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Sample records for povedenie ti zr

  1. Interstitial and substitutional Zr in SrTiO3

    NASA Astrophysics Data System (ADS)

    Jaffe, John; van Ginhoven, Renee; Jiang, Weilin

    2011-03-01

    We investigate Zr in SrTi O3 (STO) as an electronic dopant and as a model for nuclear waste forms in which radioactive Sr decays to Y and then to stable Zr through beta emission. Density functional theory (DFT) within the supercell model is used to predict the thermodynamic stability and electronic states of interstitial and Sr- or Ti-substituted Zr atoms in the STO lattice. Native point defects such as vacancies and antisites are also considered. When Zr replaces Sr, its most stable configuration is to simply occupy the Sr site (instead of, for example, replacing a Ti and displacing the Ti to the Sr site.) For Zr added to the lattice, its most stable configuration is to replace a Ti, making a Zr Ti impurity plus a Ti interstitial (as opposed to the Zr just remaining as an interstitial atom.) Zr Sr is predicted to be a double electron donor, Zr Ti is electrically inactive and interstitial Zr and Ti are predicted to be quadruple donors, with all donor levels in the conduction band. Zr Sr and the tetravalent interstitials are all predicted to increase the crystal volume, and the interstitials also are predicted to lead to a tetragonal distortion of the lattice. Experiments with injection of Zr atoms into STO qualitatively confirm these predictions of crystal structural changes. Supported by U.S. Department of Energy Waste Form Campaign.

  2. 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.

  3. Directional solidification of (Ti, Zr) carbide-(Ti, Zr) diboride eutectics

    SciTech Connect

    Sorrell, C.C.; Beratan, H.R.; Bradt, R.C.; Stubican, V.C.

    1984-03-01

    The ZrC-ZrB2, ZrC-TiB2, and TiC-TiB2 metal diboride-metal carbide pseudo-binary eutectic systems have been successfully solidified directionally by means of the floating zone method. The first and third of these eutectics possess a morphology consisting of columnar grains of parallel lamellae with interlamellar spacings that adhere to the lambda-squared (R) C relationship, while the second is noted to solidify in a Chinese calligraphy-like morphology of broken and deformed lamellae. This phenomenon may be related to solid solution effects, but it did not prevent the interlamellar spacings from following the aforementioned law. The calligraphic effect's values are larger than those of the other two systems, and the constant, C, is accordingly about an order of magnitude larger. All three of these cubic-hexagonal systems exhibited identical epitaxial relationships. 24 references.

  4. Ab initio Ti-Zr-Ni phase diagram predicts stability of icosahedral TiZrNi quasicrystals

    NASA Astrophysics Data System (ADS)

    Hennig, R. G.; Carlsson, A. E.; Kelton, K. F.; Henley, C. L.

    2005-04-01

    The ab initio phase diagram determines the energetic stability of the icosahedral TiZrNi quasicrystal. The complete ab initio zero-temperature ternary phase diagram is constructed from the calculated energies of the elemental, binary and ternary Ti-Zr-Ni phases. For this, the icosahedral i -TiZrNi quasicrystal is approximated by periodic structures of up to 123 atoms/unit cell, based on a decorated-tiling model [R. G. Hennig, K. F. Kelton, A. E. Carlsson, and C. L. Henley, Phys. Rev. B 67, 134202 (2003)]. The approximant structures containing the 45-atom Bergman cluster are nearly degenerate in energy, and are all energetically stable against the competing phases. It is concluded that i -TiZrNi is a ground-state quasicrystal, as it is experimentally the low-temperature phase for its composition.

  5. Characteristics of ZrC/ZrN and ZrC/TiN multilayers grown by pulsed laser deposition

    NASA Astrophysics Data System (ADS)

    Craciun, D.; Bourne, G.; Socol, G.; Stefan, N.; Dorcioman, G.; Lambers, E.; Craciun, V.

    2011-04-01

    ZrC/ZrN and ZrC/TiN multilayers were grown on (1 0 0) Si substrates at 300 °C by the pulsed laser deposition (PLD) technique using a KrF excimer laser. X-ray diffraction investigations showed that films were crystalline, the strain and grain size depending on the nature and pressure of the gas used during deposition. The elemental composition, analyzed by Auger electron spectroscopy (AES) and X-ray photoelectron spectroscopy (XPS), showed that films contained a low level of oxygen contamination. Simulations of the X-ray reflectivity (XRR) curves acquired from films indicated a smooth surface morphology, with roughness below 1 nm (rms) and densities very close to bulk values. Nanoindentation results showed that the ZrC/ZrN and ZrC/TiN multilayer samples exhibited hardness values between 30 and 33 GPa, slightly higher than the values of 28-30 GPa measured for pure ZrC, TiN and ZrN films.

  6. Microstructure and mechanical properties of (Ti,Al,Zr)N/(Ti,Al,Zr,Cr)N films on cemented carbide substrates

    NASA Astrophysics Data System (ADS)

    Zhao, Shi-lu; Zhang, Jun; Zhang, Zhen; Wang, Shuang-hong; Zhang, Zheng-gui

    2014-01-01

    (Ti,Al,Zr)N/(Ti,Al,Zr,Cr)N bilayer films were deposited on cemented carbide (WC-8%Co) substrates by multi-arc ion plating (MAIP) using two Ti-Al-Zr alloy targets and one pure Cr target. To investigate the composition, morphology, and crystalline structure of the bilayer films, a number of complementary methods of elemental and structural analysis were used, namely, scanning electron microscopy (SEM), energy disperse X-ray spectroscopy (EDS), and X-ray diffraction (XRD). Adhesive strength and mechanical properties of the films were evaluated by scratch testing and Vickers microindentation, respectively. It is shown that the resulting films have a TiN-type face-centered cubic (FCC) structure. The films exhibit fully dense, uniform, and columnar morphology. Furthermore, as the bias voltages vary from -50 to -200 V, the microhardness (max. Hv0.01 4100) and adhesive strength (max. > 200 N) of the bilayer films are superior to those of the (Ti,Al,Zr)N and (Ti,Al,Zr,Cr)N monolayer films.

  7. Diffusion and chemical activity of Zr-Sn and Zr-Ti systems

    SciTech Connect

    Zee, R.H.; Watters, J.F.; Davidson, R.D.

    1986-11-15

    A modified evaporation method was used to determine the diffusion coefficients and the emission rates of Sn and Ti in Zr-Sn and Zr-Ti, respectively, at temperatures between 1605 and 1970 K. Results show that both Sn and Ti diffuse in their respective alloys via a vacancy mechanism. Comparison with data in the literature reveals that the activation energy for diffusion of Sn in Zr-Sn, with Sn content between 3 and 5 at.X is relatively constant from 1200 to 1970 K. From the measured emission rates, values of 103 and 98 kcal/mol were obtained for the enthalpies of sublimation for Sn and Ti in their alloys. With a comparison of the solute vapor pressures with those of the pure elements, partial molar free energies, entropies, and enthalpies for the two systems were determined in the temperature range investigated. The Zr-Sn system shows a very large negative heat of formation (-33 kcal/mol) whereas the Zr-Ti system behaves quite ideally, in agreement with phase-diagram predictions.

  8. Thermal stability and hydrogenation behavior of Zr-1Nb alloy with TiNx and Ti/TiNx coatings

    NASA Astrophysics Data System (ADS)

    Kashkarov, E. B.; Vilkhivskaya, O. V.; Zakharchenko, S. A.

    2016-08-01

    Titanium nitride coatings were deposited by reactive dc magnetron sputtering (dcMS) to protect Zr-1Nb alloys from hydrogen embrittlement. Dense titanium (Ti) interlayer was prepared between TiNx protection film and a Zr substrate to improve thermal stability and adhesion between the TiNx and the substrate at high temperatures. Hydrogen absorption of Zr- 1Nb with TiNx and Ti/TiNx at 623 K was reduced in comparison with uncoated Zr-1Nb. No peeling or cracks of Ti/TiNx coatings is observed after thermal cycling up to 1073 K. The high temperature (1073 K) hydrogenation behaviour differs from the hydrogenation at lower temperature by increasing the amount of dissolved hydrogen in the β-phase of zirconium. The higher rate of hydrogen absorption by Zr-1Nb with TiNx was observed due to the coating delamination as a result of differences in thermal expansion coefficients, while Ti/TiNx demonstrates the lower hydrogen absorption at 1073 K and good adhesion strength.

  9. Role of Ti in the formation of Zr-Ti-Cu-Ni-Al glasses

    SciTech Connect

    Kim, T H; Gangopadhyay, A K; Xing, L Q; Lee, G W; Shen, Y T; Kelton, K F; Goldman, A I; Hyers, R W; Rogers, J R

    2010-07-19

    It has been widely reported that glass formation improves in Zr{sub 62}Cu{sub 20}Ni{sub 8}Al{sub 10} alloys when small amounts of Ti are substituted for Zr. Glasses containing greater than 3 at. % Ti crystallize to a metastable icosahedral phase, suggesting that Ti enhances icosahedral short-range order in the liquid/glass, making crystallization more difficult during cooling. However, based on containerless solidification and in situ high-energy synchrotron diffraction studies of electrostatically levitated supercooled liquids of these alloys, we demonstrate that Ti inhibits surface crystallization but neither increases the icosahedral short-range order nor improves glass formation.

  10. Martensite transformation and shape memory effect on NiTi-Zr high temperature shape memory alloys

    SciTech Connect

    Pu, Z.; Tseng, H.; Wu, K.

    1995-10-17

    NiTi-Zr high temperature alloys possess relatively poor shape memory properties and ductility in comparison with NiTi-Hf and NiTi-Pd alloys. During martensite transformation of the newly-developed NiTi-Zr high temperature shape memory alloys (SMAs) the temperature increases along with Zr content when the Zr content is more than 10 at%. As the Zr content increases, the fully reversible strain of the alloys decreases. However, complete strain recovery behavior is exhibited by all the alloys studied in this paper, even those with a Zr content of 20 at%. Stability of the NiTi-Zr alloys during thermal cycling was also tested and results indicate that the NiTi-Zr alloys have poor stability against thermal cycling. The reasons for the deterioration of the shape memory effect and stability have yet to be determined.

  11. Research on the secondary electron yield of TiZrV-Pd thin film coatings

    NASA Astrophysics Data System (ADS)

    Wang, Jie; Wang, Yong; Xu, Yanhui; Zhang, Bo; Wei, Wei

    2016-09-01

    In particle accelerators, the build-up of electron cloud may have important influence on beam quality. Especially for the positron and proton accelerators, massive electrons lead to electron cloud, which affects the stability, energy, emittance and beam life adversely. A secondary electron emission (SEE) measurement system has been designed and used to study the SEE of palladium (Pd), TiZrV and TiZrV-Pd with an independently adjustable energy from 50 eV to 5 keV. Here, we obtained the characteristics of the SEE from Pd, TiZrV and TiZrV-Pd film coatings with different thickness under ultrahigh-vacuum (UHV) conditions. Moreover, the maximum secondary electron yield (SEY), {\\delta}max, of the Pd, TiZrV and TiZrV-Pd film coatings under different primary electron doses were obtained, respectively. Finally, the variation of the secondary electron yield with the incident electron energy will be discussed for Pd, TiZrV and TiZrV-Pd thin film coatings. Low SEY is a new advantage of TiZrV-Pd films, besides high H2 absorption ability and prolonging the lifetime of TiZrV film, which will be of great value in the design of beam screen for Super Proton-Proton Collider (SPPC).

  12. Color tone and interfacial microstructure of white oxide layer on commercially pure Ti and Ti-Nb-Ta-Zr alloys

    NASA Astrophysics Data System (ADS)

    Miura-Fujiwara, Eri; Mizushima, Keisuke; Watanabe, Yoshimi; Kasuga, Toshihiro; Niinomi, Mitsuo

    2014-11-01

    In this study, the relationships among oxidation condition, color tone, and the cross-sectional microstructure of the oxide layer on commercially pure (CP) Ti and Ti-36Nb-2Ta-3Zr-0.3O were investigated. “White metals” are ideal metallic materials having a white color with sufficient strength and ductility like a metal. Such materials have long been sought for in dentistry. We have found that the specific biomedical Ti alloys, such as CP Ti, Ti-36Nb-2Ta-3Zr-0.3O, and Ti-29Nb-13Ta-4.6Zr, form a bright yellowish-white oxide layer after a particular oxidation heat treatment. The brightness L* and yellowness +b* of the oxide layer on CP Ti and Ti-36Nb-2Ta-3Zr-0.3O increased with heating time and temperature. Microstructural observations indicated that the oxide layer on Ti-29Nb-13Ta-4.6Zr and Ti-36Nb-2Ta-3Zr-0.3O was dense and firm, whereas a piecrust-like layer was formed on CP Ti. The results obtained in this study suggest that oxide layer coating on Ti-36Nb-2Ta-3Zr-0.3O is an excellent technique for dental applications.

  13. 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.

  14. 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.

  15. Mono- and multiple TiN(/Ti) coating adhesion mechanism on a Ti-13Nb-13Zr alloy

    NASA Astrophysics Data System (ADS)

    Li, Jianzhong; Zheng, Hua; Sinkovits, Theo; Hee, Ay Ching; Zhao, Yue

    2015-11-01

    Mono- and multiple TiN(/Ti) coatings deposited on Ti-13Nb-13Zr alloy substrates by the filtered arc deposition system were examined using scratch testing and depth-sensing indentation in terms of the relationship between the coating adhesion, deformation mechanism, and microstructure, and mechanical properties at the film/substrate interface. The results show that multilayer TiN/Ti coatings offer a greater resistance to cracking and delamination than monolithic TiN coatings under the same conditions on the Ti-13Nb-13Zr alloys substrates. And increasing the number of layers for TiN multilayer coating improves the coatings adhesion. In contrast, for the coatings on the Ti-13Nb-13Zr alloys substrates that were heat-treated to a higher hardness, the limited deformation in the substrates improved remarkably the coating adhesion indiscriminately. The substrate mechanical properties play the major roles in controlling the coating adhesion, and increasing thickness and layers of the TiN multilayer have a limited improvement to the adhesion of coating.

  16. Structural relaxation and nanoindentation response in Zr-Cu-Ti amorphous thin films

    SciTech Connect

    Chou, H. S.; Huang, J. C.; Chang, L. W.; Nieh, T. G.

    2008-11-10

    Ternary Zr-Cu-Ti system, especial with a high Ti content, is normally difficult to be fully vitrified. In this paper, we demonstrate that cosputtering can produce amorphous Zr-Cu-Ti thin films with an excessive Ti content even as high as 19%. Sub-T{sub g} annealing of the film induces the formation of medium-range-ordered clusters and to raise the nanohardness by 35% to 6.6 GPa. The promising mechanical properties of the sub-T{sub g} annealed Zr{sub 52}Cu{sub 29}Ti{sub 19} films offer great potential for microelectromechanical system applications.

  17. Effect of pulsed bias on the properties of ZrN/TiZrN films deposited by a cathodic vacuum arc

    NASA Astrophysics Data System (ADS)

    Zhang, Guo-Ping; Wang, Xing-Quan; Lü, Guo-Hua; Zhou, Lan; Huang, Jun; Chen, Wei; Yang, Si-Ze

    2013-03-01

    ZrN/TiZrN multilayers are deposited by using the cathodic vacuum arc method with different substrate bias (from 0 to -800 V), using Ti and Zr plasma flows in residual N2 atmosphere, combined with ion bombardment of sample surfaces. The effect of pulsed bias on the structure and properties of films is investigated. Microstructure of the coating is analyzed by X-ray diffraction (XRD), and scanning electron microscopy (SEM). In addition, nanohardness, Young's modulus, and scratch tests are performed. The experimental results show that the films exhibit a nanoscale multilayer structure consisting of TiZrN and ZrN phases. Solid solutions are formed for component TiZrN films. The dominant preferred orientation of TiZrN films is (111) and (220). At a pulsed bias of -200 V, the nanohardness and the adhesion strength of the ZrN/TiZrN multilayer reach a maximum of 38 GPa, and 78 N, respectively. The ZrN/TiZrN multilayer demonstrates an enhanced nanohardness compared with binary TiN and ZrN films deposited under equivalent conditions.

  18. Structural refinement of 1/1 bcc approximants to quasicrystals: Bergman-type W(TiZrNi) and Mackay-type M(TiZrFe)

    NASA Astrophysics Data System (ADS)

    Kim, W. J.; Gibbons, P. C.; Kelton, K. F.; Yelon, W. B.

    1998-08-01

    We report the structural refinement of large-unit-cell bcc crystalline phases found in Ti-Zr-Ni and Ti-Zr-Fe alloys, which are 1/1 rational approximants of icosahedral quasicrystals in the same alloys. The structure of the stable 1/1 phase W(TiZrNi), lattice constant ao=14.317 Å, determined by a Rietveld analysis of x-ray and neutron powder diffraction data, is closely related to that of the 1/1 phases R(AlLiCu) and Bergman(AlMgZn), containing Bergman-type icosahedral clusters of atoms. Despite the similar chemistry of the 1/1 phases in Ti-Zr-Ni and Ti-Zr-Fe alloys, the 1/1 phase M(TiZrFe) contains double-shell Mackay icosahedra, like those found in the 1/1 phase α(TiCrSiO). These results provide starting structures for six-dimensional refinements of the related quasicrystals.

  19. Resistive switching in the Au/Zr/ZrO2-Y2O3/TiN/Ti memristive devices deposited by magnetron sputtering

    NASA Astrophysics Data System (ADS)

    Gorshkov, O. N.; Mikhaylov, A. N.; Kasatkin, A. P.; Tikhov, S. V.; Filatov, D. O.; Pavlov, D. A.; Belov, A. I.; Koryazhkina, M. N.; Bobrov, A. I.; Malekhonova, N. V.; Gryaznov, E. G.; Antonov, I. N.; Shenina, M. E.

    2016-08-01

    Bipolar resistive switching phenomenon in the Au/Zr/ZrO2-Y2O3/TiN/Ti memristive devices deposited by magnetron sputtering has been studied. The structure of devices and electrical measurements data for the temperature range from 77 to 490 K are analyzed. The stable switching is demonstrated at room temperature, but the decrease in the resistive switching performance at elevated temperatures is observed.

  20. Microstructure and optical characterizations of mechanosynthesized nanocrystalline semiconducting ZrTiO4 compound

    NASA Astrophysics Data System (ADS)

    Dutta, Hema; Nandy, Anshuman; Pradhan, S. K.

    2016-08-01

    A ZrO2-TiO2 solid solution is obtained by high energy ball milling of equimolar mixture of monoclinic (m) ZrO2 and anatase (a) TiO2. Nanocrystalline orthorhombic ZrTiO4 compound is initiated from the nucleation of TiO2-ZrO2 solid solution with isostructural s-TiO2 (srilankite) base after 30 min of milling. After 12 h of milling, 95 mol% non-stoichiometric ZrTiO4 phase is formed. Post-annealing of 12 h ball-milled powder mixture at 1073 K for 1 h in open air results in complete formation of stoichiometric ZrTiO4 compound. Microstructures of all powder mixtures milled for different durations have been characterized by Rietveld's structure and microstructure refinement method using X-ray powder diffraction data. HRTEM images of 12 h milled and annealed samples provide direct evidence of the results obtained from the Rietveld analysis. Optical bandgaps of ball milled and annealed ZrTiO4 compounds lie within the semiconducting region (~2.0 eV) and increases with increase in milling time.

  1. Atom probe tomographic studies of precipitation in Al-0.1Zr-0.1Ti (at.%) alloys.

    PubMed

    Knipling, Keith E; Dunand, David C; Seidman, David N

    2007-12-01

    Atom probe tomography was utilized to measure directly the chemical compositions of Al(3)(Zr(1)-(x)Ti(x)) precipitates with a metastable L1(2) structure formed in Al-0.1Zr-0.1Ti (at.%) alloys upon aging at 375 degrees C or 425 degrees C. The alloys exhibit an inhomogeneous distribution of Al(3)(Zr(1)-(x)Ti(x)) precipitates, as a result of a nonuniform dendritic distribution of solute atoms after casting. At these aging temperatures, the Zr:Ti atomic ratio in the precipitates is about 10 and 5, respectively, indicating that Ti remains mainly in solid solution rather than partitioning to the Al(3)(Zr(1)-(x)Ti(x)) precipitates. This is interpreted as being due to the very small diffusivity of Ti in alpha-Al, consistent with prior studies on Al-Sc-Ti and Al-Sc-Zr alloys, where the slower diffusing Zr and Ti atoms make up a small fraction of the Al(3)(Zr(1)-(x)Ti(x)) precipitates. Unlike those alloys, however, the present Al-Zr-Ti alloys exhibit no interfacial segregation of Ti at the matrix/precipitate heterophase interface, a result that may be affected by a significant disparity in the evaporation fields of the alpha-Al matrix and Al(3)(Zr(1)-(x)Ti(x)) precipitates and/or a lack of local thermodynamic equilibrium at the interface.

  2. Thermal stability of nanocrystalline (Ti,Zr)0.54Al0.46N films implanted by He+ ions

    NASA Astrophysics Data System (ADS)

    Uglov, V. V.; Abadias, G.; Rovbut, A. Y.; Zlotski, S. V.; Saladukhin, I. A.; Skuratov, V. A.; Petrovich, S.

    2015-07-01

    The influence of irradiation with He+ ions on the thermal stability of TiZrN and (Ti,Zr)0.54Al0.46N nanocrystalline films was studied. The TiZrN and (Ti,Zr)0.54Al0.46N films were prepared by reactive magnetron sputtering. XRD research showed that the TiZrN and (Ti,Zr)0.54Al0.46N films were single-phase systems (based on cubic c-(Ti,Zr)N and cubic c-(Ti,Zr,Al)N solid solutions) with nanocrystalline (grain size 30 and 21 nm, respectively) structure. The irradiation with He+ ions and thermal annealing up to 800 °C do not affect the structure and phase composition of the (Ti,Zr)0.54Al0.46N film. The prior irradiation of the (Ti,Zr)0.54Al0.46N film with He+ ions activates spinodal decomposition of the c-(Ti,Zr,Al)N solid solution after thermal annealing at 1000 °C due to redistribution of the components of the solid solution inside the grains.

  3. Microstructure and mechanical properties of Ti-15Zr alloy used as dental implant material.

    PubMed

    Medvedev, Alexander E; Molotnikov, Andrey; Lapovok, Rimma; Zeller, Rolf; Berner, Simon; Habersetzer, Philippe; Dalla Torre, Florian

    2016-09-01

    Ti-Zr alloys have recently started to receive a considerable amount of attention as promising materials for dental applications. This work compares mechanical properties of a new Ti-15Zr alloy to those of commercially pure titanium Grade4 in two surface conditions - machined and modified by sand-blasting and etching (SLA). As a result of significantly smaller grain size in the initial condition (1-2µm), the strength of Ti-15Zr alloy was found to be 10-15% higher than that of Grade4 titanium without reduction in the tensile elongation or compromising the fracture toughness. The fatigue endurance limit of the alloy was increased by around 30% (560MPa vs. 435MPa and 500MPa vs. 380MPa for machined and SLA-treated surfaces, respectively). Additional implant fatigue tests showed enhanced fatigue performance of Ti-15Zr over Ti-Grade4.

  4. Ab initio molecular dynamics studies on effect of Zr on oxidation resistance of TiAlN coatings

    NASA Astrophysics Data System (ADS)

    Pi, Jingwu; Kong, Yi; Chen, Li; Du, Yong

    2016-08-01

    It was demonstrated experimentally that doping Zr into TiAlN coatings at room temperature will detriment its oxidation resistance. On the other hand, there are evidences that doping Zr into TiAlN at high temperature will improve coating's oxidation resistance. In the present work, we address the effect of Zr on the oxidation resistance of TiAlN by means of ab initio molecular dynamics simulations. The TiAlN and TiAlZrN (1 Zr atom replacing 1 Ti atom) surfaces covered with 4 oxygen atoms at 300 K and 1123 K were simulated. Based on the analysis of the atomic motion, bond formation after relaxation, and the charge density difference maps we find that at 300 K, the addition of Zr induces escape of Ti atoms from the surface, resulting in formation of surface vacancies and subsequently TiO2. Comparison of metal-oxygen dimers in the vacuum and above the TiAlZrN surface further shows that the addition of Zr in the TiAlN surface will change the lowest bonding energy sequence from Zrsbnd O < Tisbnd O < Alsbnd O in the vacuum to Tisbnd O < Zrsbnd O < Alsbnd O above the TiAlZrN surface. From Molecular Dynamics simulations at 1123 K, it is find that no Ti vacancies were generated in the surface. Moreover, less charge is transferred from metal to N atoms and the bond lengths between Ti and O atoms become shorter at 1123 K as compared with 300 K, suggesting that the addition of Zr atom promotes the interaction of Ti and O at TiAlZrN surface at 1123 K, leading to a more stable surface. Our simulation explains why Zr-doping at 1123 K increases TiAlN coating's oxidation resistance while at 300 K reduces its oxidation resistance.

  5. Stability of TiO2 Nanoparticles in Deionized Water with ZrP Nanoplatelets.

    PubMed

    Liu, Zhuowei; Chen, Ying; Mo, Songping; Cheng, Zhengdong; Li, Huawel

    2015-04-01

    The stability of nanofluid is an important property that needs to be researched. In our study, a novel method using Zirconium phosphate (ZrP) discotic colloid to disperse nanoparticles was proposed for improving stability. TiO2 nanofluid was prepared by dispersing TiO2 nanoparticles into exfoliated a-ZrP suspensions at different concentrations. Scanning electron microscopy and X-ray diffraction were used to characterize the shape, average size, and components of primary ZrP nanoplatelets. The absorbance of the suspensions was measured by a UV-VIS spectrophotometer. The results show that the stability first increased, and then decreased with increasing ZrP concentration at 1 wt.% TiO2. The effect was optimal at 2 wt.% ZrP. Thus, the hindrance of nanoplatelets in the aggregation and sedimentation of nanoparticles is the main reason for improving the stability of nanofluids. PMID:26353576

  6. Preparation and characterization of Zr(SO4)2/TiO2 catalyst.

    PubMed

    Huang, Xin; Gu, Zhenggui; Sun, Hao

    2016-01-01

    Solid acid Zr(SO4)2/TiO2 catalyst has highly catalytic activity, and has non-corrosiveness to equipment. It is separated from production expediently. As the above advantages, the influence of Zr(SO4)2 loading amount, calcination temperature, and calcination time on the solid acid Zr(SO4)2/TiO2 catalyst preparation process is discussed. The experimental condition is optimized by orthogonal test, the result indicate that Zr(SO4)2 load is 65%, calcination temperature is 430°C, and calcination time is 2.5 h. Solid acid catalyst Zr(SO4)2/TiO2 is analyzed and characterized by FT-IR, XRD and SEM. The results will provide the experimental condition for enlarging experimental study. PMID:27339282

  7. Reactive magnetron cosputtering of hard and conductive ternary nitride thin films: Ti-Zr-N and Ti-Ta-N

    SciTech Connect

    Abadias, G.; Koutsokeras, L. E.; Dub, S. N.; Tolmachova, G. N.; Debelle, A.; Sauvage, T.; Villechaise, P.

    2010-07-15

    Ternary transition metal nitride thin films, with thickness up to 300 nm, were deposited by dc reactive magnetron cosputtering in Ar-N{sub 2} plasma discharges at 300 deg. C on Si substrates. Two systems were comparatively studied, Ti-Zr-N and Ti-Ta-N, as representative of isostructural and nonisostructural prototypes, with the aim of characterizing their structural, mechanical, and electrical properties. While phase-separated TiN-ZrN and TiN-TaN are the bulk equilibrium states, Ti{sub 1-x}Zr{sub x}N and Ti{sub 1-y}Ta{sub y}N solid solutions with the Na-Cl (B1-type) structure could be stabilized in a large compositional range (up to x=1 and y=0.75, respectively). Substituting Ti atoms by either Zr or Ta atoms led to significant changes in film texture, microstructure, grain size, and surface morphology, as evidenced by x-ray diffraction, x-ray reflectivity, and scanning electron and atomic force microscopies. The ternary Ti{sub 1-y}Ta{sub y}N films exhibited superior mechanical properties to Ti{sub 1-x}Zr{sub x}N films as well as binary compounds, with hardness as high as 42 GPa for y=0.69. All films were metallic, the lowest electrical resistivity {rho}{approx}65 {mu}{Omega} cm being obtained for pure ZrN, while for Ti{sub 1-y}Ta{sub y}N films a minimum was observed at y{approx}0.3. The evolution of the different film properties is discussed based on microstructrural investigations.

  8. Texture and pyramidal slip in Ti, Zr and their alloys

    SciTech Connect

    Pochettino, A.A.; Gannio, N. ); Edwards, C.V. ); Penelle, R. )

    1992-12-15

    Zirconium, titanium and their alloys have a high anisotropic plastic behavior. One way to show this behavior is to analyze the evolution of the Lankford coefficient (R ([alpha]), values of which are obtained from tensile tests along different directions in the sheet plane). The variation of R([alpha]) can be explained from the crystallographic texture and the active deformation mechanisms. Microstructural observations show that prismatic slip is the most active deformation mode in these materials, but no dimensional change in the [lt][bar c][gt] direction of grains is possible by the activation of the (10[bar 1]0) [lt] 1[bar 2]10[gt] slip alone; so deformation along [0001] has to be accommodated either by (10[bar 1]o) [lt]1[bar 2]13[gt] (or [lt][bar c] + [bar a][gt]) pyramidal slip or by twinning. Many transmission electron microscopy (TEM) studies have shown evidence for [lt][bar c] + [bar a][gt] slip activity, and some authors have reported slip on (1[bar 1]01) planes in Ti alloys. The purpose of this paper is to contribute with another analysis of pyramidal slip activity in hcp textured materials, such as Ti and Zr alloys, and of the hardening mechanisms for this deformation mode. This analysis is performed both in a direct way, by means of TEM observations of deformed samples, and in an indirect way, by different mechanical tests.

  9. Wear and friction properties of experimental Ti-Si-Zr alloys for biomedical applications.

    PubMed

    Tkachenko, Serhii; Datskevich, Oleg; Kulak, Leonid; Jacobson, Staffan; Engqvist, Håkan; Persson, Cecilia

    2014-11-01

    Titanium alloys are widely used in biomedical applications due to their higher biocompatibility in comparison to other metallic biomaterials. However, they commonly contain aluminum and vanadium, whose ions may be detrimental to the nervous system. Furthermore, they suffer from poor wear resistance, which limits their applications. The aim of this study was to evaluate the tribological performance of experimental Ti-1.25Si-5Zr, Ti-2.5Si-5Zr, Ti-6Si-5Zr and Ti-2.5Si-5Zr-0.2Pd alloys as compared to that of control Ti-6Al-4V, CoCr F75 and CoCr F799 alloys. Friction and wear tests were performed using a standard ball-on-disc rig in serum solution at ambient temperature with Si3N4-balls as counterparts. The alloys microstructure and hardness were investigated using optical microscopy, XRD, scanning electron microscopy (SEM) and Vickers indentation. The coefficients of friction of the experimental Ti-Si-Zr alloys were generally lower than the commercial ones with Ti-6Si-5Zr presenting the lowest value (approx. 0.1). Their wear rates were found to be 2-7 times lower than that of the commercial Ti-6Al-4V alloy, but still higher than those of the CoCr alloys. SEM analysis of worn surfaces showed that abrasion was the predominant wear mechanism for all studied materials. Wear and friction were influenced by the formation and stability of transfer layers, and while commercial Ti-6Al-4V as well as the experimental Ti-Si-Zr alloys demonstrated extensive material transfer to the ceramic counterparts, the CoCr alloys did not show such material transfer.

  10. First-principles study of elastic and stability properties of ZrC-ZrN and ZrC-TiC alloys.

    PubMed

    Ivashchenko, V I; Turchi, P E A; Shevchenko, V I

    2009-09-30

    Ab initio calculations of the elastic constants for several cubic ordered structures of zirconium carbonitride (ZrC(x)N(1-x)) and zirconium-titanium carbide (Zr(x)Ti(1-x)C) alloys were carried out. The calculations of total and formation energies, bulk modulus and elastic constants as functions of composition were performed with an ab initio pseudo-potential method. The predicted equilibrium lattice parameters are slightly higher than those found experimentally (on average by 0.2-0.4%). The predicted formation energies indicate that the ZrC(x)N(1-x) alloys are stable even at 0 K in the whole concentration range, while the homogeneous Zr(x)Ti(1-x)C alloys can be stabilized only at high temperatures. Spinodal decomposition of the latter alloys into cubic domains takes place over a wide range of compositions and temperatures. For the carbonitrides, the shear modulus G, the Young's modulus E and the Poisson ratio σ reach an extremum for carbon-rich alloys, and this is attributed to a maximum value of the shear modulus C(44) that corresponds to a valence-electron concentration in the range of 8.2-8.3. This extremal behavior finds its origin in the response of the band structure of ZrC(x)N(1-x) alloys for 0≤x≤1, caused by the monoclinic strain that determines this shear modulus. In contrast, the other shear modulus [Formula: see text] does not exhibit any extremum over the whole composition range. These results are in contrast with those for Zr-Ti carbides for which the elastic properties gradually increase from ZrC to TiC. PMID:21832391

  11. Surface modification of stainless steel orthopedic implants by sol-gel ZrTiO4 and ZrTiO4-PMMA coatings.

    PubMed

    Salahinejad, E; Hadianfard, M J; Macdonald, D D; Sharifi Asl, S; Mozafari, M; Walker, K J; Rad, A Tahmasbi; Madihally, S V; Vashaee, D; Tayebi, L

    2013-08-01

    In this paper, the biocompatibility of a medical-grade stainless steel coated with sol-gel derived, nanostructured inorganic ZrTiO4 and hybrid ZrTiO4-PMMA thin films is correlated with surface characteristics. The surfaces of the samples are characterized by atomic force microscopy, the sessile drop technique, and electrochemical corrosion experiments. The viability of adult human mesenchymal stem cells on the surfaces after one day of culture is also assessed quantitatively and morphologically. According to the results, both of the coatings improve the hydrophilicity, corrosion resistance, and thereby cytocompatibility of the substrate. Despite the higher corrosion protection by the hybrid coating, the sample coated with the inorganic thin film exhibits a better cell response, suggesting the domination of wettability. In summary, the ZrTiO4-based sol-gel films can be considered to improve the biocompatibility of metallic implants.

  12. Surface nanomechanical behavior of ZrN and ZrCN films deposited on NiTi shape memory alloy by magnetron sputtering.

    PubMed

    Chu, C L; Ji, H L; Guo, C; Sheng, X B; Dong, Y S; Lin, P H; Hu, T; Chu, P K

    2011-12-01

    Surface nanomechanical behavior under nanoindentation of ZrN and ZrCN film on NiTi substrate was studied. The surface hardness and modulus of the films increase initially with larger nanoindentation depths and then reach their maximum values. Afterwards, they diminish gradually and finally reaching plateau values which are the composite modulus and composite hardness derived from the ZrN/ZrCN film and NiTi substrate. They are higher than those of electropolished NiTi SMA due to the properties of ZrN and ZrCN. In comparison, the surface nanomechanical properties of electropolished NiTi exhibit a different change with depths. PMID:22409080

  13. Wear and Corrosion Behavior of Zr-Doped DLC on Ti-13Zr-13Nb Biomedical Alloy

    NASA Astrophysics Data System (ADS)

    Kumar, Prateek; Babu, P. Dilli; Mohan, L.; Anandan, C.; Grips, V. K. William

    2013-01-01

    Zirconium (Zr)-doped DLC was deposited on biomedical titanium alloy Ti-13Nb-13Zr by a combination of plasma-enhanced chemical vapor deposition and magnetron sputtering. The concentration of Zr in the films was varied by changing the parameters of the bi-polar pulsed power supply and the Ar/CH4 gas composition. The coatings were characterized for composition, morphology, nanohardness, corrosion resistance in simulated body fluid (SBF) and tribological properties. X-ray photoelectron spectroscopy (XPS) studies on the samples were used to estimate the concentration of Zr in the films. XPS and micro-Raman studies were used to find the variation of I D/ I G ratio with Zr concentration. These studies show that the disorder in the film increased with increasing Zr concentration as deduced from the I D/ I G ratio. Nanohardness measurements showed no clear dependence of hardness and Young's modulus on Zr concentration. Reciprocating wear studies showed a low coefficient of friction (0.04) at 1 N load and it increased toward 0.4 at higher loads. The wear volume was lower at all loads on the coated samples. The wear mechanism changed from abrasive wear on the substrate to adhesive wear after coating. The corrosion current in SBF was unaffected by the coating and corrosion potential moved toward nobler (more positive) values.

  14. Deposition and characterization of TiZrV-Pd thin films by dc magnetron sputtering

    NASA Astrophysics Data System (ADS)

    Wang, Jie; Zhang, Bo; Xu, Yan-Hui; Wei, Wei; Fan, Le; Pei, Xiang-Tao; Hong, Yuan-Zhi; Wang, Yong

    2015-12-01

    TiZrV film is mainly applied in the ultra-high vacuum pipes of storage rings. Thin film coatings of palladium, which are added onto the TiZrV film to increase the service life of nonevaporable getters and enhance H2 pumping speed, were deposited on the inner face of stainless steel pipes by dc magnetron sputtering using argon gas as the sputtering gas. The TiZrV-Pd film properties were investigated by atomic force microscope (AFM), scanning electron microscope (SEM), X-ray photoelectron spectroscopy (XPS) and X-Ray Diffraction (XRD). The grain size of TiZrV and Pd films were about 0.42-1.3 nm and 8.5-18.25 nm respectively. It was found that the roughness of TiZrV films is small, about 2-4 nm, but for Pd film it is large, about 17-19 nm. The PP At. % of Pd in TiZrV/Pd films varied from 86.84 to 87.56 according to the XPS test results. Supported by National Natural Science Funds of China (11205155) and Fundamental Research Funds for the Central Universities (WK2310000041)

  15. Nanotube nucleation phenomena on Ti-25Ta-xZr alloys for implants using ATO technique.

    PubMed

    Kim, Hyun-Ju; Jeong, Yong-Hoon; Brantley, William A; Choe, Han-Cheol

    2014-10-01

    The purpose of this study was to investigate nanotube nucleation phenomena on the Ti-25Ta-xZr alloys for implant materials, using an anodic titanium oxide (ATO) technique. Ti-25Ta-(0 wt.%-15 wt.%) Zr alloys were prepared using a vacuum arc-melting furnace. The Ti-25Ta-xZr alloys were then homogenized for 12 hr at 1000 degrees C, followed by water quenching. Formation of the nanotubular oxide surface structure was achieved initially on the Ti-25Ta-xZr alloys by anodization in a 1 M H3PO4 electrolyte containing 0.8 wt.% NaF at room temperature, using a potentiostat. After the first formation of the nanotubes was achieved, this initial nanotube layer was eliminated, and further anodization was carried out repeatedly. The microstructure, phase transformation, and morphology of nanotubular Ti-25Ta-xZr alloys and the process of nanotube growth using this ATO method were analyzed by X-ray diffraction, field-emission scanning electron microscopy, and energy dispersive X-ray spectroscopy. Microstructures of the Ti-25Ta-xZr alloys changed from α" phase to β phase. Nanotubes formed with the ATO technique had pit-like top holes, with thinner walls and lower contact angle, compared to the initially formed nanotubes.

  16. 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.

  17. Mechanism of photochromic effect in Pb(Zr,Ti)O3 and (Pb,La)(Zr,Ti)O3 ceramics under violet/infrared light illumination

    NASA Astrophysics Data System (ADS)

    Xu, Caixia; Zhang, Jingwen; Xu, Long; Zhao, Hua

    2015-01-01

    Obvious photochromic effects were observed in Pb(Zr,Ti)O3 and (Pb,La)(Zr,Ti)O3 (PLZT) ceramics, along with exponential responses to illumination power in both darkening and bleaching processes. An interesting anomalous dispersion in the transparent PLZT was observed and discussed. A tentative physical picture based on photoinduced electron stimulated processes and on structural change was proposed to explain all the interesting observations. Rate equations were established and solved in verifying the validity of the proposed model. This work may serve as guidance in designing tunable achromatic lenses, UV and IR light detectors and sensors.

  18. Mechanism of photochromic effect in Pb(Zr,Ti)O{sub 3} and (Pb,La)(Zr,Ti)O{sub 3} ceramics under violet/infrared light illumination

    SciTech Connect

    Xu, Caixia; Xu, Long; Zhao, Hua; Zhang, Jingwen

    2015-01-14

    Obvious photochromic effects were observed in Pb(Zr,Ti)O{sub 3} and (Pb,La)(Zr,Ti)O{sub 3} (PLZT) ceramics, along with exponential responses to illumination power in both darkening and bleaching processes. An interesting anomalous dispersion in the transparent PLZT was observed and discussed. A tentative physical picture based on photoinduced electron stimulated processes and on structural change was proposed to explain all the interesting observations. Rate equations were established and solved in verifying the validity of the proposed model. This work may serve as guidance in designing tunable achromatic lenses, UV and IR light detectors and sensors.

  19. Microstructure and corrosion resistance of nanocrystalline TiZrN films on AISI 304 stainless steel substrate

    SciTech Connect

    Lin, Yu-Wei; Huang, Jia-Hong; Yu, Ge-Ping

    2010-07-15

    This study investigated the microstructure and properties of nanocrystalline TiZrN films on AISI 304 stainless steel substrate. TiZrN films were prepared by reactive magnetron sputtering based on the previous optimum coating conditions (substrate temperature, system pressure, nitrogen flow, etc.) for TiN and ZrN thin films. The composition ratio of TiZrN coatings were adjusted by changing the Zr target power, while keeping the Ti target power constant. Experiments were conduced to find the optimum composition with desired properties. The ratio of TiZrN composition was analyzed by x-ray photoelectron spectroscopy and Rutherford backscattering spectrometer. In terms of phase formation, there were two types of coatings that were considered: single-phase solid solutions of TiZrN and interlacing nuclei of TiZr in the matrix of TiZrN. The thickness of all TiZrN films as measured by the secondary ion mass spectroscopy was about 500 nm, and the composition depth profiles indicated that the compositions in the TiZrN films were uniform from the film surface to the 304 stainless steel substrate. The crystal structure of the TiZrN films was determined by x-ray diffraction using a M18XHF-SRA diffractometer with Cu K{sub {alpha}} radiation. A diffraction peak of TiZrN (002) was observed between that of TiN (002) and ZrN (002); similarly, a diffraction peak of TiZrN (111) was observed between that of TiN(111) and ZrN(111), respectively. The corrosion resistance of the TiZrN film deposited on the 304 stainless steel has been investigated by electrochemical measurement. The electrolyte, 0.5M H{sub 2}SO{sub 4} containing 0.05M KSCN, was used for the potentiodynamic polarization. The potentiodynamic scan was conducted from -800 to 800 mV standard calomel electrode (SCE).

  20. Composition dependences of crystal structure and electrical properties of epitaxial Pb(Zr,Ti)O3 films grown on Si and SrTiO3 substrates

    NASA Astrophysics Data System (ADS)

    Okamoto, Shoji; Okamoto, Satoshi; Yokoyama, Shintaro; Akiyama, Kensuke; Funakubo, Hiroshi

    2016-10-01

    {100}-oriented Pb(Zr x ,Ti1- x )O3 (PZT) thin films of approximately 2 µm thickness and Zr/(Zr + Ti) ratios of 0.39-0.65 were epitaxially grown on (100)cSrRuO3//(100)SrTiO3 (STO) and (100)cSrRuO3//(100)cLaNiO3//(100)CeO2//(100)YSZ//(100)Si (Si) substrates having different thermal expansion coefficients by pulsed metal-organic chemical vapor deposition (MOCVD). The effects of Zr/(Zr + Ti) ratio and type of substrate on the crystal structure and dielectric, ferroelectric and piezoelectric properties of the films were systematically investigated. The X-ray diffraction measurement showed that both films changed from having a tetragonal symmetry to rhombohedral symmetry through the coexisting region with increasing Zr/(Zr + Ti) ratio. This region showed the Zr/(Zr + Ti) ratios of 0.45-0.59 for the films on the STO substrates that were wider than the films on the Si substrates. Saturation polarization values were minimum at approximately Zr/(Zr + Ti) = 0.50 for the films on the STO substrates, and no obvious Zr/(Zr + Ti) ratio dependence was detected in the films on the Si substrates. On the other hand, the maximum field-induced strain values measured by scanning force microscopy at approximately Zr/(Zr + Ti) = 0.50 at 100 kV/cm were about 0.5 and 0.1% in the films on the Si and STO, respectively.

  1. Thermal stability of nanostructured TiZrSiN thin films subjected to helium ion irradiation

    NASA Astrophysics Data System (ADS)

    Uglov, V. V.; Abadias, G.; Zlotski, S. V.; Saladukhin, I. A.; Skuratov, V. A.; Leshkevich, S. S.; Petrovich, S.

    2015-07-01

    The phase stability, upon vacuum annealing up to 1000 °C, of nanostructured (Ti,Zr)1-xSixN thin films is investigated by X-ray diffraction analysis as a function of Si content (0.13 ⩽ x ⩽ 0.25) and prior irradiation with He ions (40 kV). The quaternary TiZrSiN thin films were deposited by reactive magnetron sputtering from elemental targets at the substrate temperature of 600 °C. It was found that the increase in Si content, x, results in the transformation of structure from nanocrystalline (x = 0.13, grain size of 11 nm) to nanocomposite state (0.19 < x ⩽ 0.25, grain size of 5 nm). The phase composition of the films changes from single-phase, cubic c-(Ti,Zr)N columns with (1 1 1) preferred orientation to dual-phase system consisting of c-(Ti,Zr)N crystallites and amorphous SiNy. Irradiation with He ions at the doses of 2 × 1016 and 5 × 1016 cm-2 does change the phase composition of the films. It is found that the onset temperature for phase decomposition decreases from 1000 °C to 800 °C with increasing Si content for unirradiated films. The formation of a secondary ZrN phase is observed concomitantly with increased broadening of the (2 0 0) c-(Ti,Zr)N diffraction peak. For irradiated films, the subsequent annealing at 1000 °C leads to decomposition of the c-(Ti,Zr)N solid solution into TiN- and ZrN-rich phases as well as crystallization of hexagonal Si3N4 phase.

  2. Comparative ab initio calculations of SrTiO3/BaTiO3 and SrZrO3/PbZrO3 (0 0 1) heterostructures

    NASA Astrophysics Data System (ADS)

    Piskunov, Sergei; Eglitis, Roberts I.

    2016-05-01

    Using a B3PW hybrid exchange-correlation functional within the density functional theory (DFT) we calculated from the first principles the electronic structure of BaTiO3/SrTiO3 and PbZrO3/SrZrO3 (0 0 1) interfaces. The optical band gap of both BaTiO3/SrTiO3 and PbZrO3/SrZrO3 (0 0 1) interfaces depends mostly from BaO or TiO2 and SrO or ZrO2 termination of the upper layer, respectively. Based on the results of our calculations we predict increase of the Ti-O and Zr-O chemical bond covalency near the SrTiO3/BaTiO3 and SrZrO3/PbZrO3 (0 0 1) interfaces as compared to the BaTiO3 and PbZrO3 bulk.

  3. Ferroelectric performances and crystal structures of (Pb, La)(Zr, Ti, Nb)O{sub 3}

    SciTech Connect

    Kitamura, Naoto; Mizoguchi, Takuma; Itoh, Takanori; Idemoto, Yasushi

    2014-02-15

    In this study, we focused on Nb and La substituted Pb(Zr, Ti)O{sub 3}: i.e., (Pb, La)(Zr, Ti, Nb)O{sub 3}. As for the samples, dependences of ferroelectric properties on La and Nb compositions were examined. In addition, the crystal structures were analyzed by the Rietveld method, and then a relationship between the metal compositions and the crystal structures were discussed. From P–E hysteresis loop measurements, it was found that the remanant polarization of Pb(Zr, Ti)O{sub 3} was increased by both the La and Nb substitutions although the heavy substitution of La had an undesirable effect. It was also indicated that the Curie temperature decreased with increasing La content. The Rietveld analysis using synchrotron X-ray diffraction patterns demonstrated that the structure distortion was relaxed by the La and Nb substitutions. Such a change in the crystals was well consistent with the harmful effects on the Curie temperature and the remanent polarization by the heavy La substitution. - Graphical abstract: Rietveld refinement pattern of 2 mol% PbSiO{sub 3}-added Pb{sub 0.95}La{sub 0.05}Zr{sub 0.50}Ti{sub 0.45}Nb{sub 0.05}O{sub 3} (synchrotron X-ray diffraction). Display Omitted - Highlights: • (Pb,La)(Zr,Ti,Nb)O{sub 3} were successfully synthesized. • Remanant polarization of Pb(Zr,Ti)O{sub 3} was improved by substitutions of La and Nb. • Crystal structures of (Pb,La)(Zr,Ti,Nb)O{sub 3} were refined and the distortions were estimated.

  4. 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.

  5. In vitro biocompatibility response of Ti-Zr-Si thin film metallic glasses

    NASA Astrophysics Data System (ADS)

    Ke, J. L.; Huang, C. H.; Chen, Y. H.; Tsai, W. Y.; Wei, T. Y.; Huang, J. C.

    2014-12-01

    In this study, the bio-electrochemical response of the Ti-Zr-Si thin film metallic glasses (TFMGs) in simulated body fluid with different contents of titanium is measured via potentiostat. According to the results of bio-corrosion potential and current, as well as the polarization resistance, it is concluded that the Ti66Zr25Si9 TFMGs possess the highest bio-electrochemical resistance. With increasing content of titanium, the corrosion resistance becomes progressively higher. The passive current results reveal that amorphous alloys can form a more protective and denser passive film on the metallic glass surface than the crystalline materials. In addition, the mechanical performance of the Ti-Zr-Si TFMGs is better than the crystalline counterparts. As a result, the Ti-based TFMGs are considered to be potential materials for bio-coating applications.

  6. Effects of Grain Size and Co Addition on the Transformation Temperatures of Ti-Ni-Zr Thin Films

    NASA Astrophysics Data System (ADS)

    Ishida, Akira

    2015-11-01

    The transformation temperatures and temperature hysteresis of Ti-Ni-Zr films were found to be very sensitive to grain size. However, films annealed at 1223 K exhibited transformation temperatures and temperature hysteresis nearly the same as those of the corresponding bulk alloys. Annealing of Ti-Ni-Zr-Co films with 10.5-26.7 at.% Zr and 0-12.7 at.% Co at 1223 K for 10 h showed that Co substitution for Ni in the Ti-Ni-Zr films was beneficial to reducing the temperature hysteresis. Correspondingly, a Ti29.3Ni42.7Zr20.9Co7.1 bulk alloy annealed at 1223 K for 10 h exhibited a high martensitic transformation temperature (432 K) and a small temperature hysteresis compared to Ti-Ni-Zr bulk alloys (21 K). The present study verified the usefulness of sputtering for the exploration of new shape-memory alloys.

  7. First-principles study of elastic and stability properties of ZrC-ZrN and ZrC-TiC alloys

    NASA Astrophysics Data System (ADS)

    Ivashchenko, V. I.; Turchi, P. E. A.; Shevchenko, V. I.

    2009-09-01

    Ab initio calculations of the elastic constants for several cubic ordered structures of zirconium carbonitride (ZrCxN1-x) and zirconium-titanium carbide (ZrxTi1-xC) alloys were carried out. The calculations of total and formation energies, bulk modulus and elastic constants as functions of composition were performed with an ab initio pseudo-potential method. The predicted equilibrium lattice parameters are slightly higher than those found experimentally (on average by 0.2-0.4%). The predicted formation energies indicate that the ZrCxN1-x alloys are stable even at 0 K in the whole concentration range, while the homogeneous ZrxTi1-xC alloys can be stabilized only at high temperatures. Spinodal decomposition of the latter alloys into cubic domains takes place over a wide range of compositions and temperatures. For the carbonitrides, the shear modulus G, the Young's modulus E and the Poisson ratio σ reach an extremum for carbon-rich alloys, and this is attributed to a maximum value of the shear modulus C44 that corresponds to a valence-electron concentration in the range of 8.2-8.3. This extremal behavior finds its origin in the response of the band structure of ZrCxN1-x alloys for 0<=x<=1, caused by the monoclinic strain that determines this shear modulus. In contrast, the other shear modulus \\frac {1}{2}(C_{11}-C_{12}) does not exhibit any extremum over the whole composition range. These results are in contrast with those for Zr-Ti carbides for which the elastic properties gradually increase from ZrC to TiC.

  8. The Icosahedral Ti-Zr-Ni Quasicrystal - A Ground State Quasicrystal?

    NASA Astrophysics Data System (ADS)

    Hennig, R. G.; Carlsson, A. E.; Kelton, K. F.; Henley, C. L.

    2001-03-01

    The icosahedral Ti-Zr-Ni quasicrystal is known to be thermodynamically stable [1]. Most stable quasicrystals form at high temperatures from the liquid phase. In contrast to those quasicrystals, however, the Ti-Zr-Ni quasicrystal forms at lower temperatures, near 570^circC, by a solid state transformation of crystal phases that are stable at higher temperatures. A decorated canonical cell tiling for the structure of this quasicrystal was determined by a refinement to x-ray and neutron diffraction data and results from ab initio calculations. The energetic stability of the icosahedral Ti-Zr-Ni quasicrystal was investigated by total energy calculations using the density-functional code VASP [2]. The ternary ground state phase diagram for Ti-Zr-Ni was determined. The energy of the structural model of the quasicrystal is found to be lower than the energy of any known competing phase. This result, coupled with the continued stability with long anneals at lower temperatures, strongly suggest that the icosahedral Ti-Zr-Ni quasicrystal is a ground state quasicrystal. [1] K. F. Kelton, W. J. Kim, and R. M. Stroud. Appl. Phys. Let. 70, 3230 (1997). [2] G. Kresse and J. Hafner, Phys. Rev. B47, RC 558 (1993); G. Kresse and J. Furthmüller, Phys. Rev. B54, 11169 (1996).

  9. 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. PMID:25848727

  10. 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.

  11. New FCC Mg–Zr and Mg–Zr–ti deuterides obtained by reactive milling

    SciTech Connect

    Guzik, Matylda N. Deledda, Stefano; Sørby, Magnus H.; Yartys, Volodymyr A.; Hauback, Bjørn C.

    2015-03-15

    Results for binary Mg–Zr and ternary Mg–Zr–Ti mixtures ball milled at room temperature under reactive deuterium atmosphere (5.6–6.7 MPa) are reported. X-ray and neutron powder diffraction combined with Rietveld refinements show that two new cubic phases were formed during milling. Mg{sub 0.40}Zr{sub 0.60}D{sub 1.78} and Mg{sub 0.40}Zr{sub 0.26}Ti{sub 0.34}D{sub 1.98} crystallize with disordered face centered cubic metal atom arrangements. Results of differential scanning calorimetry and termogravimetric measurements demonstrate that both deuterides desorb deuterium at lower temperatures than MgD{sub 2}, ZrD{sub 2} or TiD{sub 2}; 528 and 575 K in the Mg–Zr–D and Mg–Zr–Ti–D system, respectively. Interestingly, Mg{sub 0.40}Zr{sub 0.26}Ti{sub 0.34}D{sub 1.98} stores deuterium reversibly at 673 K and 10 MPa of D{sub 2}. - Graphical abstract: High resolution SR-PXD patterns obtained for Mg{sub 0.40}Zr{sub 0.60}D{sub 1.78} and first time reported Mg{sub 0.40}Zr{sub 0.26}Ti{sub 0.34}D{sub 1.98}. - Highlights: • Synthesis and characterization of Mg{sub 0.40}Zr{sub 0.60}D{sub 1.78} and Mg{sub 0.40}Zr{sub 0.26}Ti{sub 0.34}D{sub 1.98}. • New deuterides obtained by milling under H{sub 2} gas pressure in the order of a few MPa. • Phases desorb deuterium at temperature lower than corresponding binary deuterides. • Mg{sub 0.40}Zr{sub 0.26}Ti{sub 0.34}D{sub 1.98} stores hydrogen reversibly at 673 K and 10 MPa of D{sub 2}.

  12. Local structure of equilibrium and supercooled Ti-Zr-Ni liquids

    SciTech Connect

    Lee, G. W.; Gangopadhyay, A.; Hyers, R.; Rathz, T.; Rogers, J.; Robinson, D.; Goldman, A.; Kelton, K.

    2008-05-01

    Recently, we reported the results of experimental in situ high-energy x-ray diffraction studies of electrostatically levitated equilibrium and supercooled metallic elements and alloy liquids, showing evidence for icosahedral short-range ordering (ISRO). In this paper, these studies are extended to binary Ti-Zr and ternary Ti-Zr-Ni alloys. From a cluster-based analysis of the x-ray structure factors, it is concluded that ISRO in the binary alloys becomes progressively more dominant, and the coherence length of the order becomes longer, with the addition of Ni, especially near the concentration of 21 at. % Ni. The effect of chemical interactions among Ti/Zr-Ni and the atomic size on the stabilization of the ISRO is discussed.

  13. 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.

  14. 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. PMID:25818950

  15. 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.

  16. 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.

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

    DOE PAGESBeta

    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.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

  18. Photocatalytic enhancement of TiO2 by B and Zr co-doping and modulation of microstructure

    NASA Astrophysics Data System (ADS)

    Fu, Chengxin; Gong, Yinyan; Wu, Yitao; Liu, Jiaqi; Zhang, Zhen; Li, Can; Niu, Lengyuan

    2016-08-01

    Visible-light photodegradation test revealed that B and Zr co-doping can raise the photocatalytic ability of the undoped TiO2 by a fold. XRD crystallography and Raman phonon spectroscopy measurements suggest that the Zr4+ ions replace the Ti4+ ions while the B3+ ions occupy the interstitial sites, expanding the unit-cell volume and reducing crystallite size. The incorporation of interstitial boron dopants creates oxygen vacancies (Ovrad rad) and reduce Ti4+ to Ti3+ to form [Ovrad rad -Ti3+]+, which traps the carriers and prolongs carrier lifetime. Moreover, Zr4+ ions replace Ti4+ ions and form impurity levels, which could improve visible light response. The co-doped samples are benefited from both B interstitials and Zr substitutes.

  19. Are new TiNbZr alloys potential substitutes of the Ti6Al4V alloy for dental applications? An electrochemical corrosion study.

    PubMed

    Ribeiro, Ana Lúcia Roselino; Hammer, Peter; Vaz, Luís Geraldo; Rocha, Luís Augusto

    2013-12-01

    The main aim of this work was to assess the electrochemical behavior of new Ti35Nb5Zr and Ti35Nb10Zr alloys in artificial saliva at 37 °C to verify if they are indicated to be used as biomaterials in dentistry as alternatives to Ti6Al4V alloys in terms of corrosion protection efficiency of the material. Electrochemical impedance spectroscopy (EIS) experiments were carried out for different periods of time (0.5-216 h) in a three-electrode cell, where the working electrode (Ti alloys) was exposed to artificial saliva at 37 °C. The near-surface region of the alloys was investigated using x-ray photoelectron spectroscopy (XPS). All alloys exhibited an increase in corrosion potential with the immersion time, indicating the growth and stabilization of the passive film. Ti35Nb5Zr and Ti6Al4V alloys had their EIS results interpreted by a double-layer circuit, while the Ti35Nb10Zr alloy was modeled by a one-layer circuit. In general, the new TiNbZr alloys showed similar behavior to that observed for the Ti6Al4V. XPS results suggest, in the case of the TiNbZr alloys, the presence of a thicker passive layer containing a lower fraction of TiO2 phase than that of Ti6Al4V. After long-term immersion, all alloys develop a calcium phosphate phase on the surface. The new TiNbZr alloys appear as potential candidates to be used as a substitute to Ti6Al4V in the manufacturing of dental implant-abutment sets.

  20. Crystal Structure, Transformation Strain, and Superelastic Property of Ti-Nb-Zr and Ti-Nb-Ta Alloys

    NASA Astrophysics Data System (ADS)

    Kim, Hee Young; Fu, Jie; Tobe, Hirobumi; Kim, Jae Il; Miyazaki, Shuichi

    2015-06-01

    The composition dependences of transformation strain and shape memory, and superelastic properties were extensively investigated in Ti-Nb-Zr and Ti-Nb-Ta alloys in order to establish the guidelines for alloy design of biomedical superelastic alloys. The effects of composition on the crystal structure of the parent (β) phase and the martensite (α″) phase were also investigated. Results showed that not only transformation temperature but also transformation strain is tunable by alloy design, i.e., adjusting contents of Nb, Zr, and Ta. The lattice constant of the β phase increased linearly with increasing Zr content, while it was insensitive to Nb and Ta contents. On the other hand, the lattice constants of the α″ phase are mainly affected by Nb and Ta contents. The increase of Zr content exhibited a weaker impact on the transformation strain compared with Nb and Ta. The addition of Zr as a substitute of Nb with keeping superelasticity at room temperature significantly increased the transformation strain. On the other hand, the addition of Ta decreased the transformation strain at the compositions showing superelasticity. This study confirmed that the crystallography of martensitic transformation can be the main principal to guide the alloy design of biomedical superelastic alloys.

  1. First principles theoretical investigations of low Young's modulus beta Ti-Nb and Ti-Nb-Zr alloys compositions for biomedical applications.

    PubMed

    Karre, Rajamallu; Niranjan, Manish K; Dey, Suhash R

    2015-05-01

    High alloyed β-phase stabilized titanium alloys are known to provide comparable Young's modulus as that to the human bones (~30 GPa) but is marred by its high density. In the present study the low titanium alloyed compositions of binary Ti-Nb and ternary Ti-Nb-Zr alloy systems, having stable β-phase with low Young's modulus are identified using first principles density functional framework. The theoretical results suggest that the addition of Nb in Ti and Zr in Ti-Nb increases the stability of the β-phase. The β-phase in binary Ti-Nb alloys is found to be fully stabilized from 22 at.% of Nb onwards. The calculated Young's moduli of binary β-Ti-Nb alloy system are found to be lower than that of pure titanium (116 GPa). For Ti-25(at.%)Nb composition the calculated Young's modulus comes out to be ~80 GPa. In ternary Ti-Nb-Zr alloy system, the Young's modulus of Ti-25(at.%)Nb-6.25(at.%)Zr composition is calculated to be ~50 GPa. Furthermore, the directional Young's moduli of these two selected binary (Ti-25(at.%)Nb) and ternary alloy (Ti-25(at.%)Nb-6.25(at.%)Zr) compositions are found to be nearly isotropic in all crystallographic directions.

  2. Irradiation performance of U-Mo-Ti and U-Mo-Zr dispersion fuels in Al-Si matrixes

    NASA Astrophysics Data System (ADS)

    Kim, Yeon Soo; Hofman, G. L.; Robinson, A. B.; Wachs, D. M.; Ryu, H. J.; Park, J. M.; Yang, J. H.

    2012-08-01

    Performance of U-7 wt.%Mo with 1 wt.%Ti, 1 wt.%Zr or 2 wt.%Zr, dispersed in an Al-5 wt.%Si alloy matrix, was investigated through irradiation tests in the ATR at INL and HANARO at KAERI. Post-irradiation metallographic features show that the addition of Ti or Zr suppresses interaction layer growth between the U-Mo and the Al-5 wt.%Si matrix. However, higher fission gas swelling was observed in the fuel with Zr addition, while no discernable effect was found in the fuel with Ti addition as compared to U-Mo without the addition. Known to have a destabilizing effect on the γ-phase U-Mo, Zr, either as alloy addition or fission product, is ascribed for the disadvantageous result. Considering its benign effect on fuel swelling, with slight disadvantage from neutron economy point of view, Ti may be a better choice for this purpose.

  3. Mechanical treatment of TiO2 and ZrO2 oxide mixtures.

    PubMed

    Kraleva, Elka; Spojakina, Alla; Saladino, Maria Luisa; Caponetti, Eugenio; Jiratova, Kveta

    2010-12-01

    The mixed ZrO2-TiO2 system (5-50 wt% of ZrO2) has been studied to investigate the influence of the mechanical treatment on its physicochemical properties depending on the composition, time of milling (5, 10 and 20 min, r.p.m. 82) and temperature (400, 550 and 700 degrees C). Samples were characterized by Raman spectroscopy, X-ray powder diffraction, Scanning Electron Microscopy coupled with Energy Dispersion X-ray analyzer, High Resolution-Transmission Electron Microscopy and nitrogen adsorption porosimetry. Results show that srilankite (TiZrO4) phase has been produced. No influence of the milling time and temperature on the phase composition is observed. The presence of zirconia increases the thermal stability of anatase phase up to 700 degrees C hindering the anatase rutile phase transformation.

  4. Mechanical treatment of TiO2 and ZrO2 oxide mixtures.

    PubMed

    Kraleva, Elka; Spojakina, Alla; Saladino, Maria Luisa; Caponetti, Eugenio; Jiratova, Kveta

    2010-12-01

    The mixed ZrO2-TiO2 system (5-50 wt% of ZrO2) has been studied to investigate the influence of the mechanical treatment on its physicochemical properties depending on the composition, time of milling (5, 10 and 20 min, r.p.m. 82) and temperature (400, 550 and 700 degrees C). Samples were characterized by Raman spectroscopy, X-ray powder diffraction, Scanning Electron Microscopy coupled with Energy Dispersion X-ray analyzer, High Resolution-Transmission Electron Microscopy and nitrogen adsorption porosimetry. Results show that srilankite (TiZrO4) phase has been produced. No influence of the milling time and temperature on the phase composition is observed. The presence of zirconia increases the thermal stability of anatase phase up to 700 degrees C hindering the anatase rutile phase transformation. PMID:21121348

  5. Effects of TiN coating on the corrosion of nanostructured Ti-30Ta-xZr alloys for dental implants

    NASA Astrophysics Data System (ADS)

    Kim, Won-Gi; Choe, Han-Cheol

    2012-01-01

    Electrochemical characteristics of a titanium nitride (TiN)-coated/nanotube-formed Ti-Ta-Zr alloy for biomaterials have been researched by using the magnetic sputter and electrochemical methods. Ti-30Ta-xZr (x = 3, 7 and 15 wt%) alloys were prepared by arc melting and heat treated for 24 h at 1000 °C in an argon atmosphere and then water quenching. The formation of oxide nanotubes was achieved by anodizing a Ti-30Ta-xZr alloy in H3PO4 electrolytes containing small amounts of fluoride ions at room temperature. Anodization was carried out using a scanning potentiostat, and all experiments were conducted at room temperature. The microstructure and morphology of nanotube arrays were characterized by optical microscopy (OM), field emission scanning electron microscopy (FE-SEM) and X-ray diffraction (XRD). The TiN coatings were obtained by the radio-frequency (RF) magnetron sputtering technique. The depositions were performed from pure Ti targets on Ti-30Ta-xZr alloys substrates. The corrosion properties of the specimens were examined using potentiodynamic test in a 0.9% NaCl solution by using potentiostat. The microstructures of Ti-30Ta-xZr alloys were changed from an equiaxed to a needle-like structure with increasing Zr content. The interspace between the nanotubes was approximately 20, 80 and 200 nm for Zr contents of 3, 7 and 15 wt%, respectively. The corrosion resistance of the TiN-coated on the anodized Ti-30Ta-xZr alloys was higher than that of the untreated Ti alloys, indicating a better protective effect.

  6. Superelasticity, corrosion resistance and biocompatibility of the Ti-19Zr-10Nb-1Fe alloy.

    PubMed

    Xue, Pengfei; Li, Yan; Li, Kangming; Zhang, Deyuan; Zhou, Chungen

    2015-05-01

    Microstructure, mechanical properties, superelasticity and biocompatibility of a Ti-19Zr-10Nb-1Fe alloy are investigated. X-ray diffraction spectroscopy and transmission electron microscopy observations show that the as-cast Ti-19Zr-10Nb-1Fe alloy is composed of α' and β phases, but only the β phase exists in the as-rolled and as-quenched alloys. The tensile stress-strain tests indicate that the as-quenched alloy exhibits a good combination of mechanical properties with a large elongation of 25%, a low Young's modulus of 59 GPa and a high ultimate tensile stress of 723 MPa. Superelastic recovery behavior is found in the as-quenched alloy during tensile tests, and the corresponding maximum of superelastic strain is 4.7% at the pre-strain of 6%. A superelastic recovery of 4% with high stability is achieved after 10 cyclic loading-unloading training processes. Potentiodynamic polarization and ion release measurements indicate that the as-quenched alloy shows a lower corrosion rate in Hank's solution and a much less ion release rate in 0.9% NaCl solution than those of the NiTi alloys. Cell culture results indicate that the osteoblasts' adhesion and proliferation are similar on both the Ti-19Zr-10Nb-1Fe and NiTi alloys. A better hemocompatibility is confirmed for the as-quenched Ti-19Zr-10Nb-1Fe alloy, attributed to more stable platelet adhesion and small activation degree, and a much lower hemolysis rate compared with the NiTi alloy. PMID:25746260

  7. Superelasticity, corrosion resistance and biocompatibility of the Ti-19Zr-10Nb-1Fe alloy.

    PubMed

    Xue, Pengfei; Li, Yan; Li, Kangming; Zhang, Deyuan; Zhou, Chungen

    2015-05-01

    Microstructure, mechanical properties, superelasticity and biocompatibility of a Ti-19Zr-10Nb-1Fe alloy are investigated. X-ray diffraction spectroscopy and transmission electron microscopy observations show that the as-cast Ti-19Zr-10Nb-1Fe alloy is composed of α' and β phases, but only the β phase exists in the as-rolled and as-quenched alloys. The tensile stress-strain tests indicate that the as-quenched alloy exhibits a good combination of mechanical properties with a large elongation of 25%, a low Young's modulus of 59 GPa and a high ultimate tensile stress of 723 MPa. Superelastic recovery behavior is found in the as-quenched alloy during tensile tests, and the corresponding maximum of superelastic strain is 4.7% at the pre-strain of 6%. A superelastic recovery of 4% with high stability is achieved after 10 cyclic loading-unloading training processes. Potentiodynamic polarization and ion release measurements indicate that the as-quenched alloy shows a lower corrosion rate in Hank's solution and a much less ion release rate in 0.9% NaCl solution than those of the NiTi alloys. Cell culture results indicate that the osteoblasts' adhesion and proliferation are similar on both the Ti-19Zr-10Nb-1Fe and NiTi alloys. A better hemocompatibility is confirmed for the as-quenched Ti-19Zr-10Nb-1Fe alloy, attributed to more stable platelet adhesion and small activation degree, and a much lower hemolysis rate compared with the NiTi alloy.

  8. Biomimetic Hydroxyapatite Growth on Functionalized Surfaces of Ti-6Al-4V and Ti-Zr-Nb Alloys.

    PubMed

    Pylypchuk, Ie V; Petranovskaya, A L; Gorbyk, P P; Korduban, A M; Markovsky, P E; Ivasishin, O M

    2015-12-01

    A biomimetic approach for coating titanium-containing alloys with hydroxyapatite (HA) is reported in the article. Two types of Ti-containing alloys were chosen as an object for coating: Ti-6Al-4V (recommended for orthopedic application) and a novel highly biocompatible Ti-Zr-Nb alloy, with good mechanical compatibility due to a modulus that is more close to that of human bones (E ≈ 50 GPa instead of 110 GPa in Ti-6Al-4V). Coating process was carried out in a 10×-concentrated simulated body fluid (SBF)-synthetic analog of human body plasma. The effect of oxidized and carboxylated alloy surface on formation of biomimetic hydroxyapatite has been studied. By XRD, we found influence of thermal conditions on HA crystal formation and size. SEM images and Fourier transform infrared confirmed that hydroxyapatite with different morphology, crystallinity, and Ca/P ratio formed on metallic surfaces. X-ray photoelectron spectroscopy showed that in the Ti-6AL-4V sample the observed Ca/P ratio reach 0.97, whereas in the Ti-Zr-Nb sample the observed Ca/P ratio reach 1.15.

  9. Biomimetic Hydroxyapatite Growth on Functionalized Surfaces of Ti-6Al-4V and Ti-Zr-Nb Alloys

    NASA Astrophysics Data System (ADS)

    Pylypchuk, Ie V.; Petranovskaya, A. L.; Gorbyk, P. P.; Korduban, A. M.; Markovsky, P. E.; Ivasishin, O. M.

    2015-08-01

    A biomimetic approach for coating titanium-containing alloys with hydroxyapatite (HA) is reported in the article. Two types of Ti-containing alloys were chosen as an object for coating: Ti-6Al-4V (recommended for orthopedic application) and a novel highly biocompatible Ti-Zr-Nb alloy, with good mechanical compatibility due to a modulus that is more close to that of human bones (E ≈ 50 GPa instead of 110 GPa in Ti-6Al-4V). Coating process was carried out in a 10×-concentrated simulated body fluid (SBF)—synthetic analog of human body plasma. The effect of oxidized and carboxylated alloy surface on formation of biomimetic hydroxyapatite has been studied. By XRD, we found influence of thermal conditions on HA crystal formation and size. SEM images and Fourier transform infrared confirmed that hydroxyapatite with different morphology, crystallinity, and Ca/P ratio formed on metallic surfaces. X-ray photoelectron spectroscopy showed that in the Ti-6AL-4V sample the observed Ca/P ratio reach 0.97, whereas in the Ti-Zr-Nb sample the observed Ca/P ratio reach 1.15.

  10. Ferroelectric Pb(Zr,Ti)O{sub 3} epitaxial layers on GaAs

    SciTech Connect

    Louahadj, L.; Le Bourdais, D.; Agnus, G.; Pillard, V.; Lecoeur, P.; Largeau, L.; Mazet, L.; Bachelet, R.; Regreny, P.; Dubourdieu, C.; Gautier, B.; Saint-Girons, G.; Albertini, D.

    2013-11-18

    Ferroelectric epitaxial Pb(Zr,Ti)O{sub 3} (PZT) layers were grown by pulsed laser deposition on SrTiO{sub 3}/GaAs templates fabricated by molecular beam epitaxy. The templates present an excellent structural quality and the SrTiO{sub 3}/GaAs is abrupt at the atomic scale. The PZT layers contain a- and c-domains, as shown by X-Ray diffraction analyses. Piezoforce microscopy experiments and macroscopic electrical characterizations indicate that PZT is ferroelectric. A relative dielectric permittivity of 164 is extracted from these measurements.

  11. Improved conversion efficiency of dye sensitized solar cell using Zn doped TiO2-ZrO2 nanocomposite

    NASA Astrophysics Data System (ADS)

    Tomar, Laxmi J.; Bhatt, Piyush J.; Desai, Rahul K.; Chakrabarty, B. S.; Panchal, C. J.

    2016-05-01

    TiO2-ZrO2 and Zn doped TiO2-ZrO2 nanocomposites were prepared by hydrothermal method for dye sensitized solar cell (DSSC) application. The structural and optical properties were investigated by X -ray diffraction (XRD) and UV-Visible spectroscopy respectively. XRD results revealed the formation of material in nano size. The average crystallite size is 22.32 nm, 17.41 nm and 6.31 nm for TiO2, TiO2-ZrO2 and Zn doped TiO2-ZrO2 nanocomposites respectively. The optical bandgap varies from 2.04 eV to 3.75 eV. Dye sensitized solar cells were fabricated using the prepared material. Pomegranate juice was used as a sensitizer and graphite coated conducting glass plate was used as counter electrode. The I - V characteristics were recorded to measure photo response of DSSC. Photovoltaic parameter like open circuit voltage, power conversion efficiency, and fill factor were evaluated for fabricated solar cell. The power conversion efficiency of DSSC fabricated with TiO2, TiO2-ZrO2 and Zn doped TiO2-ZrO2 nanocomposites were found 0.71%, 1.97% and 4.58% respectively.

  12. Electrochemical Characteristics of TiN/ZrN Multilayers on the Ti-35Ta-xHf Alloy by Magnetron Sputtering

    NASA Astrophysics Data System (ADS)

    Moon, Byung-Hak; Jeong, Yong-Hoon; Eun, Sang-Won; Choe, Han-Cheol

    2013-11-01

    In this study, we investigated the electrochemical characteristics of TiN/ZrN multilayers on a Ti-35Ta-xHf alloy by radio frequency (RF) magnetron sputtering. The Ti-35Ta-xHf alloy had an α''+ β phase structure. The Ti-35Ta-15Hf alloy had a higher intensity β phase peak than Ti-35Ta-3Hf and 7Hf alloy, which contained lower Hf content. The martensite traces disappeared with increasing Hf content and the Ti-35Ta-15Hf alloy showed an entirely equiaxed structure with a β phase. The multilayer film was developed by alternately depositing TiN and ZrN layers on Ti-35Ta-15Hf substrates using the RF magnetron sputtering system to improve the interface properties between the coating and substrate. The uncoated specimen showed a passive region between 60 and 1300 mV with a current density of 0.38 µA/cm2, whereas, the TiN/ZrN multilayered specimen had a passive region between 210 and 1500 mV with a current density of 0.09 µA/cm2. The experimental results suggest that the as-sputtered layer coated well on the substrate. The TiN/ZrN multilayered film on Ti-35Ta-15Hf substrate exhibited better electrochemical resistance than that of the uncoated Ti-35Ta-15Hf substrate.

  13. Antimicrobial activity of the surface coatings on TiAlZr implant biomaterial.

    PubMed

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

    2011-12-01

    This study is devoted to antimicrobial activity of new surface coatings on TiAlZr. Ti alloys such as TiAlZr are used as implant biomaterials, but, despite the good behavior of such alloys in simulated conditions, bacterial infections appear after the introduction of an implant into the body. The infections are typically caused by the adherence and colonization of bacteria on the surfaces of the implants. The study presents preparation and surface morphology characterization of coatings obtained via anodizing, as well as biomimetic coatings with hydroxyapatite and silver ions with and without antibiotic. The percentage inhibition of Escherichia coli bacteria growth was evaluated for each of the studied coating, and a Trojan-horse model of silver nanoparticles (nAg) antibacterial activity at interface was proposed. Such coatings could be more important taking into account that antibacterial treatments with antibiotics are becoming less effective due to their intensive use.

  14. In vitro evaluation of biocompatibility of Ti-Mo-Sn-Zr superelastic alloy.

    PubMed

    Nunome, Shoko; Kanetaka, Hiroyasu; Kudo, Tada-aki; Endoh, Kazuki; Hosoda, Hideki; Igarashi, Kaoru

    2015-07-01

    Shape memory alloys (SMAs) including superelastic alloys have unique properties such as shape memory and superelasticity, thus they are recognized as very useful biomaterials. These properties are very advantageous for medical use, and actually the SMA wires have been widely used in medical field. However, biocompatibility of nickel-titanium (Ni-Ti) alloy, which is the only practical SMA at present, has been questioned because of its high nickel content. The aim of this study was to evaluate the biocompatibility of a newly developed Ni-free Ti-based SMA for medical use. The newly developed SMA made of Ti-Mo-Sn-Zr system was processed into a disk of 15.1 mm in diameter. Pure titanium of the same shape was prepared as control. All the disk surfaces were polished using emery papers, #120, #400, and #600. Scanning electron microscopy and a 3D optics profiler were used to evaluate the surface of the materials. In vitro evaluations included colony examination for evaluation of the cell cytotoxicity, DNA quantification for the cell proliferation, Alamar blue assay for metabolic activity, FDA staining for the live cell imaging, and cell cycle analysis, using Chinese hamster fibroblastic V-79 cells and mouse osteoblastic MC3T3-E1 cells. In colony examination and DNA quantification, there was no significant difference between the Ti-Mo-Sn-Zr and the pure titanium. In FDA staining, cultured cells on the Ti-Mo-Sn-Zr alloy showed the same biocompatibility as those on the pure titanium. The present results suggest that the newly developed Ti-Mo-Sn-Zr alloy showed the high biocompatibility comparable to pure titanium and can be used as efficient biomaterial for medical use.

  15. Polarization Rotation in Ferroelectric Tricolor PbTiO3/SrTiO3/PbZr0.2Ti0.8O3 Superlattices.

    PubMed

    Lemée, Nathalie; Infante, Ingrid C; Hubault, Cécile; Boulle, Alexandre; Blanc, Nils; Boudet, Nathalie; Demange, Valérie; Karkut, Michael G

    2015-09-16

    In ferroelectric thin films, controlling the orientation of the polarization is a key element to controlling their physical properties. We use laboratory and synchrotron X-ray diffraction to investigate ferroelectric bicolor PbTiO3/PbZr0.2Ti0.8O3 and tricolor PbTiO3/SrTiO3/PbZr0.2Ti0.8O3 superlattices and to study the role of the SrTiO3 layers on the domain structure. In the tricolor superlattices, we demonstrate the existence of 180° ferroelectric stripe nanodomains, induced by the depolarization field produced by the SrTiO3 layers. Each ultrathin SrTiO3 layer modifies the electrostatic boundary conditions between the ferroelectric layers compared to the corresponding bicolor structures, leading to the suppression of the a/c polydomain states. Combined with the electrostatic effect, the tensile strain induced by PbZr0.2Ti0.8O3 in the PbTiO3 layers leads to polarization rotation in the system as evidenced by grazing incidence X-ray measurements. This polarization rotation is associated with the monoclinic Mc phase as revealed by the splitting of the (HHL) and (H0L) reciprocal lattice points. This work demonstrates that the tricolor paraelectric/ferroelectric superlattices constitute a tunable system to investigate the concomitant effects of strains and depolarizing fields. Our studies provide a pathway to stabilize a monoclinic symmetry in ferroelectric layers, which is of particular interest for the enhancement of the piezoelectric properties.

  16. Surface phenomena of hydroxyapatite film on the nanopore formed Ti-29Nb-xZr alloy by anodization for bioimplants.

    PubMed

    Kim, Eun-Ju; Jeong, Yong-Hoon; Choe, Han-Cheol

    2013-03-01

    In this study, surface phenomena of hydroxyapatite (HA) film on the nanopore formed Ti-29Nb-xZr alloy by anodization for bioimplants have been investigated by electron beam physical vapor deposition (EB-PVD), field emission scanning electron microscope (FE-SEM), X-ray diffractometer (XRD), potentiostat and contact angle. The microstructure of Ti-29Nb-xZr alloys exhibited equiaxed structure and alpha" phase decreased, whereas beta phase increased as Zr content increased. The increment of Zr contents in HA coated nanotubular Ti-29Nb-xZr alloys showed good corrosion potential in 0.9% NaCI solution. The wettability of HA coated nanotubular surface was higher than that of non-coated samples.

  17. Photovoltaic properties of Zr(x)Ti(1-x)O2 solid solution nanowire arrays.

    PubMed

    Gu, Xuehui; Liu, Guohua; Zhang, Min; Zhang, Haifeng; Zhou, Jingran; Guo, Wenbin; Chen, Yu; Ruan, Shengping

    2014-05-01

    In this paper, Zr(0.05Ti(0.95)O2 solid solution nanowire arrays (NWs) were prepared by a low temperature hydrothermal method. The as-prepared NWs were characterized by scanning electron microscopy (SEM), X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS), and UV-visible (UV-vis) spectroscopy. With the doping of Zr content, the band gap of the composite can be varied in a wide range and excellent photoelectric properties of the arrays could be obtained. Moreover, a preliminary study on the photoelectric properties was conducted, which indicates potential applications of the arrays for fabricating high performance ultraviolet photodetectors.

  18. An innovative technique to simply fabricate ZrO₂-HA-TiO₂ nanostructured layers.

    PubMed

    Samanipour, F; Bayati, M R; Golestani-Fard, F; Zargar, H R; Troczynski, T; Mirhabibi, A R

    2011-08-01

    For the first time, ZrO₂-HA-TiO₂ layers were synthesized through EPD-Enhanced MAO (EEMAO) technique in only one step where no supplementary treatment was required. SEM, XRD, EDX, and XPS techniques were employed to propose a correlation between the growth parameters and the physical and chemical properties of the layers. The layers revealed a porous structure where applying higher voltages and/or utilizing higher concentrated electrolytes resulted in formation of wider pores and increasing the zirconium concentration in the layers; meanwhile, prolonging the growth time had the same effects. The layers mainly consisted of anatase, hydroxyapatite, monoclinic ZrO₂, and tetragonal ZrO₂ phases. Increasing the voltage, electrolyte concentration, and time, hydroxyapatite as well as tetragonal ZrO₂ was decomposed to α-TCP, monoclinic ZrO₂, and ZrO. The nanosized zirconia particles (d = 20-60 nm) were further accumulated on the vicinity of the layers when thicker electrolytes were utilized or higher voltages were applied. Emphasizing on the chemical and electrochemical foundations, a probable formation mechanism was finally put forward.

  19. Wear resistance of ZrC/TiN and ZrC/ZrN thin multilayers grown by pulsed laser deposition

    NASA Astrophysics Data System (ADS)

    Craciun, D.; Socol, G.; Dorcioman, G.; Niculaie, S.; Bourne, G.; Zhang, J.; Lambers, E.; Siebein, K.; Craciun, V.

    2013-03-01

    ZrC/TiN and ZrC/ZrN multilayers thinner than 350 nm were grown on (100) Si substrates at a temperature of 300 °C by the pulsed laser deposition (PLD) technique using a KrF excimer laser ( λ=248 nm, pulse duration τ=25 ns, 8.0 J/cm2 fluence and 40 Hz repetition rate). Cross-sectional transmission electron microscopy, Auger electron spectroscopy depth profiling and simulations of X-ray reflectivity curves indicated that there was intermixing between the deposited layers at the interfaces as well as between the first layer and the substrate. Nanoindentation investigations found hardness values between 35 and 38 GPa for the deposited multilayers. Linear unidirectional sliding wear tests were conducted using a ball-on-plate tribometer under 1 N normal force. Wear tracks were produced in a Hysitron nanoindenter with 1 μm radius diamond tip under a 500 μN load. High-resolution cross-sectional transmission electron microscopy studies of the wear tracks showed that the multilayers withstood these tests without significant damage. The results could be explained by the use of a high laser fluence during deposition that resulted in very dense and strongly adherent nanocrystalline layers.

  20. Hydrogen absorption and structural analysis of TiZrNiV quasicrystals.

    PubMed

    Lee, Sang-Hwa; Jo, Youngsoo; Kim, Jaeyong

    2014-12-01

    Ti-based quasicrystals are known to store a high capacity of hydrogen exceeding the density of liquid hydrogen. Because TiZrNi quasicrystals contain a large number of tetrahedral sites formed with Ti and Zr atoms that are chemically favorable to hydrogen, these materials retain strong advantages for hydrogen storage applications in structurally and chemically. In fact, TiZrNi quasicrystals are known to absorb hydrogen maximum of the hydrogen to host metal ratio (H/M) value of near 2.0. The critical disadvantage, however, is that the equilibrium vapor pressure of hydrogen is very low (less than 1 Torr). To overcome this engineering drawback, we added a small amount of vanadium (V) in Ti(53-x)Zr27Ni20V(x), alloys (where x = 0 to 15) and rapidly quenched the molten ingots to form quasicrystals, and investigated the effects of V in terms of changes of structure, the H/M values, and an equilibrium vapor pressure of hydrogen. As the results, an equilibrium vapor pressure significantly increased from 0.84 to 2.16 Torr while the maximum H/M value decreased from 1.32 to 1.11 as increasing x = 0 to 8. After hydrogenation, the main peaks shifted evenly to the lower angle of 20 in X-ray diffraction patterns with uniform expansion of the quasilattice constants which demonstrates that hydrogen atoms homogeneously diffused into the samples. A Laves phase starts to form at x = 13 and the samples completely transformed to the phase at x = 15 suggesting the similarity between the quasicrystal and the Laves phase. PMID:25971068

  1. Nanotubular oxide surface and layer formed on the Ti-35Ta-xZr alloys for biomaterials.

    PubMed

    Kim, Eun-Ju; Kim, Won-Gi; Jeong, Yong-Hoon; Choe, Han-Cheol

    2011-08-01

    Titanium and its alloys are widely used as a dental implant material in clinical dentistry and as an orthopedic implant materials due to their good mechanical properties, corrosion resistance, and biocompatibility. In this study, nanotubular oxide surface and layer formed on the Ti-35Ta-xZr alloys for biomaterials have been investigated by using electrochemical methods. Ti-35Ta-xZr alloys were prepared by arc melting and heat treated for 24 hr at 1000 degrees C in argon atmosphere, and then water quenching. Ti oxide nanotubes were formed on the Ti-35Ta-xZr alloys by anodizing in H3PO4 containing 0.8 wt% NaF solution at 25 degrees C. Anodization was carried out using a scanning potentiostat. Microstructures of the alloys and nanotube surface were examined by FE-SEM, EDX, and XRD. Crystallization treatment of nanotube surface was carried out for 3 hr at 450 degrees C. Microstructures of the Ti-35Ta-xZr alloys were changed from beta phase to alpha'' phase, and changed from an equiaxed to a needle-like structure with increasing Zr content. Nanotubular oxide surface and layers consisting of highly ordered nanotubes with a wide range of diameters (approximately 150-200 nm) and lengths (approximately 4-10 microm) can be formed on alloys in the Ti-35Ta-xZr alloys with Zr content. As the Zr content increased from 3% to 15%, length of step between the bamboo knob-like had increasing values of approximately 50 nm, 80 nm, and 140 nm, respectively. The nanotubes formed on the Ti-35Ta-xZr alloy surface were amorphous structure before heat treatment, but oxide surface had mainly an anatase structure by heat treatment.

  2. High temperature phase decomposition in Ti{sub x}Zr{sub y}Al{sub z}N

    SciTech Connect

    Lind, Hans; Pilemalm, Robert; Rogström, Lina; Tasnadi, Ferenc; Ghafoor, Naureen; Forsén, Rikard; Odén, Magnus; Johnson, Lars J. S.; Johansson-Jöesaar, Mats P.; Abrikosov, Igor A.

    2014-12-15

    Through a combination of theoretical and experimental observations we study the high temperature decomposition behavior of c-(Ti{sub x}Zr{sub y}Al{sub z}N) alloys. We show that for most concentrations the high formation energy of (ZrAl)N causes a strong tendency for spinodal decomposition between ZrN and AlN while other decompositions tendencies are suppressed. In addition we observe that entropic effects due to configurational disorder favor a formation of a stable Zr-rich (TiZr)N phase with increasing temperature. Our calculations also predict that at high temperatures a Zr rich (TiZrAl)N disordered phase should become more resistant against the spinodal decomposition despite its high and positive formation energy due to the specific topology of the free energy surface at the relevant concentrations. Our experimental observations confirm this prediction by showing strong tendency towards decomposition in a Zr-poor sample while a Zr-rich alloy shows a greatly reduced decomposition rate, which is mostly attributable to binodal decomposition processes. This result highlights the importance of considering the second derivative of the free energy, in addition to its absolute value in predicting decomposition trends of thermodynamically unstable alloys.

  3. Features of the structural state and mechanical properties of ZrN and Zr(Ti)-Si-N coatings obtained by ion-plasma deposition technique

    NASA Astrophysics Data System (ADS)

    Pogrebnyak, A. D.; Sobol', O. V.; Beresnev, V. M.; Turbin, P. V.; Dub, S. N.; Kirik, G. V.; Dmitrenko, A. E.

    2009-10-01

    The possibility of obtaining hard nanocrystalline coatings using vacuum-arc deposition in a high-frequency discharge stimulated regime has been studied. Condensates of the Zr(Ti)-Si-N system obtained by this method contain ZrN and TiN crystalline grains. These grains exhibit a compressive strain of about -1.1% in the film growth plane, which corresponds to compressive stresses up to about 3.5 GPa in the film-substrate system. The results of nanoindentation show evidence for a strong inhomogeneity of the coatings, in which regions possessing a hardness of 29-30 GPa alternate with those where the hardness exceeds 45-47 GPa. This pattern agrees with a two-phase model based on the structural data, according to which the condensed material consists of less hard ZrN grains and harder TiN grains.

  4. Understanding the Co-Poisoning Effect of Zr and Ti on the Grain Refinement of Cast Aluminum Alloys

    NASA Astrophysics Data System (ADS)

    Qiu, D.; Taylor, J. A.; Zhang, M.-X.

    2010-12-01

    The “co-poisoning” effect between Zr and Ti (derived from Al-Zr and Al-Ti-B master alloy additions) on the grain refinement of cast aluminum alloys is studied from a crystallographic atom matching viewpoint. The edge-to-edge matching (E2EM) model has been used to investigate the possible “poisoning” phase containing Zr/Ti, Al, and Fe in commercial grade aluminum alloys. The results show that Al3Ti is the most likely constituent to be poisoned due to the formation of an Al8Fe4Zr coating on its surface, since the Al8Fe4Zr phase has good crystallographic atom matching with Al3Ti, but not with the aluminum matrix. Meanwhile, the partial dissolution of Al3Zr nucleant particles to compensate for the loss of solute Zr aggravates the poisoning phenomenon. This proposed mechanism is consistent with most previous experimental observations and with existing practical solutions employed in the foundry.

  5. Effect of Zr addition on the mechanical characteristics and wear resistance of Al grain refined by Ti after extrusion

    NASA Astrophysics Data System (ADS)

    Zaid, Adnan I. O.; Al-Qawabah, S. M. A.

    2016-08-01

    Aluminum and its alloys are normally grain refined by Ti or Ti+B to transfer their columnar structure during solidification into equiaxed one which improves their mechanical behavior and surface quality. In this paper, the effect of addition of Zr on the metallurgical, and mechanical aspects, hardness, ductility and wear resistance of commercially pure aluminum grain refined by Ti after extrusion is investigated. Zr was added at a level of 0.1% which corresponds to the peretectic limit at the Al-Zr phase diagram. The experimental work was carried out on the specimens after direct extrusion. It was found that addition of Ti resulted in decrease of Al grain size, whereas addition of Zr alone or in the presence of Ti, resulted in reduction of Al grain size. This led to increase of Al hardness. The effect of the addition of Ti or Zr alone resulted almost in the same enhancement of Al mechanical characteristics. As for the strain hardening index,n, increase was obtained when Zr was added alone or in the presence of Ti. Hence pronounced improvement of its formability. Regarding the effect of Zr addition on the wear resistance of aluminum; it was found that at small loads and speeds addition of Ti or Zr or both together resulted in deterioration of its wear resistance whereas at higher loads and speeds resulted in pronounced improvement of its wear resistance. Finally, the available Archard model and the other available models which consider only the mass loss failed to describe the wear mechanism of Al and its micro-alloys because they do not consider the mushrooming effect at the worn end.

  6. Microstructures and Mechanical Properties of Transient Liquid-Phase Diffusion-Bonded Ti3Al/TiAl Joints with TiZrCuNi Interlayer

    NASA Astrophysics Data System (ADS)

    Ren, H. S.; Xiong, H. P.; Pang, S. J.; Chen, B.; Wu, X.; Cheng, Y. Y.; Chen, B. Q.

    2016-04-01

    Transient liquid-phase diffusion bonding of Ti3Al-based alloy to TiAl intermetallics was conducted using Ti-13Zr-21Cu-9Ni (wt pct) interlayer foil. The joint microstructures were examined using a scanning electron microscope (SEM) equipped with an electron probe micro-analyzer (EPMA). The microhardness across the joint was measured and joint strengths were tested. The results show that the Ti3Al/TiAl joint mainly consists of Ti-rich phase, Ti2Al layer, α 2-Ti3Al band, and residual interlayer alloy dissolved with Al. The amount of residual interlayer at the central part of the joint is decreased with the increase of the bonding temperature, and meantime the Ti2Al and α 2-Ti3Al reaction bands close to the joined Ti3Al-based alloy become thickened gradually. Furthermore, the central part of the joint exhibits the maximum microhardness across the whole joint. The joints bonded at 1193 K (920 °C) for 600 seconds with a pressure of 2 MPa presented the maximum shear strength of 417 MPa at room temperature, and the strength of 234 MPa was maintained at 773 K (500 °C).

  7. Partial amorphization of a Cu-Zr-Ti alloy by high pressure torsion

    SciTech Connect

    Revesz, Adam; Hobor, Sandor; Labar, Janos L.; Zhilyaev, Alex P.; Kovacs, Zsolt

    2006-11-15

    High pressure torsion was applied to produce disk-shape specimen of Cu{sub 60}Zr{sub 20}Ti{sub 20} composition. Radial dependence of the microstructure was monitored by x-ray diffraction, scanning, and transmission electron microscopies. The disk consists of a top surface layer, homogeneous on a micrometer scale with an average thickness of 10-20 {mu}m, and an inhomogeneous bulk region of 200 {mu}m thickness. Calorimetric studies revealed that the disk contains detectable amount of amorphous phase. Characteristics of this amorphous content were compared to a fully amorphous melt-quenched Cu{sub 60}Zr{sub 20}Ti{sub 20} ribbon.

  8. Bio-Corrosion Resistance and Biocompatibility of a ZrTi-BASED Bmgmc as Potential Hard Tissue Implants

    NASA Astrophysics Data System (ADS)

    Huang, Xiaobo; Zou, Jiaojuan; Wang, Chan; Hang, Ruiqiang; Qiao, Junwei; Tang, Bin

    2013-07-01

    In this study, we compared the bio-corrosion resistance and biocompatibility of a ZrTi-based BMGMC (Zr58.5Ti14.3Ni4.9Cu6.1Nb5.2Be11.0). The Ti-6Al-4V alloy was used as a reference material. By utilizing the electrochemical measurements and M3T3 cell culture, the corrosion resistance and biocompatibility of this BMGMC were evaluated. The BMGMC displayed high positive corrosion potentials and low corrosion current densities, which indicated that this material exhibited a highly improved corrosion resistance than the Ti alloy. The cells could adhere on the surface of this BMGMC and exhibited improved cellular behaviors, such as cellular viability and cytoskeketal structure. In summary, the ZrTi-based BMGMC showed great potential for applications in the hard tissue implants.

  9. Corrosion behaviour of TiN and ZrN in the environment containing fluoride ions.

    PubMed

    Joska, Ludek; Fojt, Jaroslav; Hradilova, Monika; Hnilica, Frantisek; Cvrcek, Ladislav

    2010-10-01

    Nowadays, a wide range of materials for human implants is used. To reach the required properties of implants, coatings are applied in some cases. This contribution is focused on the corrosion properties of TiN and ZrN layers on cp-titanium (commercially pure titanium) under environment modelling conditions in an oral cavity. Measurements were done in artificial saliva and a physiological solution unbuffered and buffered to a pH value of 4.2 with the addition of fluoride ions up to 4000 ppm. Standard corrosion electrochemical techniques were applied. Both types of layers were stable in both model saliva and physiological solution with non-adjusted pH. The decrease in pH to 4.2 resulted in a minor decrease of corrosion resistance in all cases, but polarization resistance was still in the order of 10(5) Ω cm². An important change in a specimens' behaviour was noticed in the presence of fluoride ions. TiN was stable in the highest concentration of fluorides used. The ZrN layers were destabilized in an environment containing a few hundred ppm of fluoride ions. As for TiN, the decisive factor is the influence of porosity; the corrosion resistance of ZrN is limited. From the corrosion point of view, the application of the TiN-based barrier layers in dental implantology is more advisable than the use of ZrN, provided that the application of a barrier is inevitable. PMID:20876958

  10. Structure and mechanical properties of Ni-Cu-Ti-Zr composite materials with amorphous phase

    NASA Astrophysics Data System (ADS)

    Churyumov, A. Yu.; Bazlov, A. I.; Solonin, A. N.; Zadorozhnyi, V. Yu.; Xie, G. Q.; Li, S.; Louzguine-Luzgin, D. V.

    2013-09-01

    The structure of specimens of Ni-Cu-Ti-Zr alloys with an amorphous phase has been examined by X-ray diffraction, as well as by transmission and scanning electron microscopy. Mechanical characteristics of the alloys have been determined using universal testing machines. Transformation-induced plasticity has been found to exist. The specimens demonstrate a good combination of strength and plasticity owing to both the composite effect of a heterophase structure and the dynamic martensitic transformation that develops during deformation.

  11. High temperature x-ray and calorimetric studies of phase transformations in quasicrystalline Ti{endash}Zr{endash}Ni alloys

    SciTech Connect

    Stroud, R.M.; Kelton, K.F.; Misture, S.T.

    1997-02-01

    We present the first high temperature x-ray diffraction (HTXRD) studies of {ital in situ} quasicrystal-crystal and crystal-crystal transformations in Ti{endash}Zr{endash}Ni alloys. Together with differential scanning calorimetry studies, these x-ray measurements indicate three separate paths for the Ti{endash}Zr{endash}Ni quasicrystal-crystal transformation: single exothermic, single endothermic, or multiple endothermic. The mode of transformation depends on the alloy composition and the level of environmental oxygen. The crystalline products include the Ti{sub 2}Ni, MgZn{sub 2} Laves, {alpha}{endash}(Ti,Zr) and {beta}{endash}(Ti,Zr) phases. In the absence of oxygen, the endothermic transformation of the quasicrystal demonstrates that it is the lowest free energy (stable) phase at the Ti{sub 53}Zr{sub 27}Ni{sub 20} composition. Oxygen stabilizes the Ti{sub 2}Ni phase, eliminating both the quasicrystal and the MgZn{sub 2} Laves phase, at partial pressures as low as a few hundred ppm. {copyright} {ital 1997 Materials Research Society.}

  12. Speculation of equilibrium pressure of Ti36Zr40Ni20Pd4 icosahedral quasicrystal

    NASA Astrophysics Data System (ADS)

    Huang, Huogen; Chen, Liang

    2015-08-01

    Ti-Zr-Ni quasicrystals have been demonstrated to store a large number of hydrogen atoms, which implies strong potential application in hydrogen energy field for them. However, the desorption of hydrogen atoms in the quasicrystals is quite difficult, with the indication of high desorption temperature and slow desorption rate. The shortage limits their use in the field to a large extent. But this kind of quasicrystals might be used in nuclear fusion energy field, because tritium as a coral fuel for nuclear fusion needs tight storage. However, equilibrium pressure at room temperature of Ti-Zr-Ni quasicrystals, important for their application in fusion energy field, has not been clear yet. In this work, we designed a gas-solid reaction system with the pressure resolution of 10-8Pa and carried out hydrogen desorption investigation at different temperatures on Ti36Zr40Ni20Pd4 icosahedral quasicrystal. Based on three Pressure-Composition-Temperature desorption curves, we speculate according to Van't Hoff theory about hydrogen storage that its equilibrium pressure at room temperature could be at the magnitude of 10-6Pa, displaying good stability of hydrogen in the quasicrystal and also implying application prospects in fusion energy field for quasicrystals of this type.

  13. First-principles calculations of single-walled nanotubes in sulfides MS2 (M = Ti, Zr)

    NASA Astrophysics Data System (ADS)

    Evarestov, Robert A.; Bandura, Andrei V.

    2014-04-01

    Hybrid density functional theory has been applied for investigations of the electronic and atomic structure of nanotubes based on titanium and zirconium disulfides. The full optimization of all atomic positions in the considered systems has been performed to study the atomic relaxation and to determine the most favorable nanostructures. Our calculations on single-wall TiS2 and ZrS2 nanotubes confirmed that the nanotubes obtained by rolling of the hexagonal layers of 1T crystalline polymorphs with the octahedral morphology (and with the layer group P\\overline 3 m1) are the most stable. However, it is also possible to obtain the relatively stable nanotubes with lepidocrocite morphology by rolling up layers of the metastable tetragonal or orthorhombic phases. The strain energy of TiS2 is almost the same as that of ZrS2 but it is greater than the strain energy of TiO2 and ZrO2 nanotubes. However, the formation energy of the sulfide nanotubes is considerably less than the formation energy of the oxide nanotubes.

  14. 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

  15. 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.

  16. Pressure induced structural transformation in Gd2Ti2O7 and Gd2Zr2O7

    NASA Astrophysics Data System (ADS)

    Xiao, H. Y.; Weber, W. J.

    2011-01-01

    Ab initio total energy calculations have been performed to study the phase stability of Gd2Ti2O7 and Gd2Zr2O7 pyrochlores over the pressure range from 0 to 60 GPa. Both compounds are unstable under pressure, and phase transformations to the defect-cotunnite structure are predicted. The phase transformation pressure of 43.6 GPa for Gd2Ti2O7 is considerably larger than the value of 13 GPa for Gd2Zr2O7, in good agreement with experiments. The decreased structural stability of Gd2Zr2O7 under pressure, relative to Gd2Ti2O7, is a consequence of the lower compressibility of the langZr-Orang bond and the higher compressibility of the langGd-Orang bond. In addition, the Gd 4f electrons are found to have only a small effect in determining the pressure induced phase transformation.

  17. 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.

  18. Preparation and wear resistance of Ti-Zr-Ni quasicrystal and polyamide composite materials

    NASA Astrophysics Data System (ADS)

    Wang, Xinlu; Li, Xuesong; Zhang, Zhenjiang; Zhang, Shanshan; Liu, Wanqiang; Wang, Limin

    2011-07-01

    Ti-Zr-Ni icosahedral quasicrystal powders (Ti-QC), prepared by mechanical alloying and then annealing in a vacuum furnace, were used as a novel filler material in polyamide 12 (PA12). The melt processability of the composite was studied using a Haake torque rheometer. This indicates that PA12/Ti-QC composites can be melt-processed into a wear-resistant material. Further, these composites, fabricated by compression molding, were tested in sliding wear against a polished bearing steel counterface. The results from wear testing show that the addition of Ti-QC filler to PA12 enhances wear resistance and reduces volume loss by half compared with neat PA12. Furthermore, it is found that the hardness of the composite increases with increasing content of Ti-QC filler. In addition, PA12/Ti-QC composites exhibit a slightly higher crystallization temperature and better thermal stability than PA12. These combined results demonstrate that Ti-QC filler may be a desirable alternative when attempting to increase the wear resistance of PA12.

  19. Facile synthesis and enhanced visible light photocatalytic activity of N and Zr co-doped TiO2 nanostructures from nanotubular titanic acid precursors.

    PubMed

    Zhang, Min; Yu, Xinluan; Lu, Dandan; Yang, Jianjun

    2013-01-01

    Zr/N co-doped TiO2 nanostructures were successfully synthesized using nanotubular titanic acid (NTA) as precursors by a facile wet chemical route and subsequent calcination. These Zr/N-doped TiO2 nanostructures made by NTA precursors show significantly enhanced visible light absorption and much higher photocatalytic performance than the Zr/N-doped P25 TiO2 nanoparticles. Impacts of Zr/N co-doping on the morphologies, optical properties, and photocatalytic activities of the NTA precursor-based TiO2 were thoroughly investigated. The origin of the enhanced visible light photocatalytic activity is discussed in detail.

  20. Facile synthesis and enhanced visible light photocatalytic activity of N and Zr co-doped TiO2 nanostructures from nanotubular titanic acid precursors

    NASA Astrophysics Data System (ADS)

    Zhang, Min; Yu, Xinluan; Lu, Dandan; Yang, Jianjun

    2013-12-01

    Zr/N co-doped TiO2 nanostructures were successfully synthesized using nanotubular titanic acid (NTA) as precursors by a facile wet chemical route and subsequent calcination. These Zr/N-doped TiO2 nanostructures made by NTA precursors show significantly enhanced visible light absorption and much higher photocatalytic performance than the Zr/N-doped P25 TiO2 nanoparticles. Impacts of Zr/N co-doping on the morphologies, optical properties, and photocatalytic activities of the NTA precursor-based TiO2 were thoroughly investigated. The origin of the enhanced visible light photocatalytic activity is discussed in detail.

  1. Study of the surface wear resistance and biological properties of the Ti-Zr-Nb-Sn alloy for dental restoration.

    PubMed

    Hu, Xin; Wei, Qiang; Li, Chang-Yi; Deng, Jia-Yin; Liu, Shuang; Zhang, Lian-Yun

    2010-10-01

    A new titanium alloy (Ti-12.5Zr-3Nb-2.5Sn) was developed to meet the needs of clinical requirements for medical titanium alloys and improve the properties of existing titanium alloys. The as-prepared alloy was solution treated at 500 °C for 3 h in vacuum followed by water quenching. Tensile, wear and hardness tests were carried out to examine the mechanical properties of the Ti-Zr-Nb-Sn alloy. Oral mucous membrane irritation test was performed to evaluate the surface biological properties of the Ti-Zr-Nb-Sn alloy. The results suggested that the surface hardness and wear-resistant properties of the Ti-12.5Zr-3Nb-2.5Sn alloy were superior to commercially pure Ti. The oral mucous irritation test showed that all samples had no mucous membrane irritation. It indicates that Ti-12.5Zr-3Nb-2.5Sn has large potential to be used as dental restoration material.

  2. Electronic and mechanical properties of Zr{sub 2}TiAl: A first principles study

    SciTech Connect

    Reddy, P. V. Sreenivasa Kanchana, V.

    2014-04-24

    First principles study of electronic and mechanical properties of ternary phase Zr{sub 2}TiAl intermetallic compound has been carried out by using full potential linear augmented plane wave (FP-LAPW) method. Our calculated lattice parameter is in good agreement with the experiment. We find the magnetic phase of the compound to be stable with a magnetic moment of 1.95 μ{sub B}. The major contribution to the total magnetic moment arises mainly from the Ti atom with the local magnetic moment of 1.22 μ{sub B}. From the density of states plots we find the Ti-d and Zr-d to dominate at the Fermi level (E{sub F}) with enhanced crystal field splitting and exchange splitting found in Ti. The mechanical stability of the compound is confirmed from the calculated elastic constants, and we find the compound to be ductile in nature from the calculated Pugh’s ratio and Cauchy’s pressure.

  3. Nanostructured Zr- and Ti-based composite materials with high strength and enhanced plasticity

    SciTech Connect

    Kuehn, U.; Mattern, N.; Gebert, A.; Kusy, M.; Bostroem, M.; Siegel, U.; Schultz, L.

    2005-09-01

    Multicomponent composite materials with the compositions Zr{sub 66}Nb{sub 13}Cu{sub 8}Ni{sub 6.8}Al{sub 6.2} and Ti{sub 66}Nb{sub 13}Cu{sub 8}Ni{sub 6.8}Al{sub 6.2} were produced by copper mold casting, and their microstructure and their room-temperature mechanical properties were investigated. The specific alloys were developed to circumvent the limited ductility of Zr- and Ti-based bulk metallic glasses by the formation of a heterogeneous microstructure consisting of a nanocrystalline matrix and ductile dendritic bcc precipitates. Comparing the microstructure of both alloys, two significant differences were observed. The volume fraction of the dendritic bcc phase is higher for the Ti-based alloy and the formed interdendritic matrix phase(s) have a different structure. The two alloys show an excellent combination of strength and plastic strain. Especially the Ti-based alloy exhibits exceptional mechanical properties, such as high fracture stress of more than 2000 MPa and a plastic elongation to failure of almost 30%.

  4. Effect of V or Zr addition on the mechanical properties of the mechanically alloyed Al-8wt%Ti alloys

    SciTech Connect

    Moon, I.H.; Lee, J.H.; Lee, K.M. . Dept. of Materials Engineering); Kim, Y.D. . Div. of Metals)

    1995-01-01

    Mechanical alloying (MA) of Al-Ti alloy, being a solid state process, offers the unique advantage of producing homogeneous and fine dispersions of thermally stable Al[sub 3]Ti phase, where the formation of the fine Al[sub 3]Ti phase by the other method is restricted from the thermodynamic viewpoint. The MA Al-Ti alloys show substantially higher strength than the conventional Al alloys at the elevated temperature due to the presence of Al[sub 3]Ti as well as Al[sub 4]C[sub 3] and Al[sub 2]O[sub 3], of which the last two phases were introduced during MA process. The addition of V or Zr to Al-Ti alloy was known to decrease the lattice mismatch between the intermetallic compound and the aluminum matrix, and such decrease in lattice mismatching can influence positively the high temperature mechanical strength of the MA Al-Ti by increasing the resistance to dispersoid coarsening at the elevated temperature. In the present study, therefore, the mechanical behavior of the MA Al-Ti-V and Al-Ti-Zr alloys were investigated in order to evaluate the effect of V or Zr addition on the mechanical properties of the MA Al-8Ti alloy at high temperature.

  5. Porous Zr(x)Si(1-x)O₂ shell/void/TiO₂ core particles with enhancing transfer for cleaning water.

    PubMed

    Zhang, Yuqing; Zhang, Yunge

    2015-06-15

    In order to immobilize TiO2 and prevent TiO2 nanoparticles from damaging polymeric supporters, the porous Zr(x)Si(1-x)O2 shell/void/TiO2 core particles (Zr-SVTs) were fabricated by the synergistic effect between nonionic surfactant P123 ((EO)20(PO)70(EO)20) and oleic acid (CH3(CH2)7CH=CH(CH2)7COOH) and cohydrolysis between TEOS and ZrOCl2·8H2O. Zr-SVTs were characterized by FT-IR, SEM, TEM, EDX and BET. The results show Zr-SVTs exhibit well-developed spherical shape with channels (approximately 5.5 nm in diameter) in porous Zr(x)Si(1-x)O2 shells. Moreover, the preparation conditions of Zr-SVTs were studied and confirmed, and the photocatalytic activity of Zr-SVTs was studied by photodegrading methyl orange in aqueous solution and oil in sewage containing oil. Alternatively, the photocatalytic activity of Zr-SVTs presents better result compared with SiO2 shell/void/TiO2 core (SVT) without doping Zr into the SiO2 shell, which further demonstrates that the Zr(x)Si(1-x)O2 shell could promote the mass transfer inside channels of Zr-SVTs. It suggests that Zr-SVTs with higher photocatalytic activity are desirable for application in water cleaning. PMID:25780933

  6. 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. PMID:26773649

  7. 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.

  8. An investigation of Zr doping in NaBiTi2O6 perovskite by direct hydrothermal synthesis.

    PubMed

    Harunsani, Mohammad H; Woodward, David I; Thomas, Pam A; Walton, Richard I

    2015-06-21

    The direct crystallisation of perovskites NaBi(Ti(1-x)Zrx)(2)O(6) with x = 0, 0.01, 0.05 and 0.1 at 240 °C is achieved from aqueous alkali (NaOH) solutions of NaBiO(3), TiF(3) and ZrOCl(2). For each material, a single rhombohedral polymorph (R3c a∼ 5.51 Å, c∼ 13.50 Å) can be fitted to powder X-ray diffraction data, with Rietveld refinement showing a linear increase in lattice parameters and unit cell volume with increasing Zr content. Scanning electron microscopy shows micron-sized cube-shaped crystallites for each sample, with energy-dispersive X-ray analysis giving Bi : Ti : Zr ratios consistent with the expected substitution. Raman spectroscopy shows no perturbance of local structure upon Zr doping and the spectrum shows five broad bands, consistent with the literature on similar materials. Attempts to increase the Zr content further (x > 0.1) were unsuccessful by this hydrothermal synthesis method, leading instead to crystalline ZrO(2) by-products. For NaBiTi(2)O(6) and NaBi(Ti(0.99)Zr(0.01))(2)O(6) densified ceramics were prepared (∼95% density of crystallographic value) and their remnant polarisation was found to be reduced upon Zr substitution, along with a higher maximum piezoelectric coefficient, d33, measured and comparable permittivity and dielectric loss to other reported NaBiTi(2)O(6) materials. PMID:25677453

  9. Studies of phase transition and impedance behavior of Ba(Zr, Ti)O3 ceramics

    NASA Astrophysics Data System (ADS)

    Sateesh, P.; Omprakash, J.; Kumar, G. S.; Prasad, G.

    2015-02-01

    Ceramic samples of Barium Zirconium Titanate (BaZrxTi1-xO3 (BZT)) were synthesized by conventional solid-state reaction method with different concentrations of x(= 0.05 (BZT1), 0.10 (BZT2), 0.15 (BZT3), 0.20 (BZT4), 0.25 (BZT5), 0.30 (BZT6)). Phase confirmation of the samples was done by X-ray diffraction (XRD) technique. All the compositions are in cubic structure. XRD pattern was recorded for samples sintered at different sintering temperatures. Lattice parameters increased with addition of Zr+4. Doping with Zr+4 into Barium titanate resulted in interesting changes of electrical properties (dielectric, impedance and ferroelectiricity). The strong influence of Zr doping on the phase transition characteristics of the BZT ceramics was studied from the dielectric response of the samples. Diffusivity of phase transition of the BZT ceramic samples increase with Zr+4 concentration, indicating changes from normal to diffuse transition to relaxor phase transition behavior. Impedance spectroscopy reveals the presence of temperature-dependent grain, grain boundary effects. Polarization-Electricfield (PE) loop measurements are also done on the samples.

  10. Single layer of MX₃ (M = Ti, Zr; X = S, Se, Te): a new platform for nano-electronics and optics.

    PubMed

    Jin, Yingdi; Li, Xingxing; Yang, Jinlong

    2015-07-28

    A serial of two-dimensional titanium and zirconium trichalcogenides nanosheets MX3 (M = Ti, Zr; X = S, Se, Te) were investigated based on first-principles calculations. The evaluated low cleavage energy indicates that stable two-dimensional monolayers can be exfoliated from their bulk crystals in the experiment. Electronic studies reveal the very rich electronic properties in these monolayers, including metallic TiTe3 and ZrTe3, direct band gap semiconductor, TiS3, and indirect band gap semiconductors, TiSe3, ZrS3 and ZrSe3. The band gaps of all the semiconductors are between 0.57 and 1.90 eV, which implies their potential applications in nano-electronics. In addition, the calculated effective masses demonstrate the highly anisotropic conduction properties for all the semiconductors. Optically, TiS3 and TiSe3 monolayers exhibit good light absorption in the visible and near-infrared region, respectively, indicating their potential applications in optical devices. In particular, the highly anisotropic optical absorption of the TiS3 monolayer suggests it could be used in designing nano-optical waveguide polarizers.

  11. Growth and surface characterization of TiNbZr thin films deposited by magnetron sputtering for biomedical applications.

    PubMed

    Tallarico, D A; Gobbi, A L; Paulin Filho, P I; Maia da Costa, M E H; Nascente, P A P

    2014-10-01

    Low modulus of elasticity and the presence of non-toxic elements are important criteria for the development of materials for implant applications. Low modulus Ti alloys can be developed by designing β-Ti alloys containing non-toxic alloying elements such as Nb and Zr. Actually, most of the metallic implants are produced with stainless steel (SS) because it has adequate bulk properties to be used as biomaterials for orthopedic or dental implants and is less expensive than Ti and its alloys, but it is less biocompatible than them. The coating of this SS implants with Ti alloy thin films may be one alternative to improve the biomaterial properties at a relatively low cost. Sputtering is a physical deposition technique that allows the formation of nanostructured thin films. Nanostructured surfaces are interesting when it comes to the bone/implant interface due to the fact that both the surface and the bone have nanoscale particle sizes and similar mechanical properties. TiNbZr thin films were deposited on both Si(111) and stainless steel (SS) substrates. The TiNbZr/Si(111) film was used as a model system, while the TiNbZr/SS film might improve the biocompatibility and extend the life time of stainless steel implants. The morphology, chemical composition, Young's modulus, and hardness of the films were analyzed by atomic force microscopy (AFM), X-ray photoelectron spectroscopy (XPS), energy-dispersive X-ray spectroscopy (EDS), and nanoindentation.

  12. Cytocompatibility and early osseointegration of nanoTiO2-modified Ti-24 Nb-4 Zr-7.9 Sn surfaces.

    PubMed

    Liu, X H; Wu, L; Ai, H J; Han, Y; Hu, Y

    2015-03-01

    This study aimed to evaluate the cytocompatibility and early osseointegration of Ti-24 Nb-4 Zr-7.9 Sn (Ti-2448) surfaces that were modified with a nanoscale TiO2 coating. The coating was fabricated using a hydrothermal synthesis method to generate nanoTiO2/Ti-2448. The surface characteristics of the samples were evaluated using scanning electron microscopy (SEM), energy dispersive spectrometry (EDS) and X-ray diffraction (XRD). The cytotoxicity of the fabricated nanoTiO2/Ti-2448 was determined using MTT assays. The proliferation and alkaline phosphatase (ALP) activity of MC3T3-E1 osteoblasts cultured on nanoTiO2/Ti-2448 were compared with those cultured on Ti-2448. Disk-shaped implants were placed in Wistar rats. The histological sections were stained with haematoxylin and eosin (HE), and the histocompatibility was analysed at 4 and 12weeks post-implantation. Cylindrical implants were embedded in Japanese white rabbits, and the histological sections were stained with HE and anti-TGF-β1 to evaluate the histocompatibility and early osseointegration at 4, 12 and 26weeks post-implantation. NanoTiO2/Ti-2448 exhibited a rougher surface than did Ti-2448. NanoTiO2/Ti-2448 was determined to be non-cytotoxic. More osteoblasts and higher ALP activity were observed for nanoTiO2/Ti-2448 than Ti-2448 (p<0.05). Few inflammatory cells were detected around nanoTiO2/Ti-2448, and the expression of TGF-β1 on nanoTiO2/Ti-2448 peaked at earlier time than that on Ti-2448. The results indicate that the cytocompatibility and early osseointegration were enhanced by the nanoTiO2 coating. PMID:25579921

  13. Nanostructured microtubes based on TiO2 doped by Zr and Hf oxides with the anatase structure

    NASA Astrophysics Data System (ADS)

    Zheleznov, VV; Voit, EI; Sushkov, YV; Sarin, SA; Kuryavyi, VG; Opra, DP; Gnedenkov, SV; Sinebryukhov, SL; Sokolov, AA

    2016-01-01

    The nanostructured microtubes based on TiO2 have been prepared on the carbon fiber template using the sol-gel method. The microtubes consist of nanoparticles of metal oxides: TiO2/ZrO2 and TiO2/HfO2. The dependence of microtubes morphology and nanoparticles structure on the synthesis conditions has been studied using the methods of SEM, SAXS, and Raman spectroscopy. It has been demonstrated that at the stoichiometric ratio of up to 0.04 for Zr/Ti and up to 0.06 for Hf/Ti microtubes consist of uniform nanoparticles with the anatase structure. Along with further increase of the dopants content in the microtubes composition, nanoparticles acquire the core-shell structure. It has been suggested that nanoparticles have a core composed of the solid solutions Ti1-xZrxO2 or Ti1-xHfxO2 and a shell consisting of zirconium or hafnium titanate. The fabricated Zr- and Hf-doped TiO2 materials were investigated in view of their possible use as anode materials for Li-ion batteries. Charge- discharge measurements showed that the doped samples manifested significantly higher reversibility in comparison with the undoped TiO2. The method opens new prospects in synthesis of nanostructured materials for Li-ion batteries application.

  14. 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.

  15. Preparation and Characterization of BaTiO3-PbZrTiO3 Coating for Pyroelectric Energy Harvesting

    NASA Astrophysics Data System (ADS)

    Raghavendra, R. M.; Praneeth, K. P. S. S.; Dutta, Soma

    2016-08-01

    Harvesting energy from waste heat is a promising field of research as there are significant energy recovery opportunities from various waste thermal energy sources. The present study reports pyroelectric energy harvesting using thick film prepared from a (x)BaTiO3-(1 - x)PbZr0.52Ti0.48O3 (BT-PZT) solid solution. The developed BT-PZT system is engineered to tune the ferro to paraelectric phase transition temperature of it in-between the phase transition temperature of BaTiO3 (393 K) and PbZrTiO3 (573 K) with higher pyroelectric figure-of-merit (FOM). The temperature-dependent dielectric behavior of the material has revealed the ferro- to paraelectric phase transition at 427 K with a maximum dielectric constant of 755. The room-temperature (298 K) pyroelectric coefficient (Pi) of the material was obtained as 738.63 μC/m2K which has yielded a significantly high FOM of 1745.8 J m-3 K-2. The enhancement in pyroelectric property is attributed to the morphotopic phase transition between tetragonal and rhombohedral PZT phases in the BT-PZT system. The developed BT-PZT system is capable of generating a power output of 1.3 mW/m2 near the Curie temperature with a constant rate (0.11 K/s) of heating. A signal conditioning circuit has been developed to rectify the time-varying current and voltage signals obtained from the harvester during heating cycles. The output voltage generated by the pyroelectric harvester has been stored in a capacitor for powering wearable electronics.

  16. Metallic glass alloys of Zr, Ti, Cu and Ni

    DOEpatents

    Lin, Xianghong; Peker, Atakan; Johnson, William L.

    1997-01-01

    At least quaternary alloys form metallic glass upon cooling below the glass transition temperature at a rate less than 10.sup.3 K/s. Such alloys comprise titanium from 19 to 41 atomic percent, an early transition metal (ETM) from 4 to 21 atomic percent and copper plus a late transition metal (LTM) from 49 to 64 atomic percent. The ETM comprises zirconium and/or hafnium. The LTM comprises cobalt and/or nickel. The composition is further constrained such that the product of the copper plus LTM times the atomic proportion of LTM relative to the copper is from 2 to 14. The atomic percentage of ETM is less than 10 when the atomic percentage of titanium is as high as 41, and may be as large as 21 when the atomic percentage of titanium is as low as 24. Furthermore, when the total of copper and LTM are low, the amount of LTM present must be further limited. Another group of glass forming alloys has the formula (ETM.sub.1-x Ti.sub.x).sub.a Cu.sub.b (Ni.sub.1-y Co.sub.y).sub.c wherein x is from 0.1 to 0.3, y.cndot.c is from 0 to 18, a is from 47 to 67, b is from 8 to 42, and c is from 4 to 37. This definition of the alloys has additional constraints on the range of copper content, b.

  17. Characterization of the Ti-10Nb-10Zr-5Ta Alloy for Biomedical Applications. Part 2: Wettability, Tribological Performance and Biocompatibility

    NASA Astrophysics Data System (ADS)

    Braic, V.; Balaceanu, M.; Braic, M.; Vitelaru, C.; Titorencu, I.; Pruna, V.; Parau, A. C.; Fanara, C.; Vladescu, A.

    2014-01-01

    The Ti-10Nb-10Zr-5Ta alloy, prepared in a levitation melting furnace, was investigated as a possible candidate for replacing Ti6Al4V alloy in medical applications. The sessile drop method, pin-on-disc and in vitro tests were used to analyze wettability, wear resistance, and biocompatibility of the new alloy. The characteristics of the Ti-10Nb-10Zr-5Ta alloy were assessed in comparison to those of the Ti6Al4V alloy. The Ti-10Nb-10Zr-5Ta system was found to have hydrophilic characteristics with similar contact angle as the Ti6Al4V alloy. In all environments (deionized water, simulated body fluid and Fusayama Meyer artificial saliva), the friction coefficient showed a stable evolution versus sliding distance, being similar for both alloys. On overall, the wear resistance of Ti-10Nb-10Zr-5Ta alloy was lower than that of Ti6Al4V for all testing environments. The Ti-10Nb-10Zr-5Ta alloy exhibited good biocompatibility characteristics at in vitro test compared to Ti6Al4V alloy. The cell viability on Ti-10Nb-10Zr-5Ta surfaces was higher than the one observed on Ti6Al4V samples, regardless the number of days spent in osteoblast-like cells culture. A high degree of cell attachment and spreading was observed on both alloys.

  18. Fatigue behaviour of boron free and boron containing heat treated Ti-13Zr-13Nb alloy for biomedical applications

    SciTech Connect

    Majumdar, P. Singh, S.B.; Chakraborty, M.

    2010-12-15

    Fatigue behaviour of heat treated Ti-13Zr-13Nb (TZN) and Ti-13Zr-13Nb-0.5B (TZNB) alloys for biomedical implants has been investigated by rotating bending test. It was found that fatigue strength of TZN and TZNB alloys is comparable with that of conventionally used biomedical titanium alloys. Addition of boron to TZN alloy deteriorates fatigue strength. - Research Highlights: {yields}The microstructure of the aged TZN consists of {alpha} phase in {beta} matrix. {yields}Addition of boron to TZN leads to the formation of dispersed acicular TiB. {yields}Presence of TiB deteriorates the fatigue strength of TZN alloy. {yields}Fatigue strength of aged TZN/TZNB alloys is comparable with biomedical Ti-alloys.

  19. Shift of morphotropic phase boundary in high-performance [111]-oriented epitaxial Pb (Zr, Ti) O3 thin films

    NASA Astrophysics Data System (ADS)

    Yu, Qi; Li, Jing-Feng; Zhu, Zhi-Xiang; Xu, Ying; Wang, Qing-Ming

    2012-07-01

    High-performance epitaxial niobium-doped lead zirconate titanate thin films [Pb(ZrxTi1-x)0.98Nb0.02O3] with a fixed thickness were deposited on [111]-cut single-crystalline SrTiO3 substrates by a sol-gel process as a function of Zr/Ti ratio ranging from 20/80 to 80/20. An obvious shift of morphotropic phase boundary (MPB) was observed in the [111]-oriented epitaxial films. Deviating from the Zr/Ti ratio of 52/48 in bulk materials, the MPB composition in the as-deposited films was found to move to a lower Zr/Ti ratio between 30/70 and 40/60, which agrees with the theoretical analysis on the basis of lattice mismatch between films and substrates and is further confirmed by the XRD patterns and Raman spectrum as well as ferroelectric test. Furthermore, a superior remnant polarization (Pr) value among all the compositions was obtained at a Zr/Ti ratio of 30/70, indicating that the extrinsic ferroelectric polarization near the new morphotropic phase boundary will lead to outstanding dielectric and piezoelectric performance in the epitaxial PZT thin film system.

  20. Metallic glass alloys of Zr, Ti, Cu and Ni

    DOEpatents

    Lin, X.; Peker, A.; Johnson, W.L.

    1997-04-08

    At least quaternary alloys form metallic glass upon cooling below the glass transition temperature at a rate less than 10{sup 3} K/s. Such alloys comprise titanium from 19 to 41 atomic percent, an early transition metal (ETM) from 4 to 21 atomic percent and copper plus a late transition metal (LTM) from 49 to 64 atomic percent. The ETM comprises zirconium and/or hafnium. The LTM comprises cobalt and/or nickel. The composition is further constrained such that the product of the copper plus LTM times the atomic proportion of LTM relative to the copper is from 2 to 14. The atomic percentage of ETM is less than 10 when the atomic percentage of titanium is as high as 41, and may be as large as 21 when the atomic percentage of titanium is as low as 24. Furthermore, when the total of copper and LTM are low, the amount of LTM present must be further limited. Another group of glass forming alloys has the formula (ETM{sub 1{minus}x}Ti{sub x}){sub a} Cu{sub b} (Ni{sub 1{minus}y}Co{sub y}){sub c} wherein x is from 0.1 to 0.3, y{center_dot}c is from 0 to 18, a is from 47 to 67, b is from 8 to 42, and c is from 4 to 37. This definition of the alloys has additional constraints on the range of copper content, b. 2 figs.

  1. 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

  2. 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. PMID:27504072

  3. 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.

  4. The first principle study of magnetic properties of Mn2WSn, Fe2YSn (Y=Ti, V), Co2YSn (Y=Ti, Zr, Hf, V, Mn) and Ni2YSn (Y=Ti, Zr, Hf, V, Mn) heusler alloys

    NASA Astrophysics Data System (ADS)

    Rauf, Sana; Arif, Suneela; Haneef, Muhammad; Amin, Bin

    2015-01-01

    The spin polarized electronic band structures, density of states (DOS) and magnetic properties of Mn2WSn, Fe2YSn (Y=Ti, V), Co2YSn (Y=Ti, Zr, Hf, V, Mn) and Ni2YSn (Y=Ti, Zr, Hf, V, Mn) huesler compounds are reported. The calculations are performed by using full-potential linearized augmented plane wave method (FP-LAPW) within density functional theory. The magnetic trend in these compounds is studied using values of magnetic moments, exchange interaction and calculated band gap. The results reveal that Mn2WSn and Ni2VSn show 100% spin polarization, Co2YSn (Y=Ti, Zr, Hf, Mn), Fe2YSn (Y=Ti, V), and Ni2MnSn exhibit metallic nature and Ni2YSn (Y=Ti, Zr, Hf) and Co2VSn show semi-conducting behavior.

  5. Surface Tension and Viscosity of Quasicrystal-Forming Ti-Zr-Ni Alloys

    NASA Technical Reports Server (NTRS)

    Hyers, R. W.; Bradshaw, R. C.; Rogers, J. R.; Rathz, T. J.; Lee, G. W.; Kelton, K. F.; Gangopadhyay, A. K.

    2003-01-01

    The surface tension and viscosity of quasicrystal-forming Ti-Zr-Ni alloys were measured over a range of temperature, including both stable and undercooled liquids by an Electrostatic Levitation (ESL) technique. ESL is a containerless technique which allows processing of samples without contact, greatly reducing contamination and increasing access to the metastable undercooled liquid. The measured viscosity is typical of glass-forming alloys of similar composition to the quasicrystal-forming alloys studied here, while the surface tension shows an anomaly at deep undercoolings.

  6. Color of TiN and ZrN from first-principles calculations

    NASA Astrophysics Data System (ADS)

    Kim, Jinwoong; Jhi, Seung-Hoon; Ryeol Lee, Kwang

    2011-10-01

    The optical properties, especially the colors, of transition metal nitrides (TiN and ZrN) are studied using first-principles method. Full ab-initio procedure of color-prediction including plasma frequency is presented. The dielectric functions and reflectivity of the compounds are calculated including both intraband and interband transitions. The color of the compounds is then produced by calculating the red-green-blue color codes through the convolution of color matching functions and the calculated reflectivity. Calculated colors and screened plasma frequency for the materials are in good agreement with measurement. The color variation due to chemical doping is also studied within the rigid band approximation.

  7. Electron dominated thermoelectric response in MNiSn (M: Ti, Zr, Hf) half-Heusler alloys.

    PubMed

    Gandi, Appala Naidu; Schwingenschlögl, Udo

    2016-05-18

    We solve the transport equations of the electrons and phonons to understand the thermoelectric behaviour of the technologically important half-Heusler alloys MNiSn (M: Ti, Zr, Hf). Doping is simulated within the rigid band approximation. We clarify the origin of the electron dominated thermoelectric response and determine the carrier concentrations with maximal figures of merit. The phonon mean free path is studied to calculate the grain size below which grain refinement methods can enforce ballistic heat conduction to enhance the figure of merit.

  8. Magnetization Reversal Processes, in the Nanocrystalline Fe-Co-Zr-Ti-Pr-B Magnets

    NASA Astrophysics Data System (ADS)

    Pawlik, K.; Pawlik, P.; Wysłocki, J. J.; Kaszuwara, W.

    2008-01-01

    Magnetization reversal processes in the magnets derived from the Fe60Co13Zr1Ti3Pr9B14 alloy were investigated. It was shown that the processing technique affects the magnetization reversal processes. For the nanocrystalline ribbon samples pinning of the domain walls arises at low external magnetic fields while nucleation of reversed domains occurs at higher fields. However, the nucleation fields are lower than the pinning fields for the nanocrystalline rod and tube samples produced by suction-casting technique.

  9. X-Ray and Electrostatic Levitation Undercooling Studies in Ti-Zr-Ni Quasicrystals Forming Alloys

    NASA Technical Reports Server (NTRS)

    Rogers, J. R.; Hyers, R. W.; Rathz, T. J.; Kelton, K. F.; Gangopadhyay, A. K.; Woo, G. L.; Hannet, L.; Krishnan, S.; Curreri, Peter A. (Technical Monitor)

    2002-01-01

    The first undercooling nucleation measurements of electrostatic-levitated droplets of TiZrNi alloys that form the icosahedral quasicrystal phase (i-phase) are presented. The reduced undercooling for crystallization decreases with an increasing polytetrahedral order of the primary solidifying phase, supporting the existence of a developing icosahedral short-range order in the undercooled liquid. X-ray diffraction measurements made at the Advance Photon Source on levitated liquid droplets of these alloys at their liquidus temperatures, however, show no evidence for increased icosahedral order. This suggests that significant ordering only occurs below the melting temperature.

  10. Electron dominated thermoelectric response in MNiSn (M: Ti, Zr, Hf) half-Heusler alloys.

    PubMed

    Gandi, Appala Naidu; Schwingenschlögl, Udo

    2016-05-18

    We solve the transport equations of the electrons and phonons to understand the thermoelectric behaviour of the technologically important half-Heusler alloys MNiSn (M: Ti, Zr, Hf). Doping is simulated within the rigid band approximation. We clarify the origin of the electron dominated thermoelectric response and determine the carrier concentrations with maximal figures of merit. The phonon mean free path is studied to calculate the grain size below which grain refinement methods can enforce ballistic heat conduction to enhance the figure of merit. PMID:27156360

  11. First-principles calculations for interstitial Fe impurities in hcp Sc, Y, Ti, and Zr

    NASA Astrophysics Data System (ADS)

    Frota-Pessôa, S.; de Mello, L. A.; Petrilli, H. M.; Klautau, A. B.

    1993-12-01

    We have determined the electronic structure around interstitial Fe impurities in hcp Sc, Y, Ti, and Zr. The self-consistent calculations take lattice relaxation into account and were performed using the recently developed real space linear muffin-tin orbital scheme. This is the first time that such realistic calculations have been performed for isolated interstitial impurities in metals. In agreement with experiments, interstitial Fe was found to be nonmagnetic in these hosts; the calculated isomer shifts on both interstitial and substitutional Fe sites are also in excellent agreement with experiments.

  12. Thermophysical properties of Ti-5Al-5V-5Mo-3Cr-1Zr titanium alloy

    NASA Astrophysics Data System (ADS)

    Bykov, V. A.; Kulikova, T. V.; Vedmid', L. B.; Fishman, A. Ya.; Shunyaev, K. Yu.; Tarenkova, N. Yu.

    2014-07-01

    The thermophysical properties of the Ti-5Al-5V-5Mo-3Cr-1Zr titanium alloy in a wide range of temperatures from room temperature to 1000°C have been studied by the methods of differential scanning calorimetry, the laser flash method, and dilatometry. The obtained data on heat capacity, thermal diffusivity, and thermal expansion have been used for calculating coefficient of thermal conductivity. The sequence and temperatures of structural transformations during heating of the alloy have been established. It has been shown that the studied alloy possesses a coefficient of thermal conductivity that is 3.5-4 times smaller than that of pure titanium.

  13. Development of finely dispersed Ti- and Zr-doped isotropic graphites for the divertor of next step fusion devices

    NASA Astrophysics Data System (ADS)

    López-Galilea, I.; García-Rosales, C.; Pintsuk, G.; Linke, J.

    2007-03-01

    Finely dispersed Ti- and Zr-doped isotropic graphites have been manufactured using three different starting raw materials. The aim is to obtain doped fine grain isotropic graphites with reduced chemical erosion, high thermal shock resistance and low cost, which aim to be competitive with present carbon-based candidate materials for next step fusion devices. First ITER relevant thermal shock loads were applied on test specimens of these materials. The brittle destruction behaviour of graphite is greatly improved by doping with Ti or Zr, most probably due to a significant increase of thermal conductivity related to the catalytic effect of TiC and ZrC on the graphitization. Doped graphites manufactured with the synthetic mesophase pitch 'AR' as raw material showed the best performance from the three investigated raw materials due to its higher graphitability. The eroded surfaces of doped graphites exhibit a thin solidified carbide layer, probably caused by the segregation of liquid carbide during the thermal shot.

  14. Preparation of ZrO II/nano-TiO II composite powder by sol-gel method

    NASA Astrophysics Data System (ADS)

    Baharvandi, H. R.; Mohammadi, E.; Abdizadeh, H.; Hadian, A. M.; Ehsani, N.

    2007-07-01

    The effects of concentration of TTIP, amount of distilled water, and calcination temperature on morphology and particle size distribution of ZrO II/nano-TiO II catalysts were investigated. Mixed ZrO II/nano-TiO II powders were prepared by a modified sol-gel method by varying the mole fraction of TTIP from 0.002 to 0.01, H IIO/TTIP fraction from 2 to 8, and various stirring time (2, 4, and 10 h). The prepared ZrO II/nano-TiO II powders have been characterized by scanning electron microscopy (SEM), X-ray diffraction (XRD), and TG/DTA. Each oxide was calcined at the temperature between 110 and 1000°C. The results showed that the calcinations temperature has a pronounced effect on the phase formation and particle size of the calcined zirconium titanate (ZT) powders.

  15. Atomic study of fracture progress of Fe[110]/TMC[100] (TM = Ti, Zr and Hf) semi-coherent interfaces

    NASA Astrophysics Data System (ADS)

    Li, Jinchun; Song, Hongquan; Qian, Ping; Shen, Jiang

    2014-09-01

    Using first-principle calculation in combination with the Chen-Möbius inversion method, we get the interfacial potentials of the Fe[110]/TMC[100] (TM = Ti, Zr and Hf) interface system. Based on the interfacial potentials, we investigate the interfacial stability, misfit dislocations and tensile fracture of the semi-coherent interfaces of Fe[110]/TMC[100] (TM = Ti, Zr and Hf). The different sizes of the misfit dislocation models are employed to compare the interfacial energy. Results indicate that Fe[110]/HfC[100] interface is more stable than Fe[110]/TMC[100] (TM = Ti and Zr). The analysis of different tensile fracture processes shows that the misfit dislocations play an important role in the fractures of interfaces between iron and transitional metal carbides.

  16. Osseointegration behavior of novel Ti-Nb-Zr-Ta-Si alloy for dental implants: an in vivo study.

    PubMed

    Wang, Xiaona; Meng, Xing; Chu, Shunli; Xiang, Xingchen; Liu, Zhenzhen; Zhao, Jinghui; Zhou, Yanmin

    2016-09-01

    This study aimed to evaluate the effects of Ti-Nb-Zr-Ta-Si alloy implants on mineral apposition rate and new BIC contact in rabbits. Twelve Ti-Nb-Zr-Ta-Si alloy implants were fabricated and placed into the right femur sites in six rabbits, and commercially pure titanium implants were used as controls in the left femur. Tetracycline and alizarin red were administered 3 weeks and 1 week before euthanization, respectively. At 4 weeks and 8 weeks after implantation, animals were euthanized, respectively. Surface characterization and implant-bone contact surface analysis were performed by using a scanning electron microscope and an energy dispersive X-ray detector. Mineral apposition rate was evaluated using a confocal laser scanning microscope. Toluidine blue staining was performed on undecalcified sections for histology and histomorphology evaluation. Scanning electron microscope and histomorphology observation revealed a direct contact between implants and bone of all groups. After a healing period of 4 weeks, Ti-Nb-Zr-Ta-Si alloy implants showed significantly higher mineral apposition rate compared to commercially pure titanium implants (P < 0.05), whereas there was no significant difference between Ti-Nb-Zr-Ta-Si alloy implants and commercially pure titanium implants (P > 0.05) at 8 weeks. No significant difference of bone-to-implant contact was observed between Ti-Nb-Zr-Ta-Si alloy implants and commercially pure titanium implants implants after a healing period of 4 weeks and 8 weeks. This study showed that Ti-Nb-Zr-Ta-Si alloy implants could establish a close direct contact comparedto commercially pure titanium implants implants, improved mineral matrix apposition rate, and may someday be an alternative as a material for dental implants. PMID:27534399

  17. The adhesion performance of epoxy coating on AA6063 treated in Ti/Zr/V based solution

    NASA Astrophysics Data System (ADS)

    Zhu, Wen; Li, Wenfang; Mu, Songlin; Yang, Yunyu; Zuo, Xi

    2016-10-01

    An environment-friendly titanium/zirconium/vanadium-based (Ti/Zr/V) conversion coating was prepared on aluminum alloy 6063 (AA6063). The epoxy powder coatings were applied on the AA6063 samples with/without Ti/Zr/V conversion coatings via electrostatic spraying. The morphology and composition of the conversion coating were studied by scanning electron microscope (SEM) and X-ray photoelectron spectroscopy (XPS), respectively. The surface free energy components of AA6063 samples were measured by a static contact angle measuring device with Owens method. The adhesion properties of the epoxy coating on AA6063 treated with different conversion times were evaluated using a pull-off tester. The Ti/Zr/V conversion coating was mainly composed of metal oxide (TiO2, ZrO2, V2O5, Al2O3, etc.), metal fluoride (ZrF4, AlF3, etc.) and metal organic complex. The formation time of this conversion coating was reduced to 50 s. After such surface treatment, the samples' surface roughness was increased and the contact angle with water was decreased. Both the surface free energy and the work of adhesion were increased. The adhesion strength between the epoxy coating and AA6063 was enhanced significantly.

  18. SANS of bulk metallic ZrTiCuNiBe glasses

    SciTech Connect

    Schneider, S.; Geyer, U.; Thiyagarajan, P.; Johnson, W.L.

    1997-07-21

    The evolution of decomposition and succeeding primary crystallization in the bulk amorphous Zr{sub 41.2}Ti{sub 13.8}Cu{sub 12.5}Ni{sub 10}Be{sub 22.5} alloy have been studied by small angle neutron scattering. Samples annealed isothermally in the supercooled liquid and in the solid state exhibit correlation peaks indicating quasiperiodic inhomogeneities in the scattering length density. The peak positions vary as a function of temperature as predicted by the linear Cahn-Hilliard theory of spinodal decomposition. Variations of the Be-Ti composition ratio of the alloy leads to significant changes in scattering signals. The initially homogeneous alloy separates into two amorphous phases. In the decomposed regions, crystallization probability increases leading to polymorphic crystallization.

  19. Morphology of nanotube arrays grown on Ti-35Nb-2Ta-3Zr alloys with different deformations

    NASA Astrophysics Data System (ADS)

    Wang, Pei; Li, Hua; Zhang, Yangyang; Liu, Hezhou; Guo, Yiping; Liu, Zhongtang; Zhao, Shichang; Yin, Jimin; Guo, Yanjie

    2014-01-01

    Nanotubes on Ti-35Nb-2Ta-3Zr alloy with different degrees of deformations in thickness were fabricated by anodization method. The effect of deformations on the morphology, crystal phase and grain size of nanotubes was investigated. Nanotube arrays with uniform diameter were achieved by using ethylene glycol (EG)/NH4F organic electrