; Capote, R.; Carrapiço, C.; Cennini, P.; Chepel, V.; Chiaveri, E.; Colonna, N.; Cortes, G.; Couture, A.; Cox, J.; Dahlfors, M.; David, S.; Dillmann, I.; Domingo-Pardo, C.; Dridi, W.; Duran, I.; Eleftheriadis, C.; Embid-Segura, M.; Ferrari, A.; Ferreira-Marques, R.; Furman, W.; Gallino, R.; Goncalves, I.; Gonzalez-Romero, E.; Gramegna, F.; Guerrero, C.; Gunsing, F.; Haas, B.; Haight, R.; Heil, M.; Herrera-Martinez, A.; Jericha, E.; Käppeler, F.; Kadi, Y.; Karadimos, D.; Karamanis, D.; Kerveno, M.; Kossionides, E.; Krtička, M.; Lamboudis, C.; Leeb, H.; Lindote, A.; Lopes, I.; Lozano, M.; Lukic, S.; Marganiec, J.; Marrone, S.; Martínez, T.; Massimi, C.; Mastinu, P.; Mengoni, A.; Moreau, C.; Mosconi, M.; Neves, F.; Oberhummer, H.; O'Brien, S.; Pancin, J.; Papachristodoulou, C.; Papadopoulos, C.; Paradela, C.; Patronis, N.; Pavlik, A.; Pavlopoulos, P.; Perrot, L.; Pigni, M. T.; Plag, R.; Plompen, A.; Plukis, A.; Poch, A.; Praena, J.; Pretel, C.; Quesada, J.; Rauscher, T.; Reifarth, R.; Rosetti, M.; Rubbia, C.; Rudolf, G.; Rullhusen, P.; Salgado, J.; Santos, C.; Sarchiapone, L.; Savvidis, I.; Stephan, C.; Tain, J. L.; Tassan-Got, L.; Tavora, L.; Terlizzi, R.; Vannini, G.; Vaz, P.; Ventura, A.; Villamarin, D.; Vincente, M. C.; Vlachoudis, V.; Vlastou, R.; Voss, F.; Walter, S.; Wiescher, M.; Wisshak, K.

    2011-07-01

    The neutron capture cross sections of the Zr isotopes play an important role in nucleosynthesis studies. The s-process reaction flow between the Fe seed and the heavier isotopes passes through the neutron magic nucleus Zr90 and through Zr91,92,93,94, but only part of the flow extends to Zr96 because of the branching point at Zr95. Apart from their effect on the s-process flow, the comparably small isotopic (n,γ) cross sections make Zr also an interesting structural material for nuclear reactors. The Zr94 (n,γ) cross section has been measured with high resolution at the spallation neutron source n_TOF at CERN and resonance parameters are reported up to 60 keV neutron energy.

  12. Diffusion behavior for Se and Zr in sodium-bentonite

    SciTech Connect

    Sato, Haruo; Yui, Mikazu; Yoshikawa, Hideki

    1995-12-31

    Apparent diffusion coefficients for Se and Zr in bentonite were measured by in-diffusion method at room temperature using water-saturated sodium-bentonite, Kunigel V1{reg_sign} containing 50wt% Na-smectite as a major mineral was used as the bentonite material. The experiments were carried out in the dry density range of 400--1,800 kg/m{sup 3}. Bentonite samples were immersed with distilled water and saturated before the experiments. The experiments for Se were carried out under N{sub 2} atmospheric condition (O{sub 2}: 2.5ppm). Those for Zr were carried out under aerobic condition. The apparent diffusion coefficients decrease with increasing density of the bentonite. Since dominant species of Se in the pore water is predicted to be SeO{sub 3}{sup 2{minus}}, Se may be retarded by anion-exclusion because of negative charge on the surface of the bentonite and little sorption. The dominant species of Zr in the porewater is predicted to be Zr(OH){sub 5}{sup {minus}} or HZrO{sub 3}{sup {minus}}. Distribution coefficient measured for Zr on the bentonite was about 1.0 m{sup 3}/kg from batch experiments. Therefore, the retardation may be caused by combination of the sorption and the anion-exclusion. A modeling for the diffusion mechanisms in the bentonite were discussed based on an electric double layer theory. Comparison between the apparent diffusion coefficients predicted by the model and the measured ones shows a good agreement.

  13. Deuterium absorption and material phase characteristics of SAES St 198 Zr-Fe Alloy. Revision 1

    SciTech Connect

    Nobile, A.; Mosley, W.C.; Holder, J.S.; Brooks, K.N.

    1994-01-01

    This document reports deuterium absorption and material phase characteristics of SAES St 198 Zr-Fe Alloy (76.5% Zr). Scanning electron microscope images of polished surfaces, electron probe microanalysis, and x-ray powder diffractometry indicated the presence of a primary Zr{sub 2}Fe phase with secondary phases of ZrFe{sub 2}, Zr{sub 5}FeSn, {alpha}-Zr, and Zr{sub 6}Fe{sub 3}O. A statistically designed experiment to determine the effects of temperature, time, and vacuum quality on activation of St 198 revealed that, when activated at low temperature (350C), deuterium absorption rate was slower when the vacuum quality was poor (2.5 Pa vs. 3 {times} 10{sup {minus}4} Pa). However, at higher activation temperature (500C), deuterium absorption rate was fast and was independent of vacuum quality. Deuterium pressure-composition-temperature (P-C-T) data are reported for St 198 in the temperature range 200 to 500C. The P-C-T data over the full range of deuterium loading and at temperatures of 350C and below is described an expression. At higher temperatures, one or more secondary reactions in the solid phase occur that slowly consume D{sub 2} from the gas phase. X-ray diffraction and other data suggest these reactions to be: 2 Zr{sub 2}FeD{sub x} {yields} xZrD{sub 2} + x/3 ZrFe{sub 2} + (2 {minus} 2/3x) Zr{sub 2}Fe and Zr{sub 2}FeD{sub x} + (2 {minus} 1/2x) D{sub 2} {yields} 2 ZrD{sub 2} + Fe, where 0 < x < 3. Reaction between gas-phase deuterium and Zr{sub 2}Fe formed in the first reaction accounts for the observed consumption of deuterium from the gas phase by this reaction.

  14. Superelastic and shape memory properties of TixNb3Zr2Ta alloys.

    PubMed

    Zhu, Yongfeng; Wang, Liqiang; Wang, Minmin; Liu, Zhongtang; Qin, Jining; Zhang, Di; Lu, Weijie

    2012-08-01

    The microstructure and phase constitutions of TixNb3Zr2Ta alloys (x=35, 31, 27, 23) (wt%) were studied. With a lower niobium content the grain size of β phase in TixNb3Zr2Ta alloys increased significantly, and the TixNb3Zr2Ta system was more likely to form α″ phase and even α phase. Tensile tests showed that UTS of TixNb3Zr2Ta alloys improved as the Nb content was decreased. Cyclic loading-unloading tensile tests were carried on TixNb3Zr2Ta alloys. Ti23Nb3Zr2Ta and Ti27Nb3Zr2Ta alloys featured the best superelasticity among the alloys studied. The pseudoelastic strain ratio of Ti35Nb3Zr2Ta alloy decreased a lot as the cycle number increased. Ti31Nb3Zr2Ta alloy showed only minimum superelasticity. This is because Ti23Nb3Zr2Ta and Ti27Nb3Zr2Ta alloys had higher yield strength than Ti31Nb3Zr2Ta did, which allowed martensite phase to be induced. On the contrary, Ti31Nb3Zr2Ta alloy exhibited better shape memory property than Ti27Nb3Zr2Ta, Ti23Nb3Zr2Ta and Ti35Nb3Zr2Ta titanium alloys. β phase, α phase and α″ phase were found in Ti23Nb3Zr2Ta alloy by TEM observation. The dislocation density of α phase was much lower than that of β phase due to their crystal structure difference. This may explained why Ti23Nb3Zr2Ta with α phase possessed higher tensile strength. The incomplete shape recovery of Ti23Nb3Zr2Ta alloy after unloading resulted from two sources. Plastic deformation occurred in β phase, α phase and even α″ phase under dislocation slip mechanism, and incomplete decomposition of α″ martensitic phase resulted in unrecovered strain as well.

  15. Detached Eddy Simulations of Incompressible Turbulent Flows Using the Finite Element Method

    SciTech Connect

    Laskowski, G M

    2001-08-01

    An explicit Galerkin finite-element formulation of the Spalart-Allmaras (SA) 1 - equation turbulent transport model was implemented into the incompressible flow module of a parallel, multi-domain, Galerkin finite-element, multi-physics code, using both a RANS formulation and a DES formulation. DES is a new technique for simulating/modeling turbulence using a hybrid RANSkES formulation. The turbulent viscosity is constructed from an intermediate viscosity obtained from the transport equation which is spatially discretized using Q1 elements and integrated in time via forward Euler time integration. Three simulations of plane channel flow on a RANS-type grid, using different turbulence models, were conducted in order to validate the implementation of the SA model: SA-RANS, SA-DES and Smagorinksy (without wall correction). Very good agreement was observed between the SA-RANS results and theory, namely the Log Law of the Wall (LLW), especially in the viscous sublayer region and, to a lesser extent, in the log-layer region. The results obtained using the SA-DES model did not agree as well with the LLW, and it is believed that this poor agreement can be attributed to using a DES model on a RANS grid, namely using an incorrect length-scale. It was observed that near the wall, the SA-DES model acted as an RANS model, and away from the wall it acted as an LES model.

  16. Crystallization kinetics of rapidly quenched Cu50Zr50 and Cu46Zr46Al8 glass-forming alloys

    NASA Astrophysics Data System (ADS)

    Kulikova, T. V.; Ryltseva, A. A.; Bykov, V. A.; Estemirova, S. Kh; Shuhyaev, K. Yu

    2017-01-01

    We studied the crystallization processes, the structure and thermal properties of amorphous alloys Cu50Zr50 and Cu46Zr46Al8 in a wide temperature range. Comparative study of the crystallization kinetics of these amorphous alloys was carried out for the first time using multivariate non-linear regression. It was found that mechanisms of the crystallization of studied metallic glasses are substantially different. The binary alloy is crystallized by branched reaction complex in four steps. For the ternary system was proposed two-step kinetic model of the crystallization process with consecutive reactions. The values of the total energy of activation for each crystallization stage reach to Cu50Zr50: E1 (345.2 kJ/mol); E2 (307.9 kJ/mol), E3 (281.1 kJ/mol), E4 (259.51 kJ/mol) and Cu46Zr46Al8: E1 (350.7 kJ/mol); E2 (150.4 kJ/mol).

  17. Characterization of ZrO2 buffer layers for sequentially evaporated Y-Ba-CuO on Si and Al2O3 substrates

    NASA Technical Reports Server (NTRS)

    Valco, George J.; Rohrer, Norman J.; Pouch, John J.; Warner, Joseph D.; Bhasin, Kul B.

    1988-01-01

    Thin film high temperature superconductors have the potential to change the microwave technology for space communications systems. For such applications it is desirable that the films be formed on substrates such as Al2O3 which have good microwave properties. The use of ZrO2 buffer layers between Y-Ba-Cu-O and the substrate has been investigated. These superconducting films have been formed by multilayer sequential electron beam evaporation of Cu, BaF2 and Y with subsequent annealing. The three layer sequence of Y/BaF2/Cu is repeated four times for a total of twelve layers. Such a multilayer film, approximately 1 micron thick, deposited directly on SrTiO3 and annealed at 900 C for 45 min produces a film with a superconducting onset of 93 K and critical temperature of 85 K. Auger electron spectroscopy in conjunction with argon ion sputtering was used to obtain the distribution of each element as a function of depth for an unannealed film, the annealed film on SrTiO3 and annealed films on ZrO2 buffer layers. The individual layers were apparent. After annealing, the bulk of the film on SrTiO3 is observed to be fairly uniform while films on the substrates with buffer layers are less uniform. The Y-Ba-Cu-O/ZrO2 interface is broad with a long Ba tail into the ZrO2, suggesting interaction between the film and the buffer layer. The underlying ZrO2/Si interface is sharper. The detailed Auger results are presented and compared with samples annealed at different temperatures and durations.

  18. Restauration adaptative des contours par une approche inspiree de la prediction des performances

    NASA Astrophysics Data System (ADS)

    Rousseau, Kami

    En teledetection, les cartes de contours peuvent servir, entre autres choses, a la restitution geometrique, a la recherche d'elements lineaires, ainsi qu'a la segmentation. La creation de ces cartes est faite relativement tot dans la chaine de traitements d'une image. Pour assurer la qualite des operations subsequentes, il faut veiller a obtenir une carte de contours precise. Notre problematique est de savoir s'il est possible de diminuer la perte de temps liee au choix d'algorithme et de parametre en corrigeant automatiquement la carte de contours. Nous concentrerons donc nos efforts sur le developpement d'une methode de detection/restauration de contours adaptative. Notre methode s'inspire d'une technique de prediction des performances d'algorithmes de bas niveau. Elle consiste a integrer un traitement par reseau de neurones a une methode " classique " de detection de contours. Plus precisement, nous proposons de combiner la carte de performances avec la carte de gradient pour permettre des decisions plus exactes. La presente etude a permis de developper un logiciel comprenant un reseau de neurones entraine pour predire la presence de contours. Ce reseau de neurones permet d'ameliorer les decisions de detecteurs de contours, en reduisant le nombre de pixels de fausses alarmes et de contours manques. La premiere etape de ce travail consiste en une methode d'evaluation de performance pour les cartes de contours. Une fois ce choix effectue, il devient possible de comparer les cartes entre elles. Il est donc plus aise de determiner, pour chaque image, la meilleure detection de contours. La revue de la litterature realisee simultanement a permis de faire un choix d'un groupe d'indicateurs prometteurs pour la restauration de contours. Ces derniers ont servi a la calibration et a l'entrainement d'un reseau de neurones pour modeliser les contours. Par la suite, l'information fournie par ce reseau a ete combinee par multiplication arithmetique avec les cartes d

  19. Precipitation in cold-rolled Al–Sc–Zr and Al–Mn–Sc–Zr alloys prepared by powder metallurgy

    SciTech Connect

    Vlach, M.; Stulikova, I.; Smola, B.; Kekule, T.; Kudrnova, H.; Danis, S.; Gemma, R.; Ocenasek, V.; Malek, J.; Tanprayoon, D.; Neubert, V.

    2013-12-15

    The effects of cold-rolling on thermal, mechanical and electrical properties, microstructure and recrystallization behaviour of the AlScZr and AlMnScZr alloys prepared by powder metallurgy were studied. The powder was produced by atomising in argon with 1% oxygen and then consolidated by hot extrusion at 350 °C. The electrical resistometry and microhardness together with differential scanning calorimetry measurements were compared with microstructure development observed by transmission and scanning electron microscopy, X-ray diffraction and electron backscatter diffraction. Fine (sub)grain structure developed and fine coherent Al{sub 3}Sc and/or Al{sub 3}(Sc,Zr) particles precipitated during extrusion at 350 °C in the alloys studied. Additional precipitation of the Al{sub 3}Sc and/or Al{sub 3}(Sc,Zr) particles and/or their coarsening was slightly facilitated by the previous cold rolling. The presence of Sc,Zr-containing particles has a significant antirecrystallization effect that prevents recrystallization at temperatures minimally up to 420 °C. The precipitation of the Al{sub 6}Mn- and/or Al{sub 6}(Mn,Fe) particles of a size ∼ 1.0 μm at subgrain boundaries has also an essential antirecrystallization effect and totally suppresses recrystallization during 32 h long annealing at 550 °C. The texture development of the alloys seems to be affected by high solid solution strengthening by Mn. The precipitation of the Mn-containing alloy is highly enhanced by a cold rolling. The apparent activation energy of the Al{sub 3}Sc particles formation and/or coarsening and that of the Al{sub 6}Mn and/or Al{sub 6}(Mn,Fe) particle precipitation in the powder and in the compacted alloys were determined. The cold deformation has no effect on the apparent activation energy values of the Al{sub 3}Sc-phase and the Al{sub 6}Mn-phase precipitation. - Highlights: • The Mn, Sc and Zr additions to Al totally suppresses recrystallization at 550 °C. • The Sc,Zr-containing particle

  20. Study of ZrO2/Al2O3/ZrO2 and Al2O3/ZrO2/Al2O3 stack structures deposited by sol-gel method on Si

    NASA Astrophysics Data System (ADS)

    Vitanov, P.; Harizanova, A.; Ivanova, T.; Dimitrova, T.

    2010-02-01

    Based on our previous experience with pseudobinary alloys of (Al2O3)x(ZrO2)1-x as high-k materials and passivating coatings for solar cells, stack systems of ZrO2/Al2O3/ZrO2and Al2O3/ZrO2/Al2O3, deposited by simple and low cost sol-gel technology have been studied. The thin films of ZrO2 and Al2O3 were sequentially obtained on Si substrates including spin coating deposition from stable solutions. High resolution scanning electron microscopy (HRSEM) was used to compare the morphology of the nanolaminates. The layers were optically characterized by UV-VIS spectrophotometry. The electrical measurements were carried out on metal-insulator-semiconductor (MIS) structures. Their leakage current and relative permittivity were determined.

  1. Zr and Mo isotopic constraints on the origins of unusual types of presolar SiC grains.

    SciTech Connect

    Pellin, M. J.; Davis, A. M.; Calaway, W. F.; Lewis, R. S.; Clayton, R. N.; Amari, S.

    2000-03-01

    Although most presolar silicon carbide grains form in asymptotic giant branch red giant stars (the so-called mainstream grains) or supernovae (the X-grains), there are a number of other minor types of grains whose origin is less clear. The dominant mechanisms of heavy element nucleosynthesis, the s-process and r-process, are thought to occur mainly in AGB stars and supernovae, respectively [1], and the isotopic patterns in heavy elements in presolar grains can be used to constrain their origins. We have previously reported that mainstream SiC grains have strong enrichments in the s-process isotopes of Sr, Zr and Mo [2-5] and that X-grains have an unusual Mo isotopic composition that differs from s- and r-process expectations [6,7]. We report here the first measurements of Zr and Mo isotopes in several grains of other rare types that were found in the same mount as the mainstream and X-grains reported previously.

  2. Controle modal des diodes laser a large fenetre d'emission

    NASA Astrophysics Data System (ADS)

    Lepage, Jean-Francois

    Les diodes laser a large fenetre d'emission (BA) constituent des sources permettant d'obtenir des puissances elevees a faible cout. Leur emission est cependant composee de nombreux modes lateraux et longitudinaux, reduisant la qualite du faisceau emis. Nous considerons l'utilisation, en cavite externe, de reseaux possedant un profil spatial de reflectivite, afin de controler les modes de ces lasers. Le chapitre 1 presente d'abord une introduction aux lasers a semi-conducteurs, ainsi qu'un rappel des principales methodes de controle des modes abordees dans la litterature. Le chapitre 2 decrit la fabrication et l'utilisation de reseaux holographiques apodisants dans le but d'obtenir une emission monomode laterale et longitudinale. Nous etudions d'abord les effets d'un profil spatial de reflectivite en cavite externe sur la discrimination envers les modes lateraux. Nous voyons ensuite la modelisation, la fabrication, puis la caracterisation des reseaux holographiques apodisants. Nous presentons finalement les resultats obtenus par l'operation d'une diode laser BA avec les reseaux fabriques. Ces resultats sont compares avec ceux obtenus en utilisant d'autres types de coupleurs externes. Le chapitre 3 traite de la fabrication et de l'usage de reseaux holographiques a double pas, dans le but d'obtenir une emission laser sur deux modes longitudinaux. La theorie et les procedures experimentales relatives a la fabrication de ces reseaux sont d'abord exposees. Nous procedons ensuite a une analyse des proprietes diffractives de ces elements. Le chapitre se termine par une presentation des resultats experimentaux obtenus en utilisant ces coupleurs en cavite externe avec une diode laser. Le chapitre 4 presente une analyse de la stabilite du systeme laser obtenu au chapitre 3. Nous rappelons d'abord la theorie relative a la competition modale dans les lasers et nous voyons, de facon analytique, l'effet de la saturation spatiale sur la saturation mutuelle des modes, dans le cas d

  3. Methods for making a porous nuclear fuel element

    DOEpatents

    Youchison, Dennis L; Williams, Brian E; Benander, Robert E

    2014-12-30

    Porous nuclear fuel elements for use in advanced high temperature gas-cooled nuclear reactors (HTGR's), and to processes for fabricating them. Advanced uranium bi-carbide, uranium tri-carbide and uranium carbonitride nuclear fuels can be used. These fuels have high melting temperatures, high thermal conductivity, and high resistance to erosion by hot hydrogen gas. Tri-carbide fuels, such as (U,Zr,Nb)C, can be fabricated using chemical vapor infiltration (CVI) to simultaneously deposit each of the three separate carbides, e.g., UC, ZrC, and NbC in a single CVI step. By using CVI, the nuclear fuel may be deposited inside of a highly porous skeletal structure made of, for example, reticulated vitreous carbon foam.

  4. Bio-corrosion and cytotoxicity studies on novel Zr55Co30Ti15 and Cu60Zr20Ti20 metallic glasses

    SciTech Connect

    Vincent, S.; Daiwile, A.; Devi, S. S.; Kramer, M. J.; Besser, M. F.; Murty, B. S.; Bhatt, Jatin

    2014-09-26

    Metallic glasses are a potential and compatible implant candidate for biomedical applications. In the present investigation, a comparative study between novel Zr55Co30Ti15 and Cu60Zr20Ti20 metallic glasses is carried out to evaluate in vitro biocompatibility using simulated body fluids. The bio-corrosion behavior of Zr- and Cu-based metallic glasses in different types of artificial body fluids such as artificial saliva solution, phosphate-buffered saline solution, artificial blood plasma solution, and Hank’s balanced saline solution is evaluated using potentiodynamic polarization studies at a constant body temperature of 310.15 K (37 °C). Surface morphology of samples after bio-corrosion experiments was observed by scanning electron microscopy. In vitro cytotoxicity test on glassy alloys were performed using human osteosarcoma cell line as per 10993-5 guidelines from International Organization for Standardization. As a result, the comparative study between Zr- and Cu-based glassy alloys provides vital information about the effect of elemental composition on biocompatibility of metallic glasses.

  5. Ostéosynthèse des fractures des métacarpiens et des phalanges de la main par mini plaque: à propos de 12 cas

    PubMed Central

    Moncef, Erraji; Abdelhafid, Derfoufi; Abdessamad, Kharraji; Omar, Agoumi; Najib, Abdeljaouad; Abdelkrim, Daoudi; Hicham, Yacoubi

    2016-01-01

    Le traitement des fractures instables des métacarpes et des phalanges reste un objet de controverse. Peu de séries ont été rapportées dans la littérature, rendant leur analyse difficile. Nous rapportons une étude rétrospective comportant 12 patients, opérés par cette technique, ayant eu des fractures déplacées des métacarpes ou des phalanges, sur une période de deux ans. Les résultats globaux ont été bons dans 75% des cas, moyenne dans 16,5% des cas et mauvais dans 8,5% des cas. La stabilité du montage par mini plaques des fractures instables des métacarpiens et des phalanges ont permis une mobilisation précoce des articulations de la main, évitant ainsi la raideur. PMID:27800079

  6. Study of temperature dependent zirconium silicide phases in Zr/Si structure by differential scanning calorimetry

    NASA Astrophysics Data System (ADS)

    Faruque, Sk Abdul Kader Md; Ranjan Bhattachryya, Satya; Sinha, Anil Kumar; Chakraborty, Supratic

    2016-02-01

    The differential scanning calorimetry (DSC) technique is employed to study the formation of different silicide compounds of Zr thin-film deposited on a 100 μm-thick Si (1 0 0) substrate by dc sputtering. A detailed analysis shows that silicide layers start growing at  ∼246 °C that changes to stable ZrSi2 at 627 °C via some compounds with different stoichiometric ratios of Zr and Si. It is further observed that oxygen starts reacting with Zr at  ∼540 °C but a stoichiometric ZrO2 film is formed after complete consumption of Zr metal at 857 °C. A further rise in temperature changes a part of ZrSi2 to Zr-Silicate. The synchrotron radiation-based grazing incidence x-ray diffraction and x-ray photoelectron spectroscopy studies also corroborate the above findings. Atomic force microscopy is also carried out on the samples. It is evident from the observations that an intermixing and nucleation of Zr and Si occur at lower temperature prior to the formation of the interfacial silicate layer. Zr-Silicate formation takes place only at a higher temperature.

  7. Evaluation of 89Zr-pertuzumab in Breast Cancer Xenografts

    PubMed Central

    2015-01-01

    Pertuzumab is a monoclonal antibody that binds to HER2 and is used in combination with another HER2–specific monoclonal antibody, trastuzumab, for the treatment of HER2+ metastatic breast cancer. Pertuzumab binds to an HER2 binding site distinct from that of trastuzumab, and its affinity is enhanced when trastuzumab is present. We aim to exploit this enhanced affinity of pertuzumab for its HER2 binding epitope and adapt this antibody as a PET imaging agent by radiolabeling with 89Zr to increase the sensitivity of HER2 detection in vivo. Here, we investigate the biodistribution of 89Zr-pertuzumab in HER2–expressing BT-474 and HER2–nonexpressing MDA-MB-231 xenografts to quantitatively assess HER2 expression in vivo. In vitro cell binding studies were performed resulting in retained immunoreactivity and specificity for HER2–expressing cells. In vivo evaluation of 89Zr-pertuzumab was conducted in severely combined immunodeficient mice, subcutaneously inoculated with BT-474 and MDA-MB-231 cells. 89Zr-pertuzumab was systemically administered and imaged at 7 days postinjection (p.i.) followed by terminal biodistribution studies. Higher tumor uptake was observed in BT-474 compared to MDA-MB-231 xenografts with 47.5 ± 32.9 and 9.5 ± 1.7% ID/g, respectively at 7 days p.i (P = 0.0009) and blocking studies with excess unlabeled pertuzumab showed a 5-fold decrease in BT-474 tumor uptake (P = 0.0006), confirming the in vivo specificity of this radiotracer. Importantly, we observed that the tumor accumulation of 89Zr-pertuzumab was increased in the presence of unlabeled trastuzumab, at 173 ± 74.5% ID/g (P = 0.01). Biodistribution studies correlate with PET imaging quantification using max SUV (r = 0.98, P = 0.01). Collectively, these results illustrate that 89Zr-pertuzumab as a PET imaging agent may be beneficial for the quantitative and noninvasive assessment of HER2 expression in vivo especially for patients undergoing trastuzumab therapy. PMID:25058168

  8. Effects of incorporation of HA/ZrO(2) into glass ionomer cement (GIC).

    PubMed

    Gu, Y W; Yap, A U J; Cheang, P; Khor, K A

    2005-03-01

    Glass ionomer cements (GICs) are a class of bioactive cements that bond directly to bone. In this paper, a new bioactive hydroxyapatite (HA)/zirconia (ZrO(2))-filled GIC composite was developed to improve the biocompatibility and bioactivity of the GICs with the surrounding bone and connective tissues. Nano-sized HA/30 wt% ZrO(2) powders were heat treated at 700 degrees Celsius and 800 degrees Celsius for 3 h to elucidate the influence of the crystallinity of composite powders on the performance of HA/ZrO(2)-GICs. The effects of different volume percentages of HA/ZrO(2) powders (4, 12, 28 and 40 vol%) substituted within GICs were investigated based on their microhardness, compressive strength and diametral tensile strength. The HA/ZrO(2)-GICs composite was soaked in distilled water for 1 day and 1 week before subjecting the samples to mechanical testing. Results showed that the glass and HA/ZrO(2) particles were distributed uniformly in the GIC matrix. The substitution of highly crystalline HA/ZrO(2) improved the mechanical properties of the HA/ZrO(2)-GICs due to the slow resorption rate for highly crystalline powders in distilled water. The mechanical properties of HA/ZrO(2)-GICs increased with increasing soak time due to the continuous formation of aluminium salt bridges, which improved the final strength of the cements. The compositions 4 and 12 vol% HA/ZrO(2)-GICs exhibited superior mechanical properties than the original GICs. The mechanical properties of HA/ZrO(2)-GICs were found to be much better than those of HA-GICs because ZrO(2) has the attributes of high strength, high modulus, and is significantly harder than glass and HA particles. Furthermore, ZrO(2) does not dissolve with increasing soaking time.

  9. The detailed crystal and electronic structures of the cotunnite-type ZrO2

    NASA Astrophysics Data System (ADS)

    Zhang, Yan; Duan, Li; Ji, Vincent

    2016-07-01

    The detailed crystal and orbital-decomposed electronic structures of cotunnite-type ZrO2 have been investigated by using the first-principles projector augmented wave (PAW) potential within the generalized gradient approximation as well as taking into account on-site Coulomb repulsive interaction (GGA+U). The optimized structure shows that the OI and OII anions are surrounded by an arbitrary tetrahedron of four Zr cations and an arbitrary pentahedron of five Zr cations, respectively, in turn, the Zr cation is surrounded by an arbitrary tetrakaidecahedron formed by nine oxygen ligands. Although one more Zr cation is coordinated to OII, the larger bond lengths between OII and its adjacent five Zr cations (dOII-Zr) than those between OI and its adjacent four Zr cations (dOI-Zr) makes density of states (DOS) of s and three p (px , py and pz) states of the OII anion driving down in lower energy region and driving up in higher energy region. No crystal-field splitting is observed between three p (px , py and pz) states of anions OI and OII (between three p (px , py and pz) states and five d (dxy , dyz , dxz , dz2 and dx2-y2) states of cation Zr) is resulted from the arrangements of the surrounding cations (anions) do not have any symmetry. The additional covalent character upon Zr-O ionic bonds is attributed to the hybridization of itinerant Zr(5s) and less filled Zr(4d) states to the separated O(2s) and O(2p) states.

  10. Understanding the Zr and Si interdispersion in Zr1-xSixO2 mesoporous thin films by using FTIR and XANES spectroscopy.

    PubMed

    Andrini, Leandro; Angelomé, Paula C; Soler-Illia, Galo J A A; Requejo, Félix G

    2016-06-14

    Zr-Si mixed mesoporous oxides were obtained in a wide range of proportions, from 0 to 30% and from 70 to 100% of Si, using Si(OEt)4 and ZrCl4 as precursors and Pluronic F127 as a template. The oxide mesostructure was characterized by transmission electron microscopy and 2D-small angle X-ray scattering. Fourier transform infrared spectroscopy measurements suggested a local homogeneous interdispersion of both cations. Further selective studies using X-ray Absorption Near Edge Structure (XANES) spectroscopy for separately Zr and Si local environments, allowed for demonstrating that the Zr coordination varies from close to 7 to 6, when its concentration in the mixed oxide is reduced. In addition, it was possible to determine that in mixed oxides with low Zr concentrations, Zr can fit into the spaces occupied by Si in SiO2 pure oxide. An equivalent XANES result was obtained for Si, which is also compatible with the information obtained by FTIR. Furthermore, the Zr-O distance varied from close to 2.2 Å to 1.7 Å when the Zr concentration decreased. Finally, our study also demonstrates the usefulness of XANES to selectively assess the local structure (coordination, symmetry and chemical state) of specific atoms in nanostructured systems.

  11. Investigation of Zr(IV) and 89Zr(IV) complexation with hydroxamates: Progress towards designing a better chelator than desferrioxamine B for immuno-PET imaging

    PubMed Central

    Guérard, François; Lee, Yong-Sok; Tripier, Raphaël; Szajek, Lawrence P.; Deschamps, Jeffrey R.; Brechbiel, Martin W.

    2012-01-01

    Single crystal X-ray diffraction show that Zr(IV) forms an octa-coordinated complex with 4 bidentate hydroxamates whose solution structures were investigated utilizing density functional theory at the level of B3LYP/DGDZVP. Stability constants obtained by potentiometry were in accordance with the tendency observed when radiolabeling with 89Zr. PMID:23250287

  12. Density and Elasticity of Zr46Cu37.6Ag8.4Al8 Bulk Metallic Glass at High Pressure

    SciTech Connect

    W Liu; Q Zeng; Q Jiang; L Wang; B Li

    2011-12-31

    Compressional and shear wave velocities of Zr{sub 46}Cu{sub 37.6}Ag{sub 8.4}Al{sub 8} bulk metallic glass (BMG) have been measured up to 6.3 GPa at room temperature using ultrasonic interferometry in conjunction with synchrotron X-radiography. The densities at high pressures are uniquely determined using the measured velocities. The experimental results for the elastic moduli of Zr{sub 46}Cu{sub 37.6}Ag{sub 8.4}Al{sub 8} show a reasonable agreement with the Voigt-Reuss-Hill approximation of the element metal phases, indicating that the elastic properties of the BMG have a close correlation with its constituent components.

  13. Peste des Petits Ruminants Virus.

    PubMed

    Baron, M D; Diallo, A; Lancelot, R; Libeau, G

    2016-01-01

    Peste des petits ruminants virus (PPRV) causes a severe contagious disease of sheep and goats and has spread extensively through the developing world. Because of its disproportionately large impact on the livelihoods of low-income livestock keepers, and the availability of effective vaccines and good diagnostics, the virus is being targeted for global control and eventual eradication. In this review we examine the origin of the virus and its current distribution, and the factors that have led international organizations to conclude that it is eradicable. We also review recent progress in the molecular and cellular biology of the virus and consider areas where further research is required to support the efforts being made by national, regional, and international bodies to tackle this growing threat.

  14. Spectroscopic, structure and antimicrobial activity of new Y(III) and Zr(IV) ciprofloxacin

    NASA Astrophysics Data System (ADS)

    Sadeek, Sadeek A.; El-Shwiniy, Walaa H.; Zordok, Wael A.; El-Didamony, Akram M.

    2011-02-01

    The preparation and characterization of the new solid complexes [Y(CIP) 2(H 2O) 2]Cl 3·10H 2O and [ZrO(CIP) 2Cl]Cl·15H 2O formed in the reaction of ciprofloxacin (CIP) with YCl 3 and ZrOCl 2·8H 2O in ethanol and methanol, respectively, at room temperature were reported. The isolated complexes have been characterized with elemental analysis, IR spectroscopy, conductance measurements, UV-vis and 1H NMR spectroscopic methods and thermal analyses. The results support the formation of the complexes and indicate that ciprofloxacin reacts as a bidentate ligand bound to the metal ion through the pyridone oxygen and one carboxylato oxygen. The activation energies, E*; entropies, Δ S*; enthalpies, Δ H*; Gibbs free energies, Δ G*, of the thermal decomposition reactions have been derived from thermogravimetric (TGA) and differential thermogravimetric (DTG) curves, using Coats-Redfern and Horowitz-Metzeger methods. The proposed structure of the two complexes was detected by using the density functional theory (DFT) at the B3LYP/CEP-31G level of theory. The ligand as well as their metal complexes was also evaluated for their antibacterial activity against several bacterial species, such as Staphylococcus aureus ( S. aureus), Escherichia coli ( E. coli) and Pseudomonas aeruginosa ( P. aeruginosa) and antifungal screening was studied against two species ( Penicillium ( P. rotatum) and Trichoderma ( T. sp.)). This study showed that the metal complexes are more antibacterial as compared to free ligand and no antifungal activity observed for ligand and their complexes.

  15. Effect of Processing Scheme on Precipitation Mechanisms and Evolution of Microstructures and Properties of CuAgZr alloy

    NASA Astrophysics Data System (ADS)

    Piyawit, Waraporn

    CuAgZr alloy is a variant of the CuAg alloy that is developed for high strength and high conductivity applications. With Zr addition, the discontinuous precipitation at the grain boundaries is decreased due to slower Ag diffusion rate. Mechanical and electrical properties of copper alloys can be influenced by many factors including alloying elements, mechanical processing, heat treatment and their microstructures. For high strength and high conductivity applications, Cu-Ag alloys are one of the good candidate materials for these used because of their excellent combinations of high strength and high electrical conductivity. The primary strengthening mechanism is precipitation hardening due to the formation of Ag precipitates during the heat treatment process. Its strengthening is accomplished mainly by the precipitation of Ag precipitates, which tend to align on the {111} planes in the Cu matrix. The evolutions of hardness and electrical conductivity of the aged samples showed that the Ag particles precipitated out from the Cu matrix in the early stage of aging. The hardness of the aged samples is significantly increased from 95 HV0.1 to the maximum at 193 HV0.1 after 2 hours of aging. The density of Ag precipitates is increased with increased aging time. Ag precipitation occurs in particular Cu matrix planes due to the minimization of elastic energy. The Ag precipitates were formed by clustering of Ag atoms while maintaining the fcc crystal structure of the matrix. They have faceted {111} interfaces with the matrix. The thickening of the precipitates appears to be by the ledge growth mechanism, which is promoted by misfit dislocation networks on the interface. The ledge movement and growth were compensated with the existence of interfacial misfit dislocations. During diffusional growth, misfit dislocation arrays along the precipitate/matrix interface accommodated the lattice mismatch. Therefore, precipitate growth involves the formation and migration of ledges

  16. Greening America's Capitals - Des Moines, IA

    EPA Pesticide Factsheets

    Report from Greening America's Capitals project in Des Moines, IA, to help the city enhance the 6th Avenue Corridor with pedestrian and bike improvements and green infrastructure to manage stormwater.

  17. Synthesis of novel ZrO2&GO@TiO2 nanocomposite as an efficient photoanode in dye-sensitized solar cells

    NASA Astrophysics Data System (ADS)

    Mohamed, Ibrahim M. A.; Dao, Van-Duong; Yasin, Ahmed S.; Yassin, Mohamed A.; Barakat, Nasser A. M.; Choi, Ho-Suk

    2017-02-01

    Due to the physicochemical and photo-electro properties, TiO2 nanostructures still being the outstanding photoanode materials in the dye-sensitized solar cells (DSCs). However, it is well known that a low dye-loading and charge recombination constrain the limitation of large-scale application. This work introduces the synthesis of ZrO2&GO@TiO2 nanofibers (NFs) by facile two steps using electrospinning and hydrothermal treatment. Furthermore, the developed materials are applied as an efficient photoanode of DSCs. The synthesized NFs are described in terms of morphology, crystallography and chemistry via FESEM, TEM, XRD, Raman spectra and EDX analysis. As the results, the Ti, Zr, O and C elements are uniformly distributed in the synthesized sample. The percentages of the atomic elements are 10.77, 57.69, 1.45 and 30.09 for C, O, Zr and Ti, respectively. The synthesized composite shows only anatase with crystal size of 25.86 nm and cell volume of 142.39 Å3. The developed material is employed as working electrode of DSCs. The J-V characteristic showed 5.09% efficiency for device using the synthesized material, which is higher than those of cells assembled with TiO2 NFs and ZrO2@TiO2 NFs photoanodes. The obtained result is explained by enhanced dye-loading (1.055 × 1017 molecule/cm2) and improved charge transfer resistance (Rct = 9.18 Ω) of the photoanode substrate. Hence, the presented nanocomposite can be an efficient photoanode towards technology of DSC.

  18. ZrP nanoplates based fire-fighting foams stabilizer

    NASA Astrophysics Data System (ADS)

    Zhang, Lecheng; Cheng, Zhengdong; Li, Hai

    2015-03-01

    Firefighting foam, as a significant innovation in fire protection, greatly facilitates extinguishments for liquid pool fire. Recently, with developments in LNG industry, high-expansion firefighting foams are also used for extinguishing LNG fire or mitigating LNG leakage. Foam stabilizer, an ingredient in fire-fighting foam, stabilizes foam bubbles and maintains desired foam volume. Conventional foam stabilizers are organic molecules. In this work, we developed a inorganic based ZrP (Zr(HPO4)2 .H2O, Zirconium phosphate) plates functionalized as firefighting foam stabilizer, improving firefighting foam performance under harsh conditions. Several tests were conducted to illustrate performance. The mechanism for the foam stabilization is also proposed. Artie McFerrin Department of Chemical Engineering, Texas A&M University, College Station, TX 77843, USA. Mary Kay O'Connor Process Safety Center, Texas A&M University, College Station, TX, 77843-3122

  19. Rapid Chemical Ordering in Supercooled Liquid Cu46Zr54

    SciTech Connect

    Wessels, Victor; Gangopadhyay, Anup; Sahu, K. K.; Hyers, R. W.; Canepari, S. M.; Rogers, J. R.; Kramer, Matthew J.; Goldman, Alan; Robinson, D.; Lee, Jae W; Morris, James R; Kelton, K. F.

    2011-01-01

    Evidence for abrupt chemical ordering in a supercooled Cu46Zr54 liquid, obtained from high energy x-ray diffraction in a containerless processing environment, is presented. Relatively sudden changes were observed in the topological and chemical short-range order near 850oC, a temperature significantly below the liquidus and above the glass transition temperatures. A peak in the specific heat was observed with supercooling, with an onset near 850oC, the same temperature as the onset of chemical ordering, and a maximum near 700oC, consistent with the prediction of a molecular dynamics calculation using embedded atom potentials. The dominant short-range order below 850oC is incompatible with that of the primary crystallizing phases. This, and the possible development of strongly bonded, chemically ordered clustersmay explain unlikely bulk metallic glass formation in Cu-Zr and other binary alloys.

  20. Complex superconductivity in the noncentrosymmetric compound Re6Zr

    DOE PAGES

    Khan, Mojammel A.; Karki, A. B.; Samanta, T.; ...

    2016-10-24

    Here, we report the electronic structure, synthesis, and measurements of the magnetic, transport, and thermal properties of the polycrystalline noncentrosymmetric compound Re6Zr . We observed a bulk superconducting transition at temperature Tc ~ 6.7 K, and measured the resistivity, heat capacity, thermal conductivity, and the London penetration depth below the transition, as well as performed doping and pressure studies. From these measurements we extracted the critical field and the superconducting parameters of Re6Zr. Lastly, our measurements indicate a relatively weak to moderate contribution from a triplet component to the order parameter, and favor a full superconducting gap, although we cannotmore » exclude the existence of point nodes based on our data.« less

  1. In-beam mechanical testing of CuCrZr

    NASA Astrophysics Data System (ADS)

    Marmy, P.

    2004-08-01

    In the ITER design, CuCrZr has been selected as the heat sink material for components of the first wall and the divertor. The objective of this work is to check the material fatigue performance when the CuCrZr alloy is cyclically deformed concurrently with irradiation, using an in situ testing machine placed in a 590 MeV proton accelerator. Three fatigue experiments have been conducted at 100 °C, under strain control, at a total strain range of 0.8%. The in-beam specimen reached the longest life. The post-irradiation tested specimen had the shortest life. The total plastic strain measured in the in-beam specimen was larger than the plastic strain measured in the statically irradiated specimen or in the unirradiated specimen.

  2. Radiochemical Separation of Group 5 Elements. Model Experiments for Investigation of Dubnium Chemical Behaviour

    SciTech Connect

    Tereshatov, E. E.; Bozhikov, G. A.; Aksenov, N. V.; Starodub, G. Ya.; Vostokin, G. K.; Shishkin, S. V.; Dmitriev, S. N.; Bruchertseifer, H.; Gaeggeler, H. W.

    2007-05-22

    Chemical behaviour of group 5 elements in the aqueous hydrofluoric acid solutions was studied. The radiochemical method for the cation exchange separation of Nb (Pa) and Ta from Zr, Hf and lanthanides is presented. The developed scheme allows excluding of the presence of SF heavy actinides in fractions of separated elements. On the basis of the data of the present work, it is possible to suggest the following order of the stability of the fluoride complexes of group 4 and 5 elements: Nb {approx_equal} Pa > Zr > Hf > Ta. The order of the complex formation is in agreement with theoretical predictions. This analytical procedure can be used in future heavy nuclei synthesis experiments for the separation of dubnium (Db) from other reactions products and for its chemical identification.

  3. Study of microstructure and precipitates of a Zr-2.5Nb-0.5Cu CANDU spacer material

    NASA Astrophysics Data System (ADS)

    Dong, Qingshan; Yu, Hongbing; Yao, Zhongwen; Long, Fei; Balogh, Levente; Daymond, Mark R.

    2016-12-01

    Synchrotron X-ray diffraction, scanning electron microscopy, and transmission electron microscope bright field and high angle annular dark field were employed to investigate the microstructure and precipitates of a Zr-2.5Nb-0.5Cu alloy wire, with potential application as a spacer in the CANDU® reactor design. Results show that three types of microstructure co-exist in the alloy: Widmanstätten structure, α-Zr grains without precipitates and α-Zr grains with precipitates. In the meantime, three types of second phase particles are detected: β-Nb, Zr2Cu and Zr2Fe, which have different distributions within the microstructure. The β-Nb precipitates are observed to be extensively distributed among the α plate boundaries and twin interfaces in the Widmanstätten structure, whereas the Zr2Cu and Zr2Fe precipitates are only found in the α plate boundaries. The orientation relations of the Zr2Cu precipitates with respect to the α-Zr and β-Nb are found to be (013)Zr2Cu / /(0001)α (013)Zr2Cu / /(0001)α , [ 0 3 bar 1 ] Zr2Cu / /[ 1 bar 100 ] α and (013)Zr2Cu / /(011) β -Nb , [ 0 3 bar 1 ] Zr2Cu / /[ 2 bar 1 bar 1 ] β -Nb respectively.

  4. Caracterisation des proprietes acoustiques des materiaux poreux a cellules ouvertes et a matrice rigide ou souple

    NASA Astrophysics Data System (ADS)

    Salissou, Yacoubou

    L'objectif global vise par les travaux de cette these est d'ameliorer la caracterisation des proprietes macroscopiques des materiaux poreux a structure rigide ou souple par des approches inverses et indirectes basees sur des mesures acoustiques faites en tube d'impedance. La precision des approches inverses et indirectes utilisees aujourd'hui est principalement limitee par la qualite des mesures acoustiques obtenues en tube d'impedance. En consequence, cette these se penche sur quatre problemes qui aideront a l'atteinte de l'objectif global precite. Le premier probleme porte sur une caracterisation precise de la porosite ouverte des materiaux poreux. Cette propriete en est une de passage permettant de lier la mesure des proprietes dynamiques acoustiques d'un materiau poreux aux proprietes effectives de sa phase fluide decrite par les modeles semi-phenomenologiques. Le deuxieme probleme traite de l'hypothese de symetrie des materiaux poreux selon leur epaisseur ou un index et un critere sont proposes pour quantifier l'asymetrie d'un materiau. Cette hypothese est souvent source d'imprecision des methodes de caracterisation inverses et indirectes en tube d'impedance. Le critere d'asymetrie propose permet ainsi de s'assurer de l'applicabilite et de la precision de ces methodes pour un materiau donne. Le troisieme probleme vise a mieux comprendre le probleme de transmission sonore en tube d'impedance en presentant pour la premiere fois un developpement exact du probleme par decomposition d'ondes. Ce developpement permet d'etablir clairement les limites des nombreuses methodes existantes basees sur des tubes de transmission a 2, 3 ou 4 microphones. La meilleure comprehension de ce probleme de transmission est importante puisque c'est par ce type de mesures que des methodes permettent d'extraire successivement la matrice de transfert d'un materiau poreux et ses proprietes dynamiques intrinseques comme son impedance caracteristique et son nombre d'onde complexe. Enfin, le

  5. Effect of non-lattice oxygen on ZrO2-based resistive switching memory.

    PubMed

    Lin, Chun-Chieh; Chang, Yi-Peng; Lin, Huei-Bo; Lin, Chu-Hsuan

    2012-03-14

    ZrO2-based resistive switching memory has attracted much attention according to its possible application in the next-generation nonvolatile memory. The Al/ZrO2/Pt resistive switching memory with bipolar resistive switching behavior is revealed in this work. The thickness of the ZrO2 film is only 20 nm. The device yield improved by the non-lattice oxygen existing in the ZrO2 film deposited at room temperature is firstly proposed. The stable resistive switching behavior and the long retention time with a large current ratio are also observed. Furthermore, it is demonstrated that the resistive switching mechanism agrees with the formation and rupture of a conductive filament in the ZrO2 film. In addition, the Al/ZrO2/Pt resistive switching memory is also possible for application in flexible electronic equipment because it can be fully fabricated at room temperature.

  6. Milling assisted synthesis of calcium zirconate СаZrО3

    NASA Astrophysics Data System (ADS)

    Kalinkin, A. M.; Nevedomskii, V. N.; Kalinkina, E. V.; Balyakin, K. V.

    2014-08-01

    Monophase calcium zirconate (CaZrO3) has been prepared from the equimolar ZrO2 + CaCO3 mixture by two-step synthesis process. In the first step, mechanical treatment of the mixture is performed in an AGO-2 planetary ball mill. In the second step, the milled mixture is annealed to form calcium zirconate. High-energy ball milling of the (ZrO2+CaCO3) mixture results in decrease in the temperature of CaZrO3 formation during annealing at 950 °C. The enhancement of CaZrO3 synthesis is due to accumulation of excess energy by the reagents, decreasing the particle size and notable increase in the interphase area because of “smearing” of CaCO3 on ZrO2 particles during milling. Nanocrystalline calcium zirconate has been produced by controlling the annealing temperature and time.

  7. High temperature ferromagnetism in cubic Mn-doped ZrO2 thin films

    NASA Astrophysics Data System (ADS)

    Hong, Nguyen Hoa; Park, Chul-Kwon; Raghavender, A. T.; Ruyter, Antoine; Chikoidze, Ekaterina; Dumont, Yves

    2012-09-01

    Theory has predicted that high temperature ferromagnetism (FM) should be found in cubic fake-diamonds, Mn-doped ZrO2. Experimentally, it is shown that Mn-doped ZrO2 ceramics are not ferromagnetic, but the nanosized Mn-doped ZrO2 thin films grown on LaAlO3 substrates can be ferromagnets with TC above 400 K. The largest saturated magnetic moment (Ms) is huge as of about 230 emu/cm3 for the Mn0.05Zr0.95O2 films, and it decreases as the Mn content increases. The intrinsic FM is strongly associated with the cubic structure of Mn-doped ZrO2, and the Mn-Mn interactions via oxygen intermediates are important. No electrical conductivity is observed. Mn-doped ZrO2 thin films can be truly considered as excellent candidates for spintronic applications.

  8. A DFT + U study of cerium solubility in La2Zr2O7

    SciTech Connect

    Wang, X J; Xiao, Haiyan; Zu, X T; Weber, William J

    2012-01-01

    Density functional theory plus Hubbard U correction is employed to study the solubility of cerium in La{sub 2}Zr{sub 2}O{sub 7}. The results show that La{sub 2}Zr{sub 2}O{sub 7} and Ce{sub 2}Zr{sub 2}O{sub 7} form a solid solution over the whole range of cerium content. The solubility of Ce in La{sub 2}Zr{sub 2}O{sub 7} can be partially attributed to the similar ionic radii of La{sup 3+} and Ce{sup 3+}. Electronic structures of the La{sub 2}yCeyZr{sub 2}O{sub 7} solid solution have been analyzed. The Ce 4f states are found to be partially occupied, and Ce in the La{sub 2}yCeyZr{sub 2}O{sub 7} solid solution exhibits a reduced charge state.

  9. Zr-based bulk metallic glass as a cylinder material for high pressure apparatuses

    SciTech Connect

    Komatsu, Kazuki; Munakata, Koji; Matsubayashi, Kazuyuki; Uwatoko, Yoshiya; Yokoyama, Yoshihiko; Sugiyama, Kazumasa; Matsuda, Masaaki

    2015-05-12

    Zirconium-based bulk metallic glass (Zr-based BMG) has outstanding properties as a cylinder mate- rial for piston-cylinder high pressure apparatuses and is especially useful for neutron scattering. The piston-cylinder consisting of a Zr-based BMG cylinder with outer/inner diameters of 8.8/2.5 mm sustains pressures up to 1.81 GPa and ruptured at 2.0 GPa, with pressure values determined by the superconduct- ing temperature of lead. The neutron attenuation of Zr-based BMG is similar to that of TiZr null-scattering alloy and more transparent than that of CuBe alloy. No contamination of sharp Bragg reflections is observed in the neutron diffraction pattern for Zr-based BMG. The magnetic susceptibility of Zr-based BMG is similar to that of CuBe alloy; this leads to a potential application for measurements of magnetic properties under pressure.

  10. Prediction des vibrations eoliennes d'un systeme conducteur-amortisseur avec une methode temporelle non lineaire

    NASA Astrophysics Data System (ADS)

    Langlois, Sebastien

    Les vibrations eoliennes sont la cause principale de bris de conducteurs en fatigue des lignes aeriennes de transport d'energie electrique. Ces vibrations sont dues a des detachements tourbillonnaires produits dans le sillage du conducteur. Une methode commune de reduction des vibrations est l'ajout d'amortisseurs de vibrations pres des pinces de suspension. Contrairement aux essais en ligne experimentale, la modelisation numerique permet d'evaluer rapidement et a faible cout la performance d'un amortisseur de vibration sur une portee de ligne aerienne. La technologie la plus frequemment utilisee fait appel au principe de balance d'energie (PBE) en evaluant le niveau de vibrations pour lequel la puissance injectee par le vent est egale a la puissance dissipee par le conducteur et l'amortisseur. Les methodes actuelles pour la prediction des vibrations reposent sur des hypotheses simplificatrices quant a la modelisation de l'interaction conducteur-amortisseur. Une approche prometteuse pour la prediction des vibrations est l'utilisation d'un modele numerique temporel non lineaire qui permet de mieux representer la masse, la geometrie, la rigidite et l'amortissement du systeme. L'objectif principal de ce projet de recherche est de developper un modele numerique avec integration temporelle directe d'un conducteur et d'un amortisseur en vibration permettant de reproduire le comportement dynamique du systeme pour la gamme de frequence et d'amplitude typique des vibrations eoliennes des conducteurs. Un modele par elements finis d'un conducteur seul en vibration resolu par integration temporelle directe a d'abord ete developpe en considerant une rigidite de flexion variable. Comme une rigidite de flexion constante et egale a 50% de la rigidite de flexion maximale theorique ( EImax) est jugee adequate pour la modelisation du conducteur, c'est cette valeur qui a ete utilisee pour la suite du projet. Ensuite, des modeles non-lineaires pour deux types d'amortisseur de

  11. Elemental analysis of ashes of office papers by EDXRF spectrometry

    NASA Astrophysics Data System (ADS)

    Rožić, M.; Mačefat, M. Rožmarić; Oreščanin, V.

    2005-02-01

    The concentrations of the elements Pb, Rb, Sr, Y, Zr, K, Ca, Ti, V, Cr, Mn, Fe, Ni, Cu, Zn and Co were determined in the ash-samples of writing, copying and computer printing papers by energy dispersive X-ray fluorescence (EDXRF). Non-coloured white papers of various manufactures and grammages were considered. Ashes of copying papers printed with black toner and black ink by laser and ink-jet printers were also analyzed. Most of the elements measured in papers showed the lowest concentrations in the ashes of Navigator and Copier papers (Sorpocel S.A., Portugal). Fabriano paper contains significantly higher amount of lead, strontium and zirconium compared to the papers of other manufactures. The concentrations of the elements Co, Mn, Fe, Cr and Ti in the Navigator paper printed by laser printers are significantly higher compared to the non-printed papers. In Fabriano papers the concentrations of the elements Cr, V and Cu as well as organic content increases with paper grammage from 80 to 160 g/m 2, while opposite was found for the amount of Pb, Rb, Sr, Y, Zr, K, Ca, Ti, Fe, Ni and Zn.

  12. Development of a Mo-Si-B coating for Nb-based Alloys and the Effects of Zr Additions to Mo-Si-B Coatings for Enhanced Oxidation Protection in Ultra-High Temperature Applications

    NASA Astrophysics Data System (ADS)

    Lu-Steffes, Otto John

    Higher efficiencies and reduced emissions performance of fossil fuel energy systems are achieved with increasing operation temperatures. This increase in operating temperature requires the use of materials with higher melting points such as refractory metal alloys. However, refractory metals suffer from catastrophic oxidation in this type of environment. Thus, oxidation protection for refractory metal alloys is a crucial step in developing next generation ultra-high temperature materials. To meet this challenge, an oxidation resistant coating for Nb based alloys has been designed as well as the incorporation of zirconium into the Mo-Si-B coating to provide further corrosion protection and a reduction in temperature for the underlying multi-layered structure. Niobium samples coated with a Mo-Si-B coating demonstrate enhanced oxidation protection compared to samples only coated with Si-B. Thermogravimetric analysis testing at 1300°C for 24 hours for both the Mo-Si-B coated Nb and Nb-based alloys show enhanced oxidation protection with mass changes of 0.44 mg/cm2 and 0.55 mg/cm2, respectively, compared to the uncoated alloy that had a mass change of 87.6 mg/cm2. To demonstrate the design concept for a coating with thermal barrier behavior, Zr is added to the Mo-Si-B coating through the pack cementation technique. The resulting coating shows that the Zr reacts with the aluminosilica top layer to form Zr silicides and ZrO2. Upon oxidation, the coating forms a mixed top layer composed of borosilica, ZrO2 and ZrSiO 4. Oxidation testing of the Zr modified Mo-Si-B coating exhibits low mass change indicating that the coating provides oxidation protection and that the Zr additions do not interfere with the oxidation protection of the Mo-Si-B coating. Finite element modeling using object oriented finite element analysis of the coating structures yielded an evaluation of the mechanical and thermal properties of the coatings, providing insight into the thermal performance and

  13. Radar Rainfall Estimation using a Quadratic Z-R equation

    NASA Astrophysics Data System (ADS)

    Hall, Will; Rico-Ramirez, Miguel Angel; Kramer, Stefan

    2016-04-01

    The aim of this work is to test a method that enables the input of event based drop size distributions to alter a quadratic reflectivity (Z) to rainfall (R) equation that is limited by fixed upper and lower points. Results will be compared to the Marshall-Palmer Z-R relation outputs and validated by a network of gauges and a single polarisation weather radar located close to Essen, Germany. The time window over which the drop size distribution measurements will be collected is varied to note any effect on the generated quadratic Z-R relation. The new quadratic algorithm shows some distinct improvement over the Marshall-Palmer relationship through multiple events. The inclusion of a minimum number of Z-R points helped to decrease the associated error by defaulting back to the Marshall-Palmer equation if the limit was not reached. More research will be done to discover why the quadratic performs poorly in some events as there appears to be little correlation between number of drops or mean rainfall amount and the associated error. In some cases it seems the spatial distribution of the disdrometers has a significant effect as a large percentage of the rain bands pass to the north of two of the three disdrometers, frequently in a slightly north-easterly direction. However during widespread precipitation events the new algorithm works very well with reductions compared to the Marshall-Palmer relation.

  14. Various sized nanotubes on TiZr for antibacterial surfaces

    NASA Astrophysics Data System (ADS)

    Grigorescu, Sabina; Ungureanu, Camelia; Kirchgeorg, Robin; Schmuki, Patrik; Demetrescu, Ioana

    2013-04-01

    A two-step anodization of a Ti50Zr alloy results in a various sized nanotube oxide structures, which show an improved antibacterial activity. The nanotubes were formed in glycol with 15 vol.% H2O and 0.2 M NH4F by two-step anodization. The oxide layer grown during 2 h was removed by sonication in deionized water and anodized again for 1 h at the same conditions as in the first step. The removed layer acts as a nano-prepatterned surface, where higher ordered and open nanotubes can be achieved. The surface morphologies were analyzed by SEM and AFM, the surface wettability by contact angle measurements. The diameter and the length of the grown nanotubes are potential dependent between 20 and 100 nm in diameter and 2.3 and 5.7 μm in length, respectively. The antibacterial properties were evaluated in vitro on the formed nanotubes on the TiZr alloy against gram negative Escherichia coli bacteria. The E. coli (ATCC 8738) were cultured in a tube containing Luria Bertani medium at 37 °C. The optical density was determined after 18 h of incubation. In comparison, the smallest nanotubes exhibited the most efficient antibacterial behavior against E. coli bacterium. This suggests the use of small diameter nanotubes on TiZr for antimicrobial surface applications, which are susceptible for biofilms and microbial cultures.

  15. Oxidation behavior of FeAl+Hf,Zr,B

    NASA Technical Reports Server (NTRS)

    Smialek, James L.; Doychak, Joseph

    1988-01-01

    The oxidation behavior of Fe-40Al-1Hf, Fe-40Al-1Hf-0.4B, and Fe-40Al-0.1Zr-0.4B (at. percent) alloys was characterized after 900, 1000, and 100 C exposures. Isothermal tests revealed parabolic kinetics after a period of transitional theta-alumina scale growth. The parabolic growth rates for the subsequent alpha-alumina scales were about five times higher than those for NiAl+0.1Zr alloys. The isothermally grown scales showed a propensity toward massive scale spallation due to both extensive rumpling from growth stresses and to an inner layer of HfO2. Cyclic oxidation for 200 1-hr cycles produced little degradation at 900 or 1000 C, but caused significant spallation at 1100 C in the form of small segments of the outer scale. The major difference in the cyclic oxidation of the three FeAl alloys was increased initial spallation for FeAl+Zr,B. Although these FeAl alloys showed many similarities to NiAl alloys, they were generally less oxidation resistant. It is believed that this resulted from nonoptimal levels of dopants and larger thermal expansion mismatch stresses.

  16. Spectral and dynamical properties of a Zr-based MOF.

    PubMed

    Gutiérrez, Mario; Sánchez, Félix; Douhal, Abderrazzak

    2016-02-21

    We report on the spectra and dynamics of a Zr-naphthalene dicarboxylic acid (Zr-NDC) MOF in different diluted solvent suspensions and in a concentrated tetrahydrofuran (THF) one. In a diluted diethyl ether (DE) suspension, we observed intraparticle excimer formation between neighboring naphthalene organic linkers, leading to a red-shifted broad band in the emission spectrum and to a dynamics composed of three components τ1 = 650 ps, τ2 = 3.7 ns and τ3 = 13.9 ns, assigned to the excimer photoproduction, monomer and excimer lifetimes, respectively. Furthermore, both absorption and emission spectra show a blue shift in more polar solvents characterized by the solvent polarity function f(ε,n). We also observed changes in the excimer formation time (490-840 ps) probably due to a variation in the MOF structural fluctuation induced by solvent filling. The global fluorescence quantum yield of these suspensions is around 0.30 ± 0.05. At higher concentrations of the MOF particles, we observed the absorption and emission signals of aggregates having an intercrystal excimer formation in ∼ 5 ps in a THF suspension, ∼ 100 times shorter than that observed in a diluted one. Our results give the spectral and dynamical properties of a Zr-NDC MOF in solvent suspensions, opening the way to further studies of these kinds of MOFs interacting with fluorescent dyes for possible photonic applications.

  17. The MOON project and DBD matrix elements

    NASA Astrophysics Data System (ADS)

    Ejiri, H.

    2009-06-01

    This is a brief report on experimental studies of double beta decays (DBD) in Japan, the MOON project for spectroscopic studies of neutrino-less DBD (0vββ) and on experimental studies of DBD nuclear matrix elements. Experimental DBD studies in Japan were made by geochemical methods on 130Te, 128Te and 96Zr and by a series of ELEGANT(EL) counting methods, EL III on 76Ge, EL IV, V on 100Mo, 116Cd, and EL VI on 48Ca. Future counter experiments are MOON, CANDLES, XMASS and DCBA. The MOON project, which is based on EL V, aims at studies of the Majorana nature of the neutrino (v) and the v-mass spectrum by spectroscopic 0vββ experiments with the v-mass sensitivity of < mmv > = 100-30 meV. The MOON detector is a super ensemble of multi-layer modules, each being composed by PL scintillator plates and position-sensitive detector planes. DBD nuclear matrix elements have been studied experimentally by using charge exchange reactions. The 2-neutrino DBD matrix elements are expressed by successive single-β matrix elements through low-lying intermediate states.

  18. 40 CFR 1065.284 - Zirconia (ZrO2) analyzer.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 34 2013-07-01 2013-07-01 false Zirconia (ZrO2) analyzer. 1065.284... Zirconia (ZrO2) analyzer. (a) Application. You may use a zirconia (ZrO2) analyzer to measure air-to-fuel...O2-based system must meet the linearity verification in § 1065.307. You may use a Zirconia...

  19. Electrodeposition and characterization of Ni-Mo-ZrO2 composite coatings

    NASA Astrophysics Data System (ADS)

    Laszczyńska, A.; Winiarski, J.; Szczygieł, B.; Szczygieł, I.

    2016-04-01

    Ni-Mo-ZrO2 composite coatings were produced by electrodeposition technique from citrate electrolytes containing dispersed ZrO2 nanopowder. The influence of deposition parameters i.e. concentration of molybdate and ZrO2 nanoparticles in the electrolyte, bath pH and deposition current density on the composition and surface morphology of the coating has been investigated. The structure, microhardness and corrosion properties of Ni-Mo-ZrO2 composites with different molybdenum and ZrO2 content have been also examined. It was found that ZrO2 content in the deposit is increased by rising the nanoparticles concentration in the plating solution up to 20 g dm-3. An increase in molybdate concentration in the electrolyte affects negatively the amount of codeposited ZrO2 nanoparticles. The correlation between the deposition current efficiency and ZrO2 content in the composite coating has been also observed. A decrease in deposition current efficiency leads to deposition of Ni-Mo-ZrO2 composite with low nanoparticles content. This may be explained by formation of higher amounts of gas bubbles on the cathode surface, which prevent the adsorption of ZrO2 nanoparticles on the growing deposit. The XRD analysis revealed that all the studied Ni-Mo-ZrO2 coatings were composed of a single, nanocrystalline phase with FCC structure. It was found that the incorporation of ZrO2 nanoparticles into Ni-Mo alloy matrix affects positively the microhardness and also slightly improves the corrosion properties of Ni-Mo alloy coating.

  20. CuCrZr alloy microstructure and mechanical properties after hot isostatic pressing bonding cycles

    NASA Astrophysics Data System (ADS)

    Frayssines, P.-E.; Gentzbittel, J.-M.; Guilloud, A.; Bucci, P.; Soreau, T.; Francois, N.; Primaux, F.; Heikkinen, S.; Zacchia, F.; Eaton, R.; Barabash, V.; Mitteau, R.

    2014-04-01

    ITER first wall (FW) panels are a layered structure made of the three following materials: 316L(N) austenitic stainless steel, CuCrZr alloy and beryllium. Two hot isostatic pressing (HIP) cycles are included in the reference fabrication route to bond these materials together for the normal heat flux design supplied by the European Union (EU). This reference fabrication route ensures sufficiently good mechanical properties for the materials and joints, which fulfil the ITER mechanical specifications, but often results in a coarse grain size for the CuCrZr alloy, which is not favourable, especially, for the thermal creep properties of the FW panels. To limit the abnormal grain growth of CuCrZr and make the ITER FW fabrication route more reliable, a study began in 2010 in the EU in the frame of an ITER task agreement. Two material fabrication approaches have been investigated. The first one was dedicated to the fabrication of solid CuCrZr alloy in close collaboration with an industrial copper alloys manufacturer. The second approach investigated was the manufacturing of CuCrZr alloy using the powder metallurgy (PM) route and HIP consolidation. This paper presents the main mechanical and microstructural results associated with the two CuCrZr approaches mentioned above. The mechanical properties of solid CuCrZr, PM CuCrZr and joints (solid CuCrZr/solid CuCrZr and solid CuCrZr/316L(N) and PM CuCrZr/316L(N)) are also presented.

  1. Ternary semiconductors NiZrSn and CoZrBi with half-Heusler structure: A first-principles study

    NASA Astrophysics Data System (ADS)

    Fiedler, Gregor; Kratzer, Peter

    2016-08-01

    The ternary semiconductors NiZrSn and CoZrBi with C 1b crystal structure are introduced by calculating their basic structural, electronic, and phononic properties using density functional theory. Both the gradient-corrected PBE functional and the hybrid functional HSE06 are employed. While NiZrSn is found to be a small-band-gap semiconductor (Eg=0.46 eV in PBE and 0.60 eV in HSE06), CoZrBi has a band gap of 1.01 eV in PBE (1.34 eV in HSE06). Moreover, effective masses and deformation potentials are reported. In both materials A B C , the intrinsic point defects introduced by species A (Ni or Co) are calculated. The Co-induced defects in CoZrBi are found to have a higher formation energy compared to Ni-induced defects in NiZrSn. The interstitial Ni atom (Nii) as well as the VNiNii complex introduce defect states in the band gap, whereas the Ni vacancy (VNi) only reduces the size of the band gap. While Nii is electrically active and may act as a donor, the other two types of defects may compensate extrinsic doping. In CoZrBi, only the VCoCoi complex introduces a defect state in the band gap. Motivated by the reported use of NiZrSn for thermoelectric applications, the Seebeck coefficient of both materials, both in the p -type and the n -type regimes, is calculated. We find that CoZrBi displays a rather large thermopower of up to 500 μ V /K when p doped, whereas NiZrSn possesses its maximum thermopower in the n -type regime. The reported difficulties in achieving p -type doping in NiZrSn could be rationalized by the unintended formation of Nii2 + in conjunction with extrinsic acceptors, resulting in their compensation. Moreover, it is found that all types of defects considered, when present in concentrations as large as 3%, tend to reduce the thermopower compared to ideal bulk crystals at T =600 K. For NiZrSn, the calculated thermodynamic data suggest that additional Ni impurities could be removed by annealing, leading to precipitation of a metallic Ni2ZrSn phase.

  2. Desulfurization from thiophene by SO(4)(2-)/ZrO(2) catalytic oxidation at room temperature and atmospheric pressure.

    PubMed

    Wang, Bo; Zhu, Jianpeng; Ma, Hongzhu

    2009-05-15

    Thiophene, due to its poison, together with its combustion products which causes air pollution and highly toxic characteristic itself, attracted more and more attention to remove from gasoline and some high concentration systems. As the purpose of achieving the novel method of de-thiophene assisted by SO(4)(2-)/ZrO(2) (SZ), three reactions about thiophene in different atmosphere at room temperature and atmospheric pressure were investigated. SO(4)(2-)/ZrO(2) catalyst were synthesized and characterized by X-ray photoelectron spectroscopy (XPS), Fourier transformation infrared spectroscopy (FT-IR), X-ray diffraction (XRD) and scanning electron microscope (SEM). The products were detected by gas chromatography-mass spectrometry (GC-MS). XP spectra show that ozone-catalyst system (SZO) have two forms of sulfur element (S(6+) and S(2-)) on the catalyst surface, which distinguished from that of air-catalyst system (SZA) and blank-catalyst system (SZB) (S(6+)). And the results of GC-MS exhibited that some new compounds has been produced under this extremely mild condition. Especially, many kinds of sulfur compounds containing oxygen, that is easier to be extracted by oxidative desulfurization (ODS), have been detected in the SZA-1.5h and SZB-3h system. In addition, some long chain hydrocarbons have also been detected. While in SZO-0.5h system, only long chain hydrocarbons were found. The results show that total efficiency of desulfurization from thiophene with ozone near to 100% can be obtained with the SO(4)(2-)/ZrO(2) catalytic oxidation reaction.

  3. Investigating the atomic level influencing factors of glass forming ability in NiAl and CuZr metallic glasses

    SciTech Connect

    Sedighi, Sina; Kirk, Donald Walter; Singh, Chandra Veer Thorpe, Steven John

    2015-09-21

    Bulk metallic glasses are a relatively new class of amorphous metal alloy which possess unique mechanical and magnetic properties. The specific concentrations and combinations of alloy elements needed to prevent crystallization during melt quenching remains poorly understood. A correlation between atomic properties that can explain some of the previously identified glass forming ability (GFA) anomalies of the NiAl and CuZr systems has been identified, with these findings likely extensible to other transition metal–transition metal and transition metal–metalloid (TM–M) alloy classes as a whole. In this work, molecular dynamics simulation methods are utilized to study thermodynamic, kinetic, and structural properties of equiatomic CuZr and NiAl metallic glasses in an attempt to further understand the underlying connections between glass forming ability, nature of atomic level bonding, short and medium range ordering, and the evolution of structure and relaxation properties in the disordered phase. The anomalous breakdown of the fragility parameter as a useful GFA indicator in TM–M alloy systems is addressed through an in-depth investigation of bulk stiffness properties and the evolution of (pseudo)Gruneisen parameters over the quench domain, with the efficacy of other common glass forming ability indicators similarly being analyzed through direct computation in respective CuZr and NiAl systems. Comparison of fractional liquid-crystal density differences in the two systems revealed 2-3 times higher values for the NiAl system, providing further support for its efficacy as a general purpose GFA indicator.

  4. Investigating the atomic level influencing factors of glass forming ability in NiAl and CuZr metallic glasses.

    PubMed

    Sedighi, Sina; Kirk, Donald Walter; Singh, Chandra Veer; Thorpe, Steven John

    2015-09-21

    Bulk metallic glasses are a relatively new class of amorphous metal alloy which possess unique mechanical and magnetic properties. The specific concentrations and combinations of alloy elements needed to prevent crystallization during melt quenching remains poorly understood. A correlation between atomic properties that can explain some of the previously identified glass forming ability (GFA) anomalies of the NiAl and CuZr systems has been identified, with these findings likely extensible to other transition metal-transition metal and transition metal-metalloid (TM-M) alloy classes as a whole. In this work, molecular dynamics simulation methods are utilized to study thermodynamic, kinetic, and structural properties of equiatomic CuZr and NiAl metallic glasses in an attempt to further understand the underlying connections between glass forming ability, nature of atomic level bonding, short and medium range ordering, and the evolution of structure and relaxation properties in the disordered phase. The anomalous breakdown of the fragility parameter as a useful GFA indicator in TM-M alloy systems is addressed through an in-depth investigation of bulk stiffness properties and the evolution of (pseudo)Gruneisen parameters over the quench domain, with the efficacy of other common glass forming ability indicators similarly being analyzed through direct computation in respective CuZr and NiAl systems. Comparison of fractional liquid-crystal density differences in the two systems revealed 2-3 times higher values for the NiAl system, providing further support for its efficacy as a general purpose GFA indicator.

  5. Effect of Zr on the crystallographic texture of precipitation-hardened Sm(Co,Fe,Cu,Zr)7 ribbons

    NASA Astrophysics Data System (ADS)

    Rong, Chuan-bing; Zhang, Hong-wei; He, Shu-li; Chen, Ren-jie; Shen, Bao-gen

    2005-03-01

    Sm(CobalFe0.1Cu0.1Zrw)7 (w=0.01-0.09) ribbons have been prepared by conventional melt spinning followed by precipitation hardening. The Zr addition can suppress the nucleation of solidification and increase the velocity of grain growth. This leads to the increase of texture degree of the ribbons with increasing Zr content. The crystallographic texture is still preserved in ribbons after the precipitation hardening. The remanence ratio of the heat-treated ribbons increases from 0.7 for w=0.01 to 0.9 for w=0.08. An energy product of about 10 MGOe has been obtained in the ribbon with w=0.03. The angular dependence of coercivity suggests that the magnetization reversal of the precipitation-hardened ribbons is controlled by both domain-wall pinning and nucleation mechanism.

  6. Radiation damage in cubic ZrO2 and yttria-stabilized zirconia from molecular dynamics simulations

    DOE PAGES

    Aidhy, Dilpuneet S.; Zhang, Yanwen; Weber, William J.

    2014-11-20

    Here, we perform molecular dynamics simulation on cubic ZrO2 and yttria-stabilized zirconia (YSZ) to elucidate defect cluster formation resulting from radiation damage, and evaluate the impact of Y-dopants. Interstitial clusters composed of split-interstitial building blocks, i.e., Zr-Zr or Y-Zr are formed. Moreover, oxygen vacancies control cation defect migration; in their presence, Zr interstitials aggregate to form split-interstitials whereas in their absence Zr interstitials remain immobile, as isolated single-interstitials. Y-doping prevents interstitial cluster formation due to sequestration of oxygen vacancies.

  7. Structure of Bergman-type W-TiZrNi approximants to quasicrystal, analyzed by lattice inversion method

    NASA Astrophysics Data System (ADS)

    Huang, H.; Meng, D. Q.; Lai, X. C.; Liu, T. W.; Long, Y.; Hu, Q. M.

    2014-08-01

    The combined interatomic pair potentials of TiZrNi, including Morse and Inversion Gaussian, are successfully built by the lattice inversion method. Some experimental controversies on atomic occupancies of sites 6-8 in W-TiZrNi are analyzed and settled with these inverted potentials. According to the characteristics of composition and site preference occupancy of W-TiZrNi, two stable structural models of W-TiZrNi are proposed and the possibilities are partly confirmed by experimental data. The stabilities of W-TiZrNi mostly result from the contribution of Zr atoms to the phonon densities of states in lower frequencies.

  8. First-principle study on some new spin-gapless semiconductors: The Zr-based quaternary Heusler alloys

    NASA Astrophysics Data System (ADS)

    Gao, Qiang; Xie, Huan-Huan; Li, Lei; Lei, Gang; Deng, Jian-Bo; Hu, Xian-Ru

    2015-09-01

    Employing first-principle calculations, we have investigated electronic and magnetic properties of the Zr-based quaternary Heusler alloys: ZrCoVIn, ZrFeVGe, ZrCoFeP, ZrCoCrBe and ZrFeCrZ (Z = In and Ga). Our calculation results show that all the alloys are (or nearly) spin-gapless semiconductors. The Slater-Pauling behaviours of these alloys are discussed as well. The cohesion energy and formation energy of these alloys have also been discussed, and the results indicate the studied alloys are stable.

  9. Radiation damage in cubic ZrO2 and yttria-stabilized zirconia from molecular dynamics simulations

    SciTech Connect

    Aidhy, Dilpuneet S.; Zhang, Yanwen; Weber, William J.

    2014-11-20

    Here, we perform molecular dynamics simulation on cubic ZrO2 and yttria-stabilized zirconia (YSZ) to elucidate defect cluster formation resulting from radiation damage, and evaluate the impact of Y-dopants. Interstitial clusters composed of split-interstitial building blocks, i.e., Zr-Zr or Y-Zr are formed. Moreover, oxygen vacancies control cation defect migration; in their presence, Zr interstitials aggregate to form split-interstitials whereas in their absence Zr interstitials remain immobile, as isolated single-interstitials. Y-doping prevents interstitial cluster formation due to sequestration of oxygen vacancies.

  10. Some features of the Structure Rearrangement in Mixed and Binary Zr-Ti Sol-xerogels

    NASA Astrophysics Data System (ADS)

    Gaponov, Yury A.; Amemiya, Yoshiyuki; Ito, Kazuki; Kamikubo, Hironari; Karakchiev, Lembit G.; Lyakhov, Nikolay Z.

    Process of thermal decomposition at different temperatures of the Zr/Ti sol-xerogels, chemically identical but prepared by different methods (mixed and binary), was studied by SAXS/WAXD with the use of synchrotron radiation. Primary particles in mixed and binary Zr/Ti sols have different structure and size. Using the qualitative contrast-variation method it was suggested that primary particle in mixed system consists of Ti nuclear surrounded by Zr atoms in the outer layer and the size of primary particle is about 20 nm. Primary particle in binary system consists of Zr nuclear surrounded by Ti atoms in the outer layer and the size of primary particle is about 5 nm. Multistage thermal decomposition of the Zr/Ti xerogels proceeds through an intermediate phase formation. The intermediate phase of mixed Zr/Ti sol has an amorphous anatase (TiO2) structure, which is formed presumably inside the primary particle. The intermediate phase of binary Zr/Ti sol has an amorphous structure consisting probably of the disordered metal atoms surrounded by water molecules. The final product of mixed Zr/Ti system with the crystallite size about of 10÷15 nm is formed during the third stage. The final product of binary Zr/Ti system with the crystallite size about of 20÷25 nm is formed during the second and third stages.

  11. Neutron skin thickness of {sup 90}Zr determined by charge exchange reactions

    SciTech Connect

    Yako, K.; Sakai, H.; Sagawa, H.

    2006-11-15

    Charge exchange spin-dipole (SD) excitations of {sup 90}Zr are studied by the {sup 90}Zr(p,n) and {sup 90}Zr(n,p) reactions at 300 MeV. A multipole decomposition technique is employed to obtain the SD strength distributions in the cross-section spectra. For the first time, a model-independent SD sum rule value is obtained: 148{+-}12 fm{sup 2}. The neutron skin thickness of {sup 90}Zr is determined to be 0.07{+-}0.04 fm from the SD sum rule value.

  12. Microstructure and mechanical properties of Ti-Zr-Cr biomedical alloys.

    PubMed

    Wang, Pan; Feng, Yan; Liu, Fengchao; Wu, Lihong; Guan, Shaokang

    2015-06-01

    The Ti-15Zr-xCr (0≤x≤10, wt.%) alloys were investigated to develop new biomedical materials. It was found that the phase constitutions and mechanical properties strongly depended on the Cr content. The Ti-15Zr alloy was comprised of α' phase and a small fraction of β phase was detected with adding 1wt.% Cr. With addition of 5wt.% or more, the β phase was completely retained. In addition, the ω phase was detected in the Ti-15Zr-5Cr alloy and Ti-15Zr-7Cr alloy which exhibited the highest compressive Young's modulus and the lowest ductility. On the other hand, all the Ti-15Zr-xCr alloys without ω phase exhibited high microhardness, high yield strength and superior ductility. Furthermore, the elastic energy of Ti-15Zr-10Cr alloy (5.89MJ/m(3)) with only β phase and that of Ti-15Zr-3Cr alloy (4.04MJ/m(3)) with α' phase and small fraction of β phase was higher than the elastic energy of c.p. Ti (1.25MJ/m(3)). This study demonstrated that Ti-15Zr-3Cr alloy and Ti-15Zr-10Cr alloy with superior mechanical properties are potential materials for biomedical applications.

  13. Hydriding performances and modeling of a small-scale ZrCo bed

    SciTech Connect

    Koo, D.; Lee, J.; Park, J.; Paek, S.; Chung, H.; Chang, M.H.; Yun, S.H.; Cho, S.; Jung, K.J.

    2015-03-15

    In order to evaluate the performance of the hydriding of a ZrCo bed, a small-scale getter bed of ZrCo was designed and fabricated. The results show that the hydriding time at room temperature was somewhat shorter than that at higher temperatures of ZrCo and that the performance of hydriding at low temperatures of ZrCo was better than that at high temperatures of ZrCo. The experimental results of the hydrogen pressure of hydriding (ZrCoH{sub 2.8}) at different temperatures were in agreement with the computed values using a numerical modeling equation but with a small difference during the first 10 minutes of the hydriding of ZrCo. The model is based on the Kozeny-Carman equation. The effect of a helium blanket on hydriding was measured and analyzed. The hydriding with no helium blanket in the primary vessel of ZrCo is much faster than that with a helium blanket. The hydriding at a helium concentration of 8% is slower than that at 0%. As the helium concentration increases, the hydriding of ZrCo decreases. The experimental results of the hydriding with 0 %, 4%, and 8% of helium concentration are in agreement with the calculated values but with minimal differences during the first 10 minutes.

  14. Interaction of Zr with oxidized and partially reduced ceria thin films

    NASA Astrophysics Data System (ADS)

    Wang, Weijia; Hu, Shanwei; Han, Yong; Pan, Xiao; Xu, Qian; Zhu, Junfa

    2016-11-01

    The growth and electronic properties of Zr on the ceria thin films were studied by X-ray photoelectron spectroscopy, low energy electron diffraction (LEED), scanning tunneling microscopy (STM) and work function measurements. Metallic zirconium was vapor-deposited on the well-ordered fully oxidized CeO2(111) and partially reduced CeO2-x(111) (0 < x < 0.5) thin films, which were epitaxially grown on a Ru(0001) substrate, under ultrahigh vacuum (UHV) conditions. The results show that the deposition of Zr on both ceria surfaces leads to electron transfer from Zr to ceria, accompanied by partial reduction of Ce from Ce4 + to Ce3 + states and oxidation of metallic Zr to Zr4 +. Moreover, with increasing the Zr coverage, the reduction degree of ceria films increases and eventually only Ce3 + is observed at a high coverage of Zr. The STM results suggest that Zr grows two-dimensionally (2D) on the CeO2(111) thin film at low coverages due to the strong interaction between Zr and CeO2(111).

  15. Novel Bifunctional Cyclic Chelator for 89Zr Labeling–Radiolabeling and Targeting Properties of RGD Conjugates

    PubMed Central

    2015-01-01

    Within the last years 89Zr has attracted considerable attention as long-lived radionuclide for positron emission tomography (PET) applications. So far desferrioxamine B (DFO) has been mainly used as bifunctional chelating system. Fusarinine C (FSC), having complexing properties comparable to DFO, was expected to be an alternative with potentially higher stability due to its cyclic structure. In this study, as proof of principle, various FSC-RGD conjugates targeting αvß3 integrins were synthesized using different conjugation strategies and labeled with 89Zr. In vitro stability, biodistribution, and microPET/CT imaging were evaluated using [89Zr]FSC-RGD conjugates or [89Zr]triacetylfusarinine C (TAFC). Quantitative 89Zr labeling was achieved within 90 min at room temperature. The distribution coefficients of the different radioligands indicate hydrophilic character. Compared to [89Zr]DFO, [89Zr]FSC derivatives showed excellent in vitro stability and resistance against transchelation in phosphate buffered saline (PBS), ethylenediaminetetraacetic acid solution (EDTA), and human serum for up to 7 days. Cell binding studies and biodistribution as well as microPET/CT imaging experiments showed efficient receptor-specific targeting of [89Zr]FSC-RGD conjugates. No bone uptake was observed analyzing PET images indicating high in vivo stability. These findings indicate that FSC is a highly promising chelator for the development of 89Zr-based PET imaging agents. PMID:25941834

  16. Investigation of the Thermal Stability of Nd(x)Sc(y)Zr(1-x-y)O(2-δ) Materials Proposed for Inert Matrix Fuel Applications.

    PubMed

    Hayes, John R; Grosvenor, Andrew P; Saoudi, Mouna

    2016-02-01

    Inert matrix fuels (IMF) consist of transuranic elements (i.e., Pu, Am, Np, Cm) embedded in a neutron transparent (inert) matrix and can be used to "burn up" (transmute) these elements in current or Generation IV nuclear reactors. Yttria-stabilized zirconia has been extensively studied for IMF applications, but the low thermal conductivity of this material limits its usefulness. Other elements can be used to stabilize the cubic zirconia structure, and the thermal conductivity of the fuel can be increased through the use of a lighter stabilizing element. To this end, a series of Nd(x)Sc(y)Zr(1-x-y)O(2-δ) materials has been synthesized via a co-precipitation reaction and characterized by multiple techniques (Nd was used as a surrogate for Am). The long-range and local structures of these materials were studied using powder X-ray diffraction, scanning electron microscopy, and X-ray absorption spectroscopy. Additionally, the stability of these materials over a range of temperatures has been studied by annealing the materials at 1100 and 1400 °C. It was shown that the Nd(x)Sc(y)Zr(1-x-y)O(2-δ) materials maintained a single cubic phase upon annealing at high temperatures only when both Nd and Sc were present with y ≥ 0.10 and x + y > 0.15.

  17. Identification of phases in the interaction layer between U-Mo-Zr/Al and U-Mo-Zr/Al-Si

    SciTech Connect

    Varela, C.L. Komar; Arico, S.F.; Mirandou, M.; Balart, S.N.; Gribaudo, L.M.

    2008-07-15

    Out-of-pile diffusion experiments were performed between U-7wt.% Mo-1wt.% Zr and Al or Al A356 (7,1wt.% Si) at 550 deg. C. In this work morphological characterization and phase identification on both interaction layer are presented. They were carried out by the use of different techniques: optical and scanning electron microscopy, X-Ray diffraction and WDS microanalysis. In the interaction layer U-7wt.% Mo-1wt.% Zr/Al, the phases UAl{sub 3}, UAl{sub 4}, Al{sub 20}Mo{sub 2}U and Al{sub 43}Mo{sub 4}U{sub 6} were identified. In the interaction layer U-7wt.% Mo-1wt.% Zr/Al A356, the phases U(Al, Si) with 25at.% Si and Si{sub 5}U{sub 3} were identified. This last phase, with a higher Si concentration, was identified with XRD Synchrotron radiation performed at the National Synchrotron Light Laboratory (LNLS), Campinas, Brasil. (author)

  18. [Vibrational spectrum and XPS contrastive studies on pyrochlore-type oxygen-rich Ce2Zr2O8 and oxygen-defective Nd2Zr2O7 phases].

    PubMed

    Xie, Hua; Wang, Lie-lin; Luo, De-li; Chen, Min

    2014-06-01

    Pyrochlore-type oxygen-rich Ce2Zr2O8 phase was prepared successfully by graphite reduction method. With the oxygen[U8]-defective Nd2Zr2O7 substituting for the oxidized precursor phase CeZrO3.5+Δ was carried out the structure comparative analysis with Ce2Zr2O8. The X-ray diffraction (XRD), Raman spectroscopy (Raman), infrared spectroscopy (IR) and X-ray photoelectron spectroscopy (XPS) were used to characterize the crystal structure of samples. The XRD experimental results show that Ce2Zr2O8 bulk phase contains the typical structure of pyrochlore, the superstructure peaks that characterize Ce/Zr cations ordering arrangement are very obvious, but the Zr-O ligands had also transformed from octahedrons of the co-top connection in the precursor to cubes of co-edge connection in the Ce2Zr2O8, and the formation of [ZrO8] ligand reduced greatlly the structural stability of Ce2Zr2O8 phase. Raman and IR results show that vibrational spectra bands of Ce2Zr2O8 phase increased significantly, meaning that the enriched oxygen ions result in a removal of the degeneracy peak for Ce2Zr2O8 phase, which confirms further the structural symmetry of Ce2Zr2O8 phase lower than its precursor. XPS results show that Ce (IV) characteristic peak (916.3 eV) in the Ce2Zr2O8 phase surface is very obvious. No the appearance of Ce (III) peak (885 eV) suggests that Ce3+ from the precursor has been completely oxidized into Ce4+ in the Ce2Zr2O8 phase; the Zr(3d) binding energy is close to fluorite phase with Zr4+, which confirms that [ZrO8] ligand in the Ce2Zr2O8 surface is consistent with the bulk phase. The increasing low binding energy of O(1s) shows that oxygen species in the Ce2Zr2O8 bulk phase are between lattice oxygen and adsorbed oxygen, the presence of high oxygen peak suggests that the surface of Ce2Zr2O8 contains adsorbed oxygen, and the bonding strength between adsorption oxygen and Ce2Zr2O8 bulk phase is between CeO2 and Nd2Zr2O7.

  19. Thermal stability of ultrathin ZrO{sub 2} films and structure determination of ZrSi{sub 2} islands on Si(100)

    SciTech Connect

    Schoenbohm, Frank; Fluechter, Christian Rolf; Weier, Daniel; Luehr, Tobias; Berges, Ulf; Doering, Sven; Westphal, Carsten

    2009-10-15

    The temperature dependence of ultrathin ZrO{sub 2} films on clean (2x1)-reconstructed Si(100) was studied by means of x-ray photoelectron spectroscopy and photoelectron diffraction (XPD). ZrO{sub 2} films with a thickness of approximately 11 A were grown by electron-beam evaporation. At temperatures of 650 deg. C and above it was found that the zirconia (ZrO{sub 2}) films were transformed into ZrSi{sub 2}. The temperature region of structural transformation could be narrowed to the range from 650 to 725 deg. C. During the formation of ZrSi{sub 2} all oxygen was removed from the sample surface. After annealing at 725 deg. C neither zirconia nor silicon oxide could be verified on the sample. Scanning electron microscopy (SEM) measurements showed the ZrSi{sub 2} being arranged in islands on the surface after annealing. From the combined spectroscopy, SEM, and XPD analysis a model for the internal structure of ZrSi{sub 2} is proposed.

  20. Drastic influence of minor Fe or Co additions on the glass forming ability, martensitic transformations and mechanical properties of shape memory Zr-Cu-Al bulk metallic glass composites.

    PubMed

    González, Sergio; Pérez, Pablo; Rossinyol, Emma; Suriñach, Santiago; Dolors Baró, Maria; Pellicer, Eva; Sort, Jordi

    2014-06-01

    The microstructure and mechanical properties of Zr48Cu48 - x Al4M x (M ≡ Fe or Co, x = 0, 0.5, 1 at.%) metallic glass (MG) composites are highly dependent on the amount of Fe or Co added as microalloying elements in the parent Zr48Cu48Al4 material. Addition of Fe and Co promotes the transformation from austenite to martensite during the course of nanoindentation or compression experiments, resulting in an enhancement of plasticity. However, the presence of Fe or Co also reduces the glass forming ability, ultimately causing a worsening of the mechanical properties. Owing to the interplay between these two effects, the compressive plasticity for alloys with x = 0.5 (5.5% in Zr48Cu47.5Al4Co0.5 and 6.2% in Zr48Cu47.5Al4Fe0.5) is considerably larger than for Zr48Cu48Al4 or the alloys with x = 1. Slight variations in the Young's modulus (around 5-10%) and significant changes in the yield stress (up to 25%) are also observed depending on the composition. The different microstructural factors that have an influence on the mechanical behavior of these composites are investigated in detail: (i) co-existence of amorphous and crystalline phases in the as-cast state, (ii) nature of the crystalline phases (austenite versus martensite content), and (iii) propensity for the austenite to undergo a mechanically-driven martensitic transformation during plastic deformation. Evidence for intragranular nanotwins likely generated in the course of the austenite-martensite transformation is provided by transmission electron microscopy. Our results reveal that fine-tuning of the composition of the Zr-Cu-Al-(Fe,Co) system is crucial in order to optimize the mechanical performance of these bulk MG composites, to make them suitable materials for structural applications.

  1. Partial oxidation of methanol catalyzed with Au/TiO2, Au/ZrO2 and Au/ZrO2-TiO2 catalysts

    NASA Astrophysics Data System (ADS)

    Hernández-Ramírez, E.; Wang, J. A.; Chen, L. F.; Valenzuela, M. A.; Dalai, A. K.

    2017-03-01

    Mesoporous TiO2, ZrO2 and ZrO2-TiO2 mixed oxides were synthesized by the sol-gel method and the Au/TiO2, Au/ZrO2 and Au/ZrO2-TiO2 catalysts were prepared by deposition-precipitation method using urea solution as a precipitating agent. These materials were characterized by UV-vis spectroscopy, X-ray diffraction (XRD), N2 adsorption-desorption isotherms, transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS), and in situ FTIR-pyridine (FTIR-Py) adsorption. XRD patterns of the samples confirmed the formation of ZrTiO4 phase in the ZrO2-TiO2 mixed oxides. TEM micrographs showed that nanosized gold particles on the catalyst had an average diameter smaller than 5 nm. Metallic gold (Au0) and oxidized Au species (Aunδ+) on the surface of the catalysts were evidenced by UV-vis and XPS characterization. In the partial oxidation of methanol (POM) reaction, among the six catalysts, the high metallic Au0/Au+ ratio and low surface acidity in the Au/ZrO2 catalysts are chiefly responsible for the highest hydrogen production rate in the whole temperature range between 210 and 300 °C. Methanol decomposition as secondary reaction was favored on TiO2-based catalysts at higher temperature, producing a large amount of CO. Formation of ZrO2-TiO2 solid solution resulted in generation of both Brønsted and Lewis acid sites; as a result, dehydrogenation and oxidative dehydrogenation of methanol was allowed over Au/ZrO2-TiO2 catalysts.

  2. Contribution a l'etude du comportement de dalles de ponts en beton arme de barres en PRF soumises a des charges concentrees simulant les charges de roues

    NASA Astrophysics Data System (ADS)

    Bouguerra, Kheireddine

    Au cours des dernieres annees, la deterioration des structures en beton arme a pris une ampleur sans precedent, et ce, malgre le fait que leur duree de vie en service initialement prevue est loin d'etre atteinte. La corrosion de l'armature d'acier est un des principaux facteurs reduisant la duree de vie des ponts en beton arme d'acier. Par ailleurs, l'armature en materiaux composites de polymeres renforces de fibres (PRF) constitue une solution a l'armature metallique afin de pallier au probleme de la corrosion d'acier et a la deterioration des structures en beton arme. Aussi, les barres d'armature en materiaux composites de PRF possedent une resistance en traction elevee (environ 2 a 6 fois la limite elastique de l'acier d'armature conventionnel), ce qui leur permet de constituer un renforcement structural attrayant pour les structures en beton. Le comportement d'elements structuraux en beton arme de barres en PRF est different de ceux en beton arme de barres d'acier. En effet, les barres en PRF possedent un module d'elasticite relativement plus faible que celui de l'acier et ont des proprietes d'adherence differentes de celles des barres d'acier. L'utilisation des barres d'armature en PRF pour armer les dalles de tabliers de ponts se concretise de plus en plus avec l'avancement des recherches dans ce domaine. La recherche entamee dans le cadre de cette these s'inscrit dans un programme de travaux realises au sein de la Chaire de recherche CRSNG/Industrie sur les Materiaux composites novateurs en PRF pour les infrastructures au departement de genie civil a l'Universite de Sherbrooke. Le comportement de membrures en beton arme de PRF soumis a des sollicitations mecaniques constitue un des principaux axes de recherche. Dans le cadre de cette these, une serie d'essais a ete effectuee sur huit dalles de ponts a confinement interne a grande echelle. Les parametres des essais comprennent: (1) l'epaisseur de la dalle, (2) le type et le taux d'armature transversale de l

  3. Quantification of colloidal and aqueous element transfer in soils: The dual-phase mass balance model

    USGS Publications Warehouse

    Bern, Carleton R.; Thompson, Aaron; Chadwick, Oliver A.

    2015-01-01

    Mass balance models have become standard tools for characterizing element gains and losses and volumetric change during weathering and soil development. However, they rely on the assumption of complete immobility for an index element such as Ti or Zr. Here we describe a dual-phase mass balance model that eliminates the need for an assumption of immobility and in the process quantifies the contribution of aqueous versus colloidal element transfer. In the model, the high field strength elements Ti and Zr are assumed to be mobile only as suspended solids (colloids) and can therefore be used to distinguish elemental redistribution via colloids from redistribution via dissolved aqueous solutes. Calculations are based upon element concentrations in soil, parent material, and colloids dispersed from soil in the laboratory. We illustrate the utility of this model using a catena in South Africa. Traditional mass balance models systematically distort elemental gains and losses and changes in soil volume in this catena due to significant redistribution of Zr-bearing colloids. Applying the dual-phase model accounts for this colloidal redistribution and we find that the process accounts for a substantial portion of the major element (e.g., Al, Fe and Si) loss from eluvial soil. In addition, we find that in illuvial soils along this catena, gains of colloidal material significantly offset aqueous elemental loss. In other settings, processes such as accumulation of exogenous dust can mimic the geochemical effects of colloid redistribution and we suggest strategies for distinguishing between the two. The movement of clays and colloidal material is a major process in weathering and pedogenesis; the mass balance model presented here is a tool for quantifying effects of that process over time scales of soil development.

  4. A-site- and/or B-site-modified PbZrTiO3 materials and (Pb, Sr, Ca, Ba, Mg) (Zr, Ti, Nb, Ta)O3 films having utility in ferroelectric random access memories and high performance thin film microactuators

    NASA Technical Reports Server (NTRS)

    Roeder, Jeffrey F. (Inventor); Chen, Ing-Shin (Inventor); Bilodeau, Steven (Inventor); Baum, Thomas H. (Inventor)

    2001-01-01

    A modified PbZrTiO.sub.3 perovskite crystal material thin film, wherein the PbZrTiO.sub.3 perovskite crystal material includes crystal lattice A-sites and B-sites at least one of which is modified by the presence of a substituent selected from the group consisting of (i) A-site substituents consisting of Sr, Ca, Ba and Mg, and (ii) B-site substituents selected from the group consisting of Nb and Ta. The perovskite crystal thin film material may be formed by liquid delivery MOCVD from metalorganic precursors of the metal components of the thin film, to form PZT and PSZT, and other piezoelectric and ferroelectric thin film materials. The thin films of the invention have utility in non-volatile ferroelectric memory devices (NV-FeRAMs), and in microelectromechanical systems (MEMS) as sensor and/or actuator elements, e.g., high speed digital system actuators requiring low input power levels.

  5. Corrosion resistance and in vitro response of laser-deposited Ti-Nb-Zr-Ta alloys for orthopedic implant applications.

    PubMed

    Samuel, Sonia; Nag, Soumya; Nasrazadani, Seifollah; Ukirde, Vaishali; El Bouanani, Mohamed; Mohandas, Arunesh; Nguyen, Kytai; Banerjee, Rajarshi

    2010-09-15

    While direct metal deposition of metallic powders, via laser deposition, to form near-net shape orthopedic implants is an upcoming and highly promising technology, the corrosion resistance and biocompatibility of such novel metallic biomaterials is relatively unknown and warrants careful investigation. This article presents the results of some initial studies on the corrosion resistance and in vitro response of laser-deposited Ti-Nb-Zr-Ta alloys. These new generation beta titanium alloys are promising due to their low elastic modulus as well as due the fact that they comprise of completely biocompatible alloying elements. The results indicate that the corrosion resistance of these laser-deposited alloys is comparable and in some cases even better than the currently used commercially-pure (CP) titanium (Grade 2) and Ti-6Al-4V ELI alloys. The in vitro studies indicate that the Ti-Nb-Zr-Ta alloys exhibit comparable cell proliferation but enhanced cell differentiation properties as compared with Ti-6Al-4V ELI.

  6. Effects of chemical composition and test conditions on the dynamic tensile response of Zr-based metallic glasses

    NASA Astrophysics Data System (ADS)

    Wang, F.; Laws, K. J.; Trujillo, C. P.; Brown, A. D.; Cerreta, E. K.; Hazell, P. J.; Quadir, M. Z.; Ferry, M.; Escobedo, J. P.

    2015-06-01

    The effects of impact velocity and temperature on the dynamic mechanical behavior of two bulk metallic glasses (BMG) with slightly different elemental compositions (Zr55Cu30Ni5Al30 and Zr46Cu38Ag8Al38) have been investigated. Bullet-shaped samples were accelerated by a gas gun to speeds in the 400 ~ 600m/s range and tested at room temperature and 250 °C. The specimens impacted a steel extrusion die which subjected them to high strains at high strain-rates. The extruded samples were subsequently soft recovered by using low density foams. The deformed specimens were examined by optical and electron microscopy, x-ray diffraction and hardness measurements. The characterization results aided to assess the effect of chemical composition on the microstructural evolution, i.e. phase changes or crystallization, which might influence the ductility on the nominally brittle amorphous BMGs. The most significant results from this study will be presented. School of Engineering and Information Technology, UNSW Canberra.

  7. High- and low-Am RE inclusion phases in a U-Np-Pu-Am-Zr alloy

    SciTech Connect

    Janney, Dawn E.; Madden, James W.; O'Holleran, Thomas P.; Kennedy, J. Rory

    2015-03-01

    Structural, microstructural, and microchemical data were collected from rare-earth inclusions in an as-cast U-Pu-Zr alloy with ~3 at% Am, 2% Np, and 9% rare-earth elements (La, Ce, Pr, and Nd). Two RE phases with different concentrations of Am were identified. The composition of high-Am RE inclusions is ~2-5 at% La, 15-20 % Ce, 5-10% Pr, 25-45% Nd, 1% Np, 5-10% Pu, and 10-20% Am. Some areas also have O, although this does not appear to be an essential part of the high-Am RE phase. The inclusions have a face-centered cubic structure with a lattice parameter a ~ 0.54 nm. The composition of the only low-Am RE inclusion studied in detail is ~~35-40 at% O, 40-45 % Nd, 1-2% Zr, 4-5% La, 9-10% Ce, and 6-7% Pr. This inclusion is an oxide with a crystal structure similar to the room-temperature structure of Nd2O3. Microstructural features suggest that oxidation occurred during casting, and that early crystallization of high-temperature oxides led to formation of two distinct RE phases.

  8. Enhancement of the electrochemical behaviour and biological performance of Ti-25Ta-5Zr alloy by thermo-mechanical processing.

    PubMed

    Cimpean, Anisoara; Vasilescu, Ecaterina; Drob, Paula; Cinca, Ion; Vasilescu, Cora; Anastasescu, Mihai; Mitran, Valentina; Drob, Silviu Iulian

    2014-05-01

    A new Ti-25Ta-5Zr alloy based only on non-toxic and non-allergic elements was elaborated in as-cast and thermo-mechanical processed, recrystallized states (XRD and SEM) in order to be used as candidate material for implant applications. Its long-term interactions with Ringer-Brown and Ringer solutions of different pH values and its cytocompatibility were determined. The thermo-mechanically processed alloy has nobler electrochemical behaviour than as-cast alloy due to finer microstructure obtained after the applied treatment. Corrosion and ion release rates presented the lowest values for the treated alloy. Nyquist and Bode plots displayed higher impedance values and phase angles for the processed alloy, denoting a more protective passive film. SEM micrographs revealed depositions from solutions that contain calcium, phosphorous and oxygen ions (EDX analysis), namely calcium phosphate. An electric equivalent circuit with two time constants was modelled. Cell culture experiments with MC3T3-E1 pre-osteoblasts demonstrated that thermo-mechanically processed Ti-25Ta-5Zr alloy supports a better cell adhesion and spreading, and enhanced cell proliferation. Altogether, these data indicate that thermo-mechanical treatment endows the alloy with improved anticorrosion and biological performances.

  9. Development and investigation of the structure and physical and mechanical properties of low-modulus Ti-Zr-Nb alloys

    NASA Astrophysics Data System (ADS)

    Grib, S. V.; Illarionov, A. G.; Popov, A. A.; Ivasishin, O. M.

    2014-06-01

    The criteria for the optimization of chemical composition of Ti-Zr-Nb alloys have been selected that allow for obtaining materials with low elastic moduli and which have been used to melt alloys 50Ti-(50 - x) Zr- xNb, at 15 < x < 20 at %. Transmission electron microscopy and X-ray diffraction analysis have been used to study the phase composition of the as-cast alloys and alloys after homogenizing annealing. The minimum elastic modulus (69 GPa) and minimum microhardness (2440 MPa) have been found in the almost single-β-phase alloy with a maximum niobium content (17.1 at %). An increase in the volume fraction of α″ phase in the alloys with a lower niobium content (to 15 at %) promotes the growth of values of these properties. The phase transformations that occur during the continuous heating of homogenized alloys have been studied. The dependence of the temperature of the polymorphic (α + β)-β transformation on the ratio of the alloying elements in the studied alloys have been shown.

  10. Laser shock peening on Zr-based bulk metallic glass and its effect on plasticity: Experiment and modeling

    DOE PAGES

    Cao, Yunfeng; Xie, Xie; Antonaglia, James; ...

    2015-05-20

    The Zr-based bulk metallic glasses (BMGs) are a new family of attractive materials with good glass-forming ability and excellent mechanical properties, such as high strength and excellent wear resistance, which make them candidates for structural and biomedical materials. Although the mechanical behavior of BMGs has been widely investigated, their deformation mechanisms are still poorly understood. In particular, their poor ductility significantly impedes their industrial application. In the present work, we show that the ductility of Zr-based BMGs with nearly zero plasticity is improved by a laser shock peening technique. Moreover, we map the distribution of laser-induced residual stresses via themore » micro-slot cutting method, and then predict them using a three dimensional finite-element method coupled with a confined plasma model. Reasonable agreement is achieved between the experimental and modeling results. The analysis of serrated flow reveals plentiful and useful information of the underlying deformation process. As a result, our work provides an easy and effective way to extend the ductility of intrinsically-brittle BMGs, opening up wider applications of these materials.« less

  11. Laser Shock Peening on Zr-based Bulk Metallic Glass and Its Effect on Plasticity: Experiment and Modeling

    PubMed Central

    Cao, Yunfeng; Xie, Xie; Antonaglia, James; Winiarski, Bartlomiej; Wang, Gongyao; Shin, Yung C.; Withers, Philip J.; Dahmen, Karin A.; Liaw, Peter K.

    2015-01-01

    The Zr-based bulk metallic glasses (BMGs) are a new family of attractive materials with good glass-forming ability and excellent mechanical properties, such as high strength and good wear resistance, which make them candidates for structural and biomedical materials. Although the mechanical behavior of BMGs has been widely investigated, their deformation mechanisms are still poorly understood. In particular, their poor ductility significantly impedes their industrial application. In the present work, we show that the ductility of Zr-based BMGs with nearly zero plasticity is improved by a laser shock peening technique. Moreover, we map the distribution of laser-induced residual stresses via the micro-slot cutting method, and then predict them using a three-dimensional finite-element method coupled with a confined plasma model. Reasonable agreement is achieved between the experimental and modeling results. The analyses of serrated flows reveal plentiful and useful information of the underlying deformation process. Our work provides an easy and effective way to extend the ductility of intrinsically-brittle BMGs, opening up wider applications of these materials. PMID:25991412

  12. Laser shock peening on Zr-based bulk metallic glass and its effect on plasticity: Experiment and modeling

    SciTech Connect

    Cao, Yunfeng; Xie, Xie; Antonaglia, James; Winiarski, Bartlomiej; Wang, Gongyao; Shin, Yung C.; Withers, Philip J.; Dahmen, Karin A.; Liaw, Peter K.

    2015-05-20

    The Zr-based bulk metallic glasses (BMGs) are a new family of attractive materials with good glass-forming ability and excellent mechanical properties, such as high strength and excellent wear resistance, which make them candidates for structural and biomedical materials. Although the mechanical behavior of BMGs has been widely investigated, their deformation mechanisms are still poorly understood. In particular, their poor ductility significantly impedes their industrial application. In the present work, we show that the ductility of Zr-based BMGs with nearly zero plasticity is improved by a laser shock peening technique. Moreover, we map the distribution of laser-induced residual stresses via the micro-slot cutting method, and then predict them using a three dimensional finite-element method coupled with a confined plasma model. Reasonable agreement is achieved between the experimental and modeling results. The analysis of serrated flow reveals plentiful and useful information of the underlying deformation process. As a result, our work provides an easy and effective way to extend the ductility of intrinsically-brittle BMGs, opening up wider applications of these materials.

  13. Polaron-electron assisted giant dielectric dispersion in SrZrO3 high-k dielectric

    NASA Astrophysics Data System (ADS)

    Borkar, Hitesh; Barvat, Arun; Pal, Prabir; Shukla, A. K.; Pulikkotil, J. J.; Kumar, Ashok

    2016-06-01

    The SrZrO3 is a well known high-k dielectric constant (˜22) and high optical bandgap (˜5.8 eV) material and one of the potential candidates for future generation nanoelectronic logic elements (8 nm node technology) beyond silicon. Its dielectric behavior is fairly robust and frequency independent till 470 K; however, it suffers a strong small-polaron based electronic phase transition (Te) linking 650 to 750 K. The impedance spectroscopy measurements revealed the presence of conducting grains and grain boundaries at elevated temperature which provide energetic mobile charge carriers with activation energy in the range of 0.7 to 1.2 eV supporting the oxygen ions and proton conduction. X-ray photoemission spectroscopy measurements suggest the presence of weak non-stoichiometric O2- anions and hydroxyl species bound to different sites at the surface and bulk. These thermally activated charge carriers at elevated temperature significantly contribute to the polaronic based dielectric anomaly and conductivity. Our dielectric anomaly supports pseudo phase transition due to high degree of change in ZrO6 octahedral angle in the temperature range of 650-750 K, where electron density and phonon vibration affect the dielectric and conductivity properties.

  14. Phase Characteristics of a U-20Pu-3Am-2Np-15Zr Metallic Alloy Containing Rare Earths

    SciTech Connect

    Douglas E. Burkes; J. Rory Kennedy; Thomas Hartmann; Cynthia A. Papesch

    2009-12-01

    Metallic fuel alloys consisting of uranium, plutonium, and zirconium with minor additions of americium and neptunium are under evaluation for potential use to transmute long-lived transuranic actinide isotopes in fast reactors. The current irradiation test series design, designated AFC2, includes minor additions of rare earth elements to simulate expected fission product carry-over from the electrochemical molten salt reprocessing technique. The metal fuel alloys have been fabricated by an arc casting technique. The as-cast fuel alloys have been investigated for phase and thermal properties, specifically, enthalpies of transition, transition temperatures, and room temperature phase characteristics. Results and observations related to these characteristics for the “fresh” fuel alloys are provided. The alloy compositions are based on a U-20Pu-3Am-2Np-15Zr alloy, along with additions of 1 and 1.5 wt% RE (at the expense of U) where RE denotes rare earth alloy of cerium, lanthanum, praseodymium and neodymium). Phase behavior and associated transitions have been compared to available U-Pu-Zr ternary diagrams with acceptable agreement. Enthalpies of transition were deconvoluted from heating and cooling thermal traces for relatively reliable values. The rare earth additions to the base alloy have a minimal influence on the room temperature phases present, but the room temperature phases present slightly impacted the enthalpies of transition and transition temperatures.

  15. High temperature oxidation behavior of austenitic stainless steel AISI 304 in steam of nanofluids contain nanoparticle ZrO2

    SciTech Connect

    Prajitno, Djoko Hadi Syarif, Dani Gustaman

    2014-03-24

    The objective of this study is to evaluate high temperature oxidation behavior of austenitic stainless steel SS 304 in steam of nanofluids contain nanoparticle ZrO{sub 2}. The oxidation was performed at high temperatures ranging from 600 to 800°C. The oxidation time was 60 minutes. After oxidation the surface of the samples was analyzed by different methods including, optical microscope, scanning electron microscope (SEM) and X-ray diffraction (XRD). X-ray diffraction examination show that the oxide scale formed during oxidation of stainless steel AISI 304 alloys is dominated by iron oxide, Fe{sub 2}O{sub 3}. Minor element such as Cr{sub 2}O{sub 3} is also appeared in the diffraction pattern. Characterization by optical microscope showed that cross section microstructure of stainless steel changed after oxidized with the oxide scale on the surface stainless steels. SEM and x-ray diffraction examination show that the oxide of ZrO{sub 2} appeared on the surface of stainless steel. Kinetic rate of oxidation of austenite stainless steel AISI 304 showed that increasing oxidation temperature and time will increase oxidation rate.

  16. Atomic layer chemical vapor deposition of ZrO2-based dielectric films: Nanostructure and nanochemistry

    NASA Astrophysics Data System (ADS)

    Dey, S. K.; Wang, C.-G.; Tang, D.; Kim, M. J.; Carpenter, R. W.; Werkhoven, C.; Shero, E.

    2003-04-01

    A 4 nm layer of ZrOx (targeted x˜2) was deposited on an interfacial layer (IL) of native oxide (SiO, t˜1.2 nm) surface on 200 mm Si wafers by a manufacturable atomic layer chemical vapor deposition technique at 300 °C. Some as-deposited layers were subjected to a postdeposition, rapid thermal annealing at 700 °C for 5 min in flowing oxygen at atmospheric pressure. The experimental x-ray diffraction, x-ray photoelectron spectroscopy, high-resolution transmission electron microscopy, and high-resolution parallel electron energy loss spectroscopy results showed that a multiphase and heterogeneous structure evolved, which we call the Zr-O/IL/Si stack. The as-deposited Zr-O layer was amorphous ZrO2-rich Zr silicate containing about 15% by volume of embedded ZrO2 nanocrystals, which transformed to a glass nanoceramic (with over 90% by volume of predominantly tetragonal-ZrO2 (t-ZrO2) and monoclinic-ZrO2 (m-ZrO2) nanocrystals) upon annealing. The formation of disordered amorphous regions within some of the nanocrystals, as well as crystalline regions with defects, probably gave rise to lattice strains and deformations. The interfacial layer (IL) was partitioned into an upper SiO2-rich Zr silicate and the lower SiOx. The latter was substoichiometric and the average oxidation state increased from Si0.86+ in SiO0.43 (as-deposited) to Si1.32+ in SiO0.66 (annealed). This high oxygen deficiency in SiOx was indicative of the low mobility of oxidizing specie in the Zr-O layer. The stacks were characterized for their dielectric properties in the Pt/{Zr-O/IL}/Si metal oxide-semiconductor capacitor (MOSCAP) configuration. The measured equivalent oxide thickness (EOT) was not consistent with the calculated EOT using a bilayer model of ZrO2 and SiO2, and the capacitance in accumulation (and therefore, EOT and kZr-O) was frequency dispersive, trends well documented in literature. This behavior is qualitatively explained in terms of the multilayer nanostructure and nanochemistry that

  17. Thermodynamic Modeling and Experimental Study of the Fe-Cr-Zr System

    SciTech Connect

    Yang, Ying; Tan, Lizhen; Bei, Hongbin; Busby, Jeremy T

    2013-01-01

    Wide applications of zircaloys, stainless steels and their interactions in nuclear reactors require the knowledge on phase stability and thermodynamic property of the Fe-Cr-Zr system. This knowledge is also important to develop new Zr-contained Fe-Cr ferritic steels. This work aims at developing thermodynamic models for describing phase stability and thermodynamic property of the Fe-Cr-Zr system using the Calphad approach coupled with experimental study. Thermodynamic descriptions of the Fe-Cr and Cr-Zr systems were either directly adopted or slightly modified from literature. The Fe-Zr system has been remodeled to accommodate recent ab-initio calculation of formation enthalpies of various Fe-Zr compounds. Reliable ternary experimental data and thermodynamic models were mainly available in the Zr-rich region. Therefore, selected ternary alloys located in the vicinity of the eutectic valley of (Fe,Cr,Zr) and (Fe,Cr)2Zr laves phase in the Fe-rich region have been experimentally investigated in this study. Microstructure has been examined by using scanning electron microscope, energy-dispersive Xray spectroscopy and X-ray diffraction. These experimental results, along with the literature data were then used to develop thermodynamic models for phases in the Fe-Cr-Zr system. Calculated phase equilibria and thermodynamic properties of the ternary system yield satisfactory agreements with available experimental data, which gives the confidence to use these models as building blocks for developing a Zr, Fe and Cr contained multicomponent thermodynamic database for broader applications in nuclear reactors.

  18. Positionsbestimmung des Unternehmens: Interne und externe Analyse

    NASA Astrophysics Data System (ADS)

    Bergmann, Lars; Crespo, Isabel; Portmann, Stefan

    Die Initiierung und Lenkung von Maßnahmen zur integrierten Modernisierung zielen auf die Verbesserung der Wettbewerbsfähigkeit eines Unternehmens ab. Damit diese Maßnahmen zielgerichtet die Wettbewerbsfähigkeit verbessern können, ist Wissen über die bestehende Wettbewerbsfähigkeit sowie über die bestehenden Fähigkeiten eine zentrale Voraussetzung. Eine zielgerichtete Auswahl problemadäquater Maßnahmen zur Verbesserung der Wettbewerbsfähigkeit bedarf daher im Vorfeld einer Bewertung der aktuellen Situation des Unternehmens im Sinne einer Positionsbestimmung. Erst wenn die internen Stärken und Schwächen sowie die externen Chancen und Risiken identifiziert sind, kann ein ganzheitliches Bild von der Position eines Unternehmens in seiner Umwelt gewonnen werden. Auf Basis der Kenntnisse über die Position des Unternehmens können anschließend zielgerichtet Maßnahmen ausgewählt werden, die einen Beitrag zur Verbesserung der Wettbewerbsfähigkeit des Unternehmens haben. Damit kommt der Positionsbestimmung als initialer Schritt des Prozesses der strategischen Unternehmensplanung eine zentrale Bedeutung im Rahmen der integrierten Modernisierung zu. Erfolgt die Auswahl von Maßnahmen ohne eine vorherige Positionsbestimmung, also lediglich auf Basis drängender Probleme, so besteht die Gefahr einer unbedachten und nur auf das "hier und heute“ bezogenen Schwerpunktbildung ohne Berücksichtigung der mittel- und langfristigen Ziele des Unternehmens.

  19. Responses of bone-forming cells on pre-immersed Zr-based bulk metallic glasses: Effects of composition and roughness.

    PubMed

    Huang, L; Cao, Z; Meyer, H M; Liaw, P K; Garlea, E; Dunlap, J R; Zhang, T; He, W

    2011-01-01

    Bulk metallic glasses (BMGs) demonstrate attractive properties for potential biomedical applications, owing to their amorphous structure. The present work has investigated the biocompatibility of Zr-based BMGs by studying the cellular behavior of bone-forming mouse MC3T3-E1 pre-osteoblast cells. A Ti-6Al-4V alloy was used as a reference material. Pre-immersion treatment was performed on BMG samples in phosphate-buffered saline prior to cell experiments. The effects of 1at.% yttrium alloying and surface roughness on cellular behavior were examined. The general biosafety of Zr-based BMGs for MC3T3-E1 cells was revealed as normal cell responses. Pre-immersion treatment was found to effectively reduce the surface concentrations of alloying elements. Micro-alloying with 1 at.% yttrium did not significantly affect cell adhesion and proliferation, but slightly decreased alkaline phosphatase (ALP) activity on rough surfaces. Lower cell adhesion and proliferation were found on smooth surfaces of Zr-based BMGs compared to their rougher counterparts. Higher ALP activity was detected on rougher surfaces. To obtain a mechanistic understanding surface free energy was correlated with cell adhesion.

  20. Electrical and structural properties of group-4 transition-metal nitride (TiN, ZrN, and HfN) contacts on Ge

    SciTech Connect

    Yamamoto, Keisuke; Nakashima, Hiroshi; Noguchi, Ryutaro; Wang, Dong; Mitsuhara, Masatoshi; Nishida, Minoru; Hara, Toru

    2015-09-21

    Electrical and structural properties were investigated for group-4 transition-metal nitride contacts on Ge (TiN/Ge, ZrN/Ge, and HfN/Ge), which were prepared by direct sputter depositions using nitride targets. These contacts could alleviate the intrinsic Fermi-level pinning (FLP) position toward the conduction band edge. It was revealed that this phenomenon is induced by an amorphous interlayer (a-IL) containing nitrogen atoms at the nitride/Ge interfaces. The strength of FLP alleviation positively depended on the thickness of a-IL. TiN/Ge and ZrN/Ge contacts with ∼2 nm-thick a-ILs showed strong FLP alleviations with hole barrier heights (Φ{sub BP}) in the range of 0.52–56 eV, and a HfN/Ge contact with an ∼1 nm-thick a-IL showed a weaker one with a Φ{sub BP} of 0.39 eV. However, TaN/Ge contact without a-IL did not show such FLP alleviation. Based on the results of depth distributions for respective elements, we discussed the formation kinetics of a-ILs at TiN/Ge and ZrN/Ge interfaces. Finally, we proposed an interfacial dipole model to explain the FLP alleviation.

  1. Zr electrorefining process for the treatment of cladding hull waste in LiCl-KCl molten salts

    SciTech Connect

    Lee, Chang Hwa; Lee, You Lee; Jeon, Min Ku; Kang, Kweon Ho; Choi, Yong Taek; Park, Geun Il

    2013-07-01

    Zr electrorefining for the treatment of Zircaloy-4 cladding hull waste is demonstrated in LiCl-KCl-ZrCl{sub 4} molten salts. Although a Zr oxide layer thicker than 5 μm strongly inhibits the Zr dissolution process, pre-treatment processes increases the dissolution kinetics. For 10 g-scale experiments, the purities of the recovered Zr were 99.54 wt.% and 99.74 wt.% for fresh and oxidized cladding tubes, respectively, with no electrical contact issue. The optimal condition for Zr electrorefining has been found to improve the morphological feature of the recovered Zr, which reduces the salt incorporation by examining the effect of the process parameters such as the ZrCl{sub 4} concentration and the applied potential.

  2. Les Elements Legers: Diffusion dans les Enveloppes Stellaires et Implications Cosmologiques

    NASA Astrophysics Data System (ADS)

    Richer, Jacques

    1992-01-01

    Les observations des abondances des elements legers (Z <= 5) sont utilisees pour estimer la quantitie de lithium qui a ete produite lors du Big -Bang, et obtenir simultanement des contraintes sur la nature des inhomogeneites qui ont pu exister durant la nucleosynthese primordiale. Nous utilisons un modele simple capable de simuler approximativement la diffusion et la retro-diffusion des neutrons a travers la matiere inhomogene durant les premieres minutes de l'expansion de l'Univers. Nous tenons compte de la difference possible entre l'abondance primordiale de Li et les abondances observees dans les plus vieilles etoiles. Cette difference (un facteur 2, environ) est estimee en construisant des modeles evolutifs d'etoiles peu massives de Population II, incluant la sedimentation gravitationnelle du lithium et de l'helium. Ces modeles montrent egalement que les ages des vieux amas stellaires sont grandement surestimes lorsqu'ils sont determines a partir de modeles stellaires n'incluant pas l'effet de la diffusion de He. Nous calculons ensuite comment evoluent les abondances de Li et Be dans des etoiles plus massives et plus jeunes, de la pre-sequence principale ou de la ZAMS, jusqu'a l'epuisement de leur hydrogene central. Les modeles incluent la sedimentation simultanee de l'helium a travers l'enveloppe. Une approche hierarchique (evolution du coeur--evolution de l'enveloppe --tri des elements traces) est utilisee pour simuler efficacement le grand nombre d'etoiles necessaire pour la construction d'isochrones. Une attention particuliere est portee aux consequences de la sedimentation de He sur l'etendue des zones convectives, et sur la diffusion de Li et Be. Les forces radiatives agissant sur ces deux elements sont calculees en detail a partir des donnees atomiques. Les etoiles simulees correspondent approximativement aux types spectraux A, F, et AmFm. Les abondances de Li et Be observees dans les etoiles jeunes de ces types sont comparees a nos predictions dans le

  3. Neutrinoless double-β decay and nuclear transition matrix elements

    SciTech Connect

    Rath, P. K.

    2015-10-28

    Within mechanisms involving the light Majorana neutrinos, squark-neutrino, Majorons, sterile neutrinos and heavy Majorana neutrino, nuclear transition matrix elements for the neutrinoless (β{sup −}β{sup −}){sub 0ν} decay of {sup 96}Zr, {sup 100}Mo, {sup 128,130}Te and {sup 150}Nd nuclei are calculated by employing the PHFB approach. Effects due to finite size of nucleons, higher order currents, short range correlations, and deformations of parent as well as daughter nuclei on the calculated matrix elements are estimated. Uncertainties in nuclear transition matrix elements within long-ranged mechanisms but for double Majoron accompanied (β{sup −}β{sup −}ϕϕ){sub 0ν} decay modes are 9%–15%. In the case of short ranged heavy Majorona neutrino exchange mechanism, the maximum uncertainty is about 35%. The maximum systematic error within the mechanism involving the exchange of light Majorana neutrino is about 46%.

  4. Effects of Zr impurity on microscopic behavior of Hf metal

    NASA Astrophysics Data System (ADS)

    Dey, S. K.; Dey, C. C.; Saha, S.

    2016-08-01

    Hf metal with ∼ 3 wt% Zr impurity has been reinvestigated by perturbed angular correlation (PAC) spectroscopy using a LaBr3(Ce)-BaF2 detector set up to understand the microscopic behavior of this metal with temperature. From present measurements, five quadrupole interaction frequencies have been found at room temperature where both pure hcp fraction (∼33%) with 12 nearest neighbor Hf surrounding the probe 181Hf atom and the probe-impurity fraction (∼33%) corresponding to 11 nearest neighbor Hf plus one dissimilar Zr atom are clearly distinguished. At room temperature, the results for quadrupole frequency and asymmetry parameter are found to be ωQ=51.6(4) Mrad/s, η=0.20(4) for the impurity fraction and ωQ=46.8(2) Mrad/s, η=0 for the pure fraction with values of frequency distribution width δ=0 for both components. At 77 K, only 1 NN Zr impurity (∼93%) and pure hcp (∼7%) components have been found with a value of δ ∼ 10% for the impurity fraction. A drastic change in microstructural configuration of Hf metal is observed at 473 K where the impurity fraction increases to ∼ 50% and the pure hcp fraction reduces to ∼ 15% with abrupt changes in quadrupole frequencies for both components. The pure fraction then increases with temperature and enhances to ∼50% at 973 K. In the temperature range 473-973 K, quadrupole frequencies for both components are found to decrease slowly with temperature. Using the Arrhenius relation, binding energy (B) for the probe-impurity pair and the entropy of formation are measured from temperature dependent fractions of probe-impurity and pure hcp in the temperature range 473-773 K. The three other minor components found at different temperatures are attributed to crystalline defects.

  5. The Visible Spectrum of Zirconium Dioxide, ZrO2

    NASA Astrophysics Data System (ADS)

    Le, Anh; Steimle, Timothy C.; Gupta, Varun; Maier, John P.

    2011-06-01

    Zirconia (ZrO2) is an important material with applications in microelectronics, catalysis, and ceramics. Previously the photoelectron spectrum of the ZrO2 anion and the pure rotation spectrum of the neutral have been recorded and analyzed. Here we present the first observation of the visible spectrum of ZrO2 via laser induced fluorescence (LIF) and resonance enhanced multi-photon ionization (REMPI). The LIF spectrum was recorded between 17000-18900 Cm-1 at a resolution of 0.2 Cm-1 using pulsed dye laser excitation and tentatively analyzed to give harmonic vibrational parameters ω1, ω2, and ω3 for the tilde{A}1B2 state of 495(1) Cm-1, 150(3) Cm-1 and 1045(4) Cm-1, respectively. Dispersed fluorescence spectra of thirteen bands were recorded and analyzed to give harmonic vibrational parameters ω1, ω2, and ω3 for the X1A1 state of 898 (1) Cm-1, 287(3) Cm-1 and 808(4) Cm-1, respectively. The radiative lifetimes of numerous bands have been measured and analyzed. Franck-Condon factors were calculated and used to model the REMPI and excitation spectra. A comparison with TiO2 is made. O.C. Thomas; S. Xu; T.P. Lippa; and K.H. Bowen Journal of Cluster Science 10(4) 525 ,1999 W.Zheng; K.H. Bowen JPCA. 109 11521, 2005 D.J. Brugh; R.D. Suenram JCP {11}(8), 3526,1999 X. Zhuang; A. Le; T.C. Steimle; R. Magarajan; V. Gupta; and J.P. Maier PCCP {12} 15018, 2010

  6. Cross-Correlating DES and SPT

    NASA Astrophysics Data System (ADS)

    Baxter, Eric

    2017-01-01

    The Dark Energy Survey (DES) and the South Pole Telescope (SPT) provide a uniquely powerful combination of overlapping optical imaging and cosmic microwave background (CMB) data. Cross-correlations between DES and SPT are expected to arise from several physical effects, including gravitational lensing, the Sunyaev-Zel'dovich (SZ) effect, and the Integrated Sachs-Wolfe effect. The resultant correlations contain information not accessible to either experiment on its own. Measurement of these correlations offers several exciting possibilities, such as improved cosmological parameter constraints, improved understanding of systematics affecting the two experiments, and calibration of the masses of galaxy clusters at high redshift. In this talk I will summarize recent results obtained by cross-correlating early DES data with data from the SPT-SZ survey and will discuss prospects for future cross-correlation measurements with these two surveys.

  7. Dynamic DDES On DES Type Grid

    NASA Astrophysics Data System (ADS)

    Yin, Zifei; Durbin, Paul

    2014-11-01

    A dynamic procedure allows a DES formulation that we developed to adjustCDES for different flow configurations. Similarly to the dynamic Smagorinsky model, the grid is required to be fine enough to resolve a significant portion of the inertial range. In some cases, that requirement conflicts with the goal of DES to cut down computing cost. The current effort is therefore to determine a properCDES value by approximately recovering some unresolved small scales from primary, filtered solution. Repeated test filtering is adopted here to compute the approximation of the unfiltered solution. The formulation is based on the dynamicl2 w DDES model and different geometries with varies grid resolution are tested to determine the applicability of proposed formultion on DES type grids.

  8. Catalyst for elemental sulfur recovery process

    DOEpatents

    Flytzani-Stephanopoulos, Maria; Liu, Wei

    1995-01-01

    A catalytic reduction process for the direct recovery of elemental sulfur from various SO.sub.2 -containing industrial gas streams. The catalytic process provides high activity and selectivity, as well as stability in the reaction atmosphere, for the reduction of SO.sub.2 to elemental sulfur product with carbon monoxide or other reducing gases. The reaction of sulfur dioxide and reducing gas takes place over a metal oxide composite catalyst having one of the following empirical formulas: [(OF.sub.2).sub.1-n (RO.sub.1)n].sub.1-k M.sub.k, [(FO.sub.2).sub.1-n (RO.sub.1.5).sub.n ].sub.1-k M.sub.k, or [Ln.sub.x Zr.sub.1-x O.sub.2-0.5x ].sub.1-k M.sub.k wherein FO.sub.2 is a fluorite-type oxide; RO represents an alkaline earth oxide; RO.sub.1.5 is a Group IIIB or rare earth oxide; Ln is a rare earth element having an atomic number from 57 to 65 or mixtures thereof; M is a transition metal or a mixture of transition metals; n is a number having a value from 0.0 to 0.35; k is a number having a value from 0.0 to about 0.5; and x is a number having a value from about 0.45 to about 0.55.

  9. The corrosion behaviour of Ti-6Al-4V, Ti-6Al-7Nb and Ti-13Nb-13Zr in protein solutions.

    PubMed

    Khan, M A; Williams, R L; Williams, D F

    1999-04-01

    Ti alloys are used in orthopaedic applications owing to their appropriate mechanical properties and their excellent corrosion resistance. The release of titanium and the other alloying elements into the surrounding tissue has been reported due either to passive corrosion or accelerating processes such as wear. Since the passive layer can be broken down in certain circumstances by wear it is important to study the ability of these alloys to repassivate in biological environments, in particular in the presence of proteins, and evaluate how the repassivated surface may vary from the original surface. In this study we investigated the ability of Ti-6Al-4V, Ti-6Al-7Nb and Ti-13Nb-13Zr to repassivate in phosphate buffered saline (PBS), bovine albumin solutions in PBS and 10% foetal calf serum in PBS at different pH values and at different albumin concentrations. It was found that an increase in pH had a greater effect on the corrosion behaviour of Ti-6Al-4V and Ti-6Al-7Nb than on Ti-13Nb-13Zr in PBS and that the addition of protein to the PBS reduced the influence of pH on the corrosion behaviour of all the alloys. The effect of the corrosion and repassivation was investigated by measuring changes in the surface hardness of the alloys and it was found that corrosion reduced the hardness of the surface oxides of all the alloys. In PBS the reduction was smallest for Ti-6Al-4V and largest for Ti-13Nb- 3Zr and that corrosion in protein solutions further reduced the hardness of the surface oxides. This effect was greater for Ti-6Al-4V and Ti-6Al-7Nb than for Ti-13Nb-13Zr. In conclusion, proteins in the environment appear to interact with the repassivation process at the surface of these alloys and influence the resulting surface properties.

  10. Fully ALD-grown TiN/Hf0.5Zr0.5O2/TiN stacks: Ferroelectric and structural properties

    NASA Astrophysics Data System (ADS)

    Zarubin, Sergei; Suvorova, Elena; Spiridonov, Maksim; Negrov, Dmitrii; Chernikova, Anna; Markeev, Andrey; Zenkevich, Andrei

    2016-11-01

    Since the discovery of ferroelectricity (FE) in HfO2-based thin films, they are gaining increasing attention as a viable alternative to conventional FE in the next generation of non-volatile memory devices. In order to further increase the density of elements in the integrated circuits, it is essential to adopt a three-dimensional design. Since atomic layer deposition (ALD) processes are extremely conformal, ALD is the favored approach in the production of 3D ferroelectric random access memory. Here, we report the fabrication of fully ALD-grown capacitors comprising a 10-nm-thick FE Hf0.5Zr0.5O2 layer sandwiched between TiN electrodes, which are subjected to a detailed investigation of the structural and functional properties. The robust FE properties of Hf0.5Zr0.5O2 films in capacitors are established by several alternative techniques. We demonstrate a good scalability of TiN/Hf0.5Zr0.5O2/TiN FE capacitors down to 100-nm size and the polarization retention in the test "one transistor-one capacitor" (1T-1C) cells after 1010 writing cycles. The presence of a non-centrosymmetric orthorhombic phase responsible for FE properties in the alloyed polycrystalline Hf0.5Zr0.5O2 films is established by transmission electron microscopy. Given the ability of the ALD technique to grow highly conformal films and multilayered structures, the obtained results indicate the route for the design of FE non-volatile memory devices in 3D integrated circuits.

  11. Unreported Emission Lines of Rb, Ce, La, Sr, Y, Zr, Pb and Se Detected Using Laser-Induced Breakdown Spectroscopy

    NASA Technical Reports Server (NTRS)

    Lepore, K. H.; Mackie, J.; Dyar, M. D.; Fassett, C. I.

    2017-01-01

    Information on emission lines for major and minor elements is readily available from the National Institute of Standards and Technology (NIST) as part of the Atomic Spectra Database. However, tabulated emission lines are scarce for some minor elements and the wavelength ranges presented on the NIST database are limited to those included in existing studies. Previous work concerning minor element calibration curves measured using laser-induced break-down spectroscopy found evidence of Zn emission lines that were not documented on the NIST database. In this study, rock powders were doped with Rb, Ce, La, Sr, Y, Zr, Pb and Se in concentrations ranging from 10 percent to 10 parts per million. The difference between normalized spectra collected on samples containing 10 percent dopant and those containing only 10 parts per million were used to identify all emission lines that can be detected using LIBS (Laser-Induced Breakdown Spectroscopy) in a ChemCam-like configuration at the Mount Holyoke College LIBS facility. These emission spectra provide evidence of many previously undocumented emission lines for the elements measured here.

  12. Preparation of SrZrO3 Thermal Barrier Coating by Solution Precursor Plasma Spray

    NASA Astrophysics Data System (ADS)

    Li, Xinhui; Ma, Wen; Wen, Jing; Bai, Yu; Sun, Li; Chen, Baodong; Dong, Hongying; Shuang, Yingchai

    2017-02-01

    The solution precursor plasma spray (SPPS) process is capable of depositing highly durable thermal barrier coatings (TBCs). In this study, an aqueous chemical precursor feedstock was injected into the plasma jet to deposit SrZrO3 thermal barrier coating on metal substrate. Taguchi design of experiments was employed to optimize the SPPS process. The thermal characteristics and phase evolution of the SrZrO3 precursor, as well as the influence of various spray parameters on the coating deposition rate, microhardness, microstructure, and phase stability, were investigated. The experimental results showed that, at given spray distance, feedstock flow rate, and atomization pressure, the optimized spray parameters were arc current of 600 A, argon flow rate of 40 L/min, and hydrogen flow rate of 10 L/min. The SrZrO3 coating prepared using the optimized spray parameters had single-pass thickness of 6.0 μm, porosity of 18%, and microhardness of 6.8 ± 0.1 GPa. Phase stability studies indicated that the as-sprayed SrZrO3 coating had good phase stability in the temperature range from room temperature to 1400 °C, gradually exhibiting a phase transition from t'-ZrO2 to m-ZrO2 in the SrZrO3 coating at 1450 °C with increasing time, while the SrZrO3 phase did not change.

  13. From solid solution to cluster formation of Fe and Cr in α-Zr

    NASA Astrophysics Data System (ADS)

    Burr, P. A.; Wenman, M. R.; Gault, B.; Moody, M. P.; Ivermark, M.; Rushton, M. J. D.; Preuss, M.; Edwards, L.; Grimes, R. W.

    2015-12-01

    To understand the mechanisms by which the re-solution of Fe and Cr additions increase the corrosion rate of irradiated Zr alloys, the solubility and clustering of Fe and Cr in model binary Zr alloys was investigated using a combination of experimental and modelling techniques - atom probe tomography (APT), x-ray diffraction (XRD), thermoelectric power (TEP) and density functional theory (DFT). Cr occupies both interstitial and substitutional sites in the α-Zr lattice; Fe favours interstitial sites, and a low-symmetry site that was not previously modelled is found to be the most favourable for Fe. Lattice expansion as a function of Fe and Cr content in the α-Zr matrix deviates from Vegard's law and is strongly anisotropic for Fe additions, expanding the c-axis while contracting the a-axis. Matrix content of solutes cannot be reliably estimated from lattice parameter measurements, instead a combination of TEP and APT was employed. Defect clusters form at higher solution concentrations, which induce a smaller lattice strain compared to the dilute defects. In the presence of a Zr vacancy, all two-atom clusters are more soluble than individual point defects and as many as four Fe or three Cr atoms could be accommodated in a single Zr vacancy. The Zr vacancy is critical for the increased apparent solubility of defect clusters; the implications for irradiation induced microstructure changes in Zr alloys are discussed.

  14. Visible light nonlinear absorption and optical limiting of ultrathin ZrSe3 nanoflakes

    NASA Astrophysics Data System (ADS)

    Wu, Jia-Jing; Tao, You-Rong; Fan, Lei; Wu, Zhong-Yu; Wu, Xing-Cai; Chun, Yuan

    2016-11-01

    The nonlinear absorption and nonlinear refractive properties of ZrSe3 nanoflakes were studied with a 6.5 ns pulse laser at 532 nm. Open-aperture Z-scan curves reveal that ZrSe3 nanoflakes have a strong reverse saturable absorption property, and close-aperture Z-scan curves show that ZrSe3 dispersions possess a positive nonlinear refractive index caused by self-focusing. The nonlinear absorption coefficient, the nonlinear refraction coefficient, and the figures of merit (FOM) of ZrSe3 dispersed in water with linear transmittances of 0.86 at input energy of 18 μJ are 6.35 × 10-10 m W-1 15.73 × 10-17 m2 W-1, and 10.09 × 10-11 esu · cm respectively. In addition, nonlinear optical (NLO) performance of ZrSe3 nanoflakes depends on organic solvent dispersions. ZrSe3 nanoflakes in water dispersions have the largest FOM of 10.27 × 10-11 esu · cm, while the FOM in ethanol dispersions is 5.41 × 10-11 esu · cm at the same input energy of 26.5 μJ. The optical limiting threshold Fth of ZrSe3 nanosheet is 2.2 J cm-2 under picosecond laser pulse. The Results imply that ZrSe3 nanoflakes are an extraordinarily promising material for novel nanophotonic devices like optical limiters.

  15. Reinforcement of denture base PMMA with ZrO(2) nanotubes.

    PubMed

    Yu, Wei; Wang, Xixin; Tang, Qingguo; Guo, Mei; Zhao, Jianling

    2014-04-01

    In the research described, ZrO2 nanotubes were prepared by anodization. The morphologies, crystal structure, etc. were characterised by scanning electron microscope (SEM), transmission electron microscope (TEM), X-ray diffractometer (XRD), and Fourier transform infrared spectroscopy (FTIR). ZrO2 nanotubes were pre-stirred with the denture base PMMA powder by a mechanical blender and mixed with MMA liquid to fabricate reinforced composites. The composites were tested by an electromechanical universal testing machine to study the influences of contents and surface-treatment effect on the reinforcement. The ZrO2 nanoparticles were also investigated for comparative purposes. Results indicated that ZrO2 nanotubes had a better reinforcement effect than ZrO2 nanoparticles, and surface-treatment would lower the reinforcement effect of the ZrO2 nanotubes which itself was significantly different from that of the ZrO2 nanoparticles. The flexural strength of the composite was maximised when 2.0wt% untreated ZrO2 nanotubes were added.

  16. Microstructure and Corrosion Behavior of Electrodeposited Ni-Co-ZrC Coatings

    NASA Astrophysics Data System (ADS)

    Zhang, Zhongquan; Jiang, Chuanhai; Ma, Naiheng

    2014-11-01

    In this present work, ZrC particles incorporated Ni-Co composite coatings were electrodeposited. The objective of this article is to study the influence of Co content on the microstructure and properties of Ni-Co-ZrC coatings. Pure Ni and Ni-ZrC coatings have also been electrodeposited for comparison. Surface morphology, chemical composition, microstructure, and microhardness of Ni-Co-ZrC coatings were characterized by scanning electron microscopy, energy dispersive spectrometer, x-ray diffractometer, and Vicker microhardness tester. The potentiodynamic polarization technique was applied to measure the corrosion behavior of the coatings. By increasing Co concentration in electrolyte, Co content of the coatings was modified from 0 to 80 wt.% and ZrC particles content of the coatings was reduced. As the Co content increased, the dominant phase structure was changed from face centered cubic to hexagonal close packed crystal structure. Surface morphology of the Ni-Co-ZrC coatings was changed from nodular to sharp corner structure, and finally branched morphology with increasing Co content of the coating. Among the electrodeposited coatings, Ni-Co-ZrC coating with 42 wt.% Co content exhibited the highest microhardness. The corrosion potential of the coating was shifted to more positive with increasing the Co content from 0 to 64 wt.%. The lowest corrosion rate of 4.507 × 10-7 g·h-1·cm-2 was found for Ni-Co-ZrC coating at the Co content of 75 wt.%.

  17. Assessment of Experimental Data and Thermodynamic Modeling in the Zr-Fe-O System

    NASA Astrophysics Data System (ADS)

    Fabrichnaya, Olga; Pavlyuchkov, Dmytro

    2016-01-01

    The thermodynamic parameters of the ZrO2-FeO-Fe2O3 system were assessed based on experimental data for the ZrO-FeO and ZrO2-Fe3O4 systems for the first time. The solubility of FeO and Fe2O3 in the ZrO2-based solid solutions and the solubility of ZrO2 in the Fe2O3 and Fe3O4 phases were taken into account and described by compound energy formalism. A partially ionic liquid model was used to describe the liquid phase. The isothermal section and liquidus surface of the ZrO2-FeO-Fe2O3 system were calculated. Data on binary systems were combined with the description of the ZrO2-FeO-Fe2O3 system. Phase diagrams were calculated using a thermodynamic description based on advanced models. An equilibrium between the metallic liquid and solid ZrO2 was calculated and compared with experimental data. Substantial differences between the calculations and the results of experiments were found, as in the calculations of previous research.

  18. Local structures surrounding Zr in nanostructurally stabilized cubic zirconia: Structural origin of phase stability

    SciTech Connect

    Soo, Y. L.; Chen, P. J.; Huang, S. H.; Shiu, T. J.; Tsai, T. Y.; Chow, Y. H.; Lin, Y. C.; Weng, S. C.; Chang, S. L.; Wang, G.; Cheung, C. L.; Sabirianov, R. F.; Mei, W. N.; Namavar, F.; Haider, H.; Garvin, K. L.; Lee, J. F.; Lee, H. Y.; Chu, P. P.

    2008-12-01

    Local environment surrounding Zr atoms in the thin films of nanocrystalline zirconia (ZrO{sub 2}) has been investigated by using the extended x-ray absorption fine structure (EXAFS) technique. These films prepared by the ion beam assisted deposition exhibit long-range structural order of cubic phase and high hardness at room temperature without chemical stabilizers. The local structure around Zr probed by EXAFS indicates a cubic Zr sublattice with O atoms located on the nearest tetragonal sites with respect to the Zr central atoms, as well as highly disordered locations. Similar Zr local structure was also found in a ZrO{sub 2} nanocrystal sample prepared by a sol-gel method. Variations in local structures due to thermal annealing were observed and analyzed. Most importantly, our x-ray results provide direct experimental evidence for the existence of oxygen vacancies arising from local disorder and distortion of the oxygen sublattice in nanocrystalline ZrO{sub 2}. These oxygen vacancies are regarded as the essential stabilizing factor for the nanostructurally stabilized cubic zirconia.

  19. Highly active Ni/Y-doped ZrO2 catalysts for CO2 methanation

    NASA Astrophysics Data System (ADS)

    Takano, H.; Kirihata, Y.; Izumiya, K.; Kumagai, N.; Habazaki, H.; Hashimoto, K.

    2016-12-01

    The catalytic methanation of CO2 was carried out on Ni catalysts supported on Y-doped ZrO2 with various Y3+ concentrations and Ni/(Zr + Y) molar ratio = 1. The catalysts were characterized by X-ray diffraction, scanning transmission electron microscopy, specific surface area, temperature-programmed desorption of CO2, and temperature-programmed reaction. In addition, operando diffuse-reflectance infrared Fourier-transform spectroscopy (DRIFT) was used to identify the adsorbed reaction intermediate. Catalysts supported on Y-doped ZrO2 show higher catalytic activity than the catalyst on Y-free ZrO2 with a monoclinic ZrO2 phase. The catalytic activity is also dependent upon the Y3+ concentration, and the highest activity was obtained for the catalyst with a Y/(Zr + Y) molar ratio of 0.333, which consists mainly of fcc Ni and cubic ZrO2 phase. Y3+ doping into ZrO2 introduces oxygen vacancies, which play an important role in enhancing the catalytic activity. The operando DRIFT study reveals that a CO adsorption intermediate is absent, and bidentate carbonate is an important intermediate for CH4 formation.

  20. Atomistic Studies of Cation Transport in Tetragonal ZrO2 During Zirconium Corrosion

    SciTech Connect

    Xian-Ming Bai; Yongfeng Zhang; Michael R. Tonks

    2013-10-01

    Zirconium alloys are the major fuel cladding materials in current reactors. The water-side corrosion is one of the major degradation mechanisms of these alloys. During corrosion the transport of oxidizing species in zirconium dioxide (ZrO2) determines the corrosion kinetics. Previously it has been argued that the outward diffusion of cation ions is important for forming protective oxides. In this work, the migration of Zr defects in tetragonal ZrO2 is studied with temperature accelerated dynamics and molecular dynamics simulations. The results show that Zr interstitials have anisotropic diffusion and migrate preferentially along the [001] or c direction in tetragonal ZrO2. The compressive stresses can increase the Zr interstitial migration barrier significantly. The migration barriers of some defect clusters can be much lower than those of point defects. The migration of Zr interstitials at some special grain boundaries is much slower than in a bulk oxide. The implications of these atomistic simulation results in the Zr corrosion are discussed.

  1. Microstructure, growth mechanism and anisotropic resistivity of quasi-one-dimensional ZrTe5 crystal

    NASA Astrophysics Data System (ADS)

    Lv, Yang-Yang; Zhang, Fan; Zhang, Bin-Bin; Pang, Bin; Yao, Shu-Hua; Chen, Y. B.; Ye, Liwang; Zhou, Jian; Zhang, Shan-Tao; Chen, Yan-Feng

    2017-01-01

    The study of ZrTe5 is revived because theory predicts the quantum spin Hall effect in monolayer ZrTe5 and topological phase in bulk ZrTe5. To study the topological property of ZrTe5, the growth of large size and high-quality single crystals is the first and crucial step. Here, by mean of iodine (I2) transport agent, centimeter-sized ZrTe5 single crystals were successfully grown by the chemical vapor transport technique. The microstructure characterization reveals that grown ZrTe5 crystal has "stacking stripes of wood" morphology, and growth mechanism is proposed accordingly. The size of grown ZrTe5 crystals can be reached as large as 35×2×0.5 mm3, which enable us to measure the a-, b- and c- axis anisotropic resistance. Large and single crystalline ZrTe5 crystals provide a solid basis for exploring its topological phase.

  2. NMR studies of electronic structure in crystalline and amorphous Zr2PdH/x/

    NASA Technical Reports Server (NTRS)

    Bowman, R. C., Jr.; Johnson, W. L.; Maeland, A. J.; Rhim, W.-K.

    1983-01-01

    The proton Knight shifts and spin-lattice relaxation times have been measured in crystalline and amorphous Ze2PdH(x). Core polarization from the Zr d-band dominates the proton hyperfine interactions. The density of Fermi level d-electron states is reduced in the amorphous phase relative to the electron density in crystalline Zr2PdH(x).

  3. Preparation and Oxidation of ZrB2/SiC/Zr2Al4C5 Multi-phase Ceramics with Spark Plasma Sintering

    NASA Astrophysics Data System (ADS)

    Guo, Qilong; Li, Junguo; Ma, Zhiyu; Nie, Ye; Shen, Qiang; Zhang, Lianmeng

    2013-03-01

    The ZrB2/SiC/Zr2Al4C5 multi-phase ceramics were fabricated by spark plasma sintering (SPS) at 1800 °C for 3 min under 20 MPa in an vacuum. Oxidation behavior of multi-phase ceramics were investigated using thermo gravimetric analysis (TGA) from 20 °C to 1500 °C and muffle furnace in stagnant air at 1200 °C. Samples were analyzed after oxidation by X-ray diffraction (XRD), scanning electron microscopy (SEM) along with energy dispersive spectroscopy (EDS) to determine the reaction products and to observe the microstructure. The results showed that the aluminium borate and mullite crystallize on the surface in the samples oxidized. The effect of Zr2Al4C5 content on the oxidation resistance of the ZrB2 ceramics were discussed respectively, and oxidation mechanism was also analysised.

  4. Tetradihydrobenzoquinonate and tetrachloranilate Zr(IV) complexes: single-crystal-to-single-crystal phase transition and open-framework behavior for K4Zr(DBQ)4.

    PubMed

    Imaz, Inhar; Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Sutter, Jean-Pascal

    2013-10-07

    The molecular complexes K4[Zr(DBQ)4] and K4[Zr(CA)4], where DBQ(2-) and CA(2-) stand respectively for deprotonated dihydroxybenzoquinone and chloranilic acid, are reported. The anionic metal complexes consist of Zr(IV) surrounded by four O,O-chelating ligands. Besides the preparation and crystal structures for the two complexes, we show that in the solid state the DBQ complex forms a 3-D open framework (with 22% accessible volume) that undergoes a crystal-to-crystal phase transition to a compact structure upon guest molecule release. This process is reversible. In the presence of H2O, CO2, and other small molecules, the framework opens and accommodates guest molecules. CO2 adsorption isotherms show that the framework breathing occurs only when a slight gas pressure is applied. Crystal structures for both the hydrated and guest free phases of K4[Zr(DBQ)4] have been investigated.

  5. Microstructural evolution and grain morphology of ZrN pellets

    NASA Astrophysics Data System (ADS)

    Park, Sungho; Han, Ilsu; Lee, Hyunjun; Huh, Sunchul; Park, Wonjo

    2009-04-01

    Improvements in the mechanical integrity of zirconium nitride (ZrN) inert matrixes in advanced nuclear fuels were addressed in this work. This was done by first better understanding and then controlling texture and microstructural evolution of the former. Several samples were examined via orientation imaging microscopy: several monolithic specimens were hot isostatically pressed (HIP), and two sintered specimens with 80 % and 85 % density Grain size and crystallographic orientation studies revealed sample microstructure and their evolution during sintering. A correlation between larger grains and orientations near to <111> parallel to the compression axis during cold pressing was present for the 85 % density sample.

  6. Report on Characterization of U-10 wt.% Zr Alloy

    SciTech Connect

    McKeown, J; Wall, M; Hsiung, L; Turchi, P

    2012-03-01

    This report summarizes the chemical and structural characterization results for a U-10 wt.% Zr alloy to be used in an ultra-high burn-up nuclear fuel concept. The as-cast alloy material was received from Texas A and M University. Characterization and an initial heat treatment of the alloy material were conducted at Lawrence Livermore National Laboratory. The as-received ingot was sectioned for X-ray analysis, metallography, SEM, TEM, and heat treatments, as shown in Figure 1.

  7. Laboratory produced P/M aluminum 2XXX + Zr sheet

    NASA Technical Reports Server (NTRS)

    Royster, Dick M.; Singleton, O. R.

    1988-01-01

    A laboratory-scale batch of aluminum alloy sheeting samples in the 2XXX + Zr system has been produced by P/M techniques in the T8X temper and subjected to tensile and Kahn tear property tests in both the longitudinal and long-transverse directions. The results obtained were compared to those of a NASA study concerning the same alloy powders; it appears that laboratory production-scale sheet-sample properties are good to excellent predictors of pilot-scale process products' tensile and tear notch toughness properties. The tear resistance toughness of the laboratory samples was not predictive of the pilot-scale products, however.

  8. Study of a splat cooled Cu-Zr-noncrystalline phase.

    NASA Technical Reports Server (NTRS)

    Revcolevschi, A.; Grant, N. J.

    1972-01-01

    By rapid quenching from the melt, using the splat forming gun technique, a noncrystalline phase has been obtained in a Cu-Zr alloy containing 60 at. % Cu. Upon heating, rapid crystallization of the samples takes place at 477 C with a heat release of about 700 cal per mol. The variation of the electrical resistivity of the samples with temperature confirms the transformation. Very high resolution electron microscopy studies of the structural changes of the samples upon heating are presented and show the gradual crystallization of the amorphous structure.

  9. Distribution of platinum group elements and other traffic related elements among different plants along some highways in Germany.

    PubMed

    Djingova, Rumiana; Kovacheva, Petya; Wagner, Gerhard; Markert, Bernd

    2003-06-01

    Using ICP-MS and ICP-AES platinum group elements (Pt, Pd, Rh, Ru and Ir) and Ce, La, Nd, Pb and Zr have been determined in street dust, Taraxacum officinale (dandelion), Plantago lanceolata (plantain), Lolium multiflorum (annual ryegrass), Rhytidiadelphus squarrosus (moss) and Vascellum pratense (mushrooms) collected along highways and streets in Germany during 1999. Among the plants Taraxacum officinale (dandelion) reflects most adequately the pollution with the investigated elements matching the results from street dust. A strong positive correlation between all elements determined in the plants is established. Transfer factor for Pt between soil and plants has been determined in an agricultural experiment ranging between 0.004 and 0.008 for two types of soils.

  10. ZrO₂ surface chemically coated with hyaluronic acid hydrogel loading GDF-5 for osteogenesis in dentistry.

    PubMed

    Bae, Min Soo; Kim, Ji Eun; Lee, Jung Bok; Heo, Dong Nyoung; Yang, Dae Hyeok; Kim, Jin-Ho; Kwon, Kung-Rock; Bang, Jae Beum; Bae, Hojae; Kwon, Il Keun

    2013-01-30

    The objective of this study was to modify zirconium dioxide (ZrO(2)) with photo-cured hyaluronic acid hydrogel (pcHAgel), and to subsequently evaluate the bone regeneration potential of the modified ZrO(2). In the present study, HA grafted onto a ZrO(2) substrate was investigated for its biocompatibility and other properties. We describe the positive influences of ZrO(2) surface-modified with pcHAgel (Zr-3) containing two different loads of growth and differentiation factor-5 (GDF-5) to aid new bone formation as compared to the same amount of BMP-2 (Zr-4-7). We characterized the Zr-3 for their surface morphology and chemical properties. Atomic force microscopy (AFM), scanning electron microscope (SEM), and X-ray photoelectron spectroscopy (XPS) showed that the pcHAgel was successfully grafted onto the ZrO(2) surface. The sustained release of GDF-5 and BMP-2 were observed to occur in the Zr-4-7. In vitro cell tests showed a higher level of MG63 cell proliferation and differentiation on Zr-4-7 than on Zr-3. The Zr-3 is a good biomaterial to deliver osteogenic differentiation factors such as BMP-2 and GDF-5, and GDF-5 can be useful as an effective alternative to aid new bone formation as compared to BMP-2.

  11. Application of the Bons-Azuma method and determination of grain growth mechanism in rolled Ti-Zr alloys

    NASA Astrophysics Data System (ADS)

    Homma, Tomoyuki; Matayoshi, Yusuke; Voskoboinikov, Roman

    2015-12-01

    Zr-containing Ti alloys have widely been developed owing to the infinite solid solubility of Zr in Ti and its avirulence, leading respectively to high strength and good biocompatibility. It is known that the Zr addition gives rise to grain refinement when rolled Ti-Zr alloys are annealed; nevertheless, the governing mechanism by which Zr addition in Ti can reduce grain size is not fully understood. In this study, the grain growth behaviour of rolled Zr-free and Zr-containing (Ti-10Zr, wt.%) alloys is analysed using analytical transmission electron microscopy and the classical and Bons-Azuma methods by evaluating the grain growth exponent. Irrespective of the evaluation technique and Zr content, the grain growth exponent is found to be close to ~0.3, indicating the occurrence of normal grain growth in the Zr-free alloy and solute drag mechanism in the Zr-containing alloy. It is found that the grain size and grain growth rate are significantly reduced by Zr segregation near grain boundaries, resulting from the solute drag mechanism.

  12. First principle investigation of crystal lattice structure, thermodynamics and mechanical properties in ZnZrAl2 intermetallic compound

    NASA Astrophysics Data System (ADS)

    Wei, Zhenyi; Tou, Shushi; Wu, Bo; Bai, Kewu

    2016-12-01

    ZnZrAl2 is a kind of heterogeneous nucleation to promote the refine of grain of ZA43 alloy. ZnZrAl2 intermetallic is also considered as a candidate for superalloys. The crystal lattice structure, alloy thermodynamics and mechanical properties of ZnZrAl2 intermetallic compound were investigated by ab initio calculations based on density functional theory (DFT). In particular, the site preference of atoms in different sublattices was predicted based on alloy thermodynamics. At ground state, the most stable structure is L12 structure with sublattice model (Zn)1a(Zr0.3333Al0.6667)3c or (Zr)1a(Zn0.3333Al0.6667)3c, and the occupying preferences of Zn, Zr and Al atoms are independent with the increasing temperature. The bulk, shear, Young's modulus and the Poisson's ratio of the L12 structure ZnZrAl2 were calculated based on the site occupying configurations. The results show that ZnZrAl2 is a brittle material in nature. Electronic structures analysis revealed that Al-Zr atoms possess a covalent bonding character, while the Zn-Zr atoms have a metallic bonding character. ZnZrAl2 has stable mechanical properties at high temperature. The grain refinement effect of ZnZrAl2 precipitates in Zn-Al alloys were discussed based on crystal lattice match theory.

  13. Note: utilizing Pb(Zr(0.95)Ti(0.05))O3 ferroelectric ceramics to scale down autonomous explosive-driven shock-wave ferroelectric generators.

    PubMed

    Shkuratov, Sergey I; Baird, Jason; Talantsev, Evgueni F

    2012-07-01

    Further miniaturization of recently designed autonomous ferroelectric generators (FEGs) [S. I. Shkuratov, J. Baird, and E. F. Talantsev, Rev. Sci. Instrum. 82, 086107 (2011)], which are based on the effect of explosive-shock-wave depolarization of poled ferroelectrics is achieved. The key miniaturization factor was the utilization of high-energy density Pb(Zr(0.95)Ti(0.05))O(3) (PZT 95/5) ferroelectric ceramics as energy-carrying elements of FEGs instead of the previously used Pb(Zr(0.52)Ti(0.48))O(3) (PZT 52/48). A series of experiments demonstrated that FEGs based on smaller PZT 95/5 ferroelectric elements are capable of producing the same output voltage as those based on PZT 52/48 elements twice as large. It follows from the experimental results that the FEG output voltage is directly proportional to the thickness of PZT 95/5 samples. A comparison of the operation of FEGs based on PZT 95/5 and on PZT 52/48 ferroelectrics is presented.

  14. Enhancement of the capability of hydroxyapatite formation on Zr with anodic ZrO₂ nanotubular arrays via an effective dipping pretreatment.

    PubMed

    Wang, Lu-Ning; Adams, Alissa; Luo, Jing-Li

    2011-11-01

    Hydroxyapatite (HA) depositions on metallic biomedical implants are widely applied to generate bioactive surfaces in simulated biological environments. Highly ordered anodic ZrO₂ nanotubes have attracted increasing interest for biomedical applications. However, previous reports showed that at least 14-28 days were required to obtain HA coating on ZrO₂ nanotubular arrays under biomimetic condition, thus capability to grow HA coating on ZrO ₂nanotubular at room temperature needs to be enhanced. In the present work, we demonstrate that ZrO₂ nanotubular arrays are suitable for an effective dipping treatment to induce more rapid HA coating. A series of ZrO₂ nanotubular arrays having different dimensions were fabricated in fluoride containing electrolyte. Then, we used a dipping treatment for biomimetic formation of an adhesive HA coating on the nanotubular arrays. The coatings formed rapidly using this procedure under biomimetic conditions and did not require a high-temperature annealing process. The as-formed ZrO₂ nanotubular arrays were treated using several dip-and-dry steps, through which the nanotubular arrays were filled and covered with calcium phosphate (CaP) nucleation sites. The specimens readily grew HA once immersed in the simulated biological fluid after 2 days immersion. The carbonated HA coating had several micron thickness after 8 days of immersion while only a thin layer of CaP were observed on annealed ZrO₂ nanotubes immersed in the same solution for the same duration. Tensile testing showed that bonding strength between HA coating and substrate was 21.6 ± 1.6 MPa. This treatment dramatically improves efficiency for promoting HA formation on anodic ZrO₂ nanotubes at room temperature.

  15. Vacancy analysis in a Ni-Nb-Zr-H glassy alloy by positron annihilation spectroscopy

    NASA Astrophysics Data System (ADS)

    Fukuhara, Mikio

    2012-02-01

    The positron lifetimes of Ni36Nb24Zr40 and (Ni0.36Nb0.24Zr0.40)90H10 glassy alloys are almost the same but longer than those of pure Zr, Nb, and Ni crystals, indicating that they have higher density of vacancies with smaller size than in crystals. The coincidence Doppler broadening spectrum for both specimens shows that the contribution of Ni around the vacancies is lower than that of Zr and Nb, suggesting that hydrogen atoms favour to exist between Ni atoms comprising neighboring distorted icosahedral Zr5Ni5Nb3 clusters. Thus, these results provide a substitute model of quantum dot tunneling along Ni-H-Ni atomic bond arrays among the clusters.

  16. Preparation and photoluminescence properties of Sm3+-doped ZrO2 nanotube arrays

    NASA Astrophysics Data System (ADS)

    Fu, Ning; Wang, Xixin; Ma, Yuanhui; Wang, Mingli; Li, Jiaxin; Zhao, Jianling

    2016-04-01

    Zr-Sm (3 at.% Sm) alloy was prepared through a powder metallurgical method. Sm3+-doped ZrO2 nanotube arrays have been achieved directly by anodizing the Zr-Sm alloy. The effects of electrolyte and annealing temperature on the morphologies and structures of the nanotube arrays were studied. The photoluminescence properties of Sm3+-doped ZrO2 nanotube arrays prepared in aqueous solution and formamide  +  glycerol solution were studied in detail as well. Results show that tetragonal ZrO2 promoted the photoluminescence efficiency of this system. Under excitation at 407 nm, the sample prepared in aqueous solution annealed at 600 °C displayed the strongest emission peak at 571 nm, corresponding to the 4G5/2  →  6H5/2 samarium transition.

  17. Irradiation induced structural change in Mo2Zr intermetallic phase

    SciTech Connect

    Gan, J.; Keiser, Jr., D. D.; Miller, B. D.; Eriksson, N.; Sohn, Y. H.; Kirk, M.

    2016-05-14

    The Mo2Zr phase has been identified as a major interaction product at the interface of U-10Mo and Zr. Transmission electron microscopy in-situ irradiation with Kr ions at 200 °C with doses up to 2.0E+16 ions/cm2 was carried out to investigate the radiation stability of the Mo2Zr. The Mo2Zr undergoes a radiation-induced structural change, from a large cubic (cF24) to a small cubic (cI2), along with an estimated 11.2% volume contraction without changing its composition. The structural change begins at irradiation dose below 1.0E+14 ions/cm2. Furthermore, the transformed Mo2Zr phase demonstrates exceptional radiation tolerance with the development of dislocations without bubble formation.

  18. Organometallic Chemical Vapor Deposition of ZrF4-Based Fluoride Glasses

    NASA Astrophysics Data System (ADS)

    Fujiura, Kazuo; Ohishi, Yasutake; Takahashi, Shiro

    1989-01-01

    By organometallic chemical vapor deposition (OMCVD), fluoride glasses in a ZrF4-BaF2 binary system are successfully synthesized. β-Diketone chelates of Zr and Ba as starting materials can be volatilized and completely fluorinated with HF gas into ZrF4-BaF2 compounds. 65 mol%ZrF4-35 mol%BaF2 powder synthesized by OMCVD is identified as homogeneous glass by X-ray diffraction (XRD) and differential scanning calorimetry (DSC). By this method, ZrF4 is also obtained in an amorphous state. The OMCVD is available for preparation of fluoride glass, which is promising for optical fiber.

  19. Effects of strain on the stability of tetragonal ZrO2

    NASA Astrophysics Data System (ADS)

    Chen, Min-Hua; Thomas, John C.; Natarajan, Anirudh Raju; Van der Ven, Anton

    2016-08-01

    The tetragonal form of ZrO2 is used in a wide range of technologies. In this study, we systematically explore the effect of strain on the relative stability of symmetrically equivalent tetragonal variants of ZrO2 using first-principles density functional theory. We focus, in particular, on the role that strain plays in altering metastability and causing dynamical instabilities as these properties affect the mechanisms of ferroelastic switching. We also discover the emergence of a dynamical instability in tetragonal ZrO2 at its high temperature equilibrium volume. This indicates that the high-temperature thermodynamic properties of tetragonal ZrO2 have important anharmonic vibrational contributions that cannot be captured with the quasiharmonic approximation. Finally, we determine that the instability of tetragonal ZrO2 at large volumes leads to a new orthorhombic phase having a P 212121 space group.

  20. Thermophysical characterisation of ZrCxNy ceramics fabricated via carbothermic reduction-nitridation

    NASA Astrophysics Data System (ADS)

    Harrison, R.; Ridd, O.; Jayaseelan, D. D.; Lee, W. E.

    2014-11-01

    Thermophysical properties of ZrCxNy ceramics prepared from powders produced via a two-step carbothermic reduction-nitridation of zirconia were characterised to 2200 K. Preliminary evidence for the mechanism of nitridation shows a gas-solid phase reaction at the ZrC particle surface which is the first such observation with this system. Electrical and thermal conductivities were higher than commercially available ZrC and ZrN. Thermal conductivity values of the ZrCxNy phases at room temperature were between 35 and 43 Wm-1 K-1, increasing with nitrogen content due to increased electronic contribution to thermal conduction and increased to 40-50 Wm-1 K-1 with temperature. Electrical conductivity also increased with nitrogen content and values were in the range of 100-450 × 104 Ω-1 m1, but decreased with increasing temperature showing metallic behaviour.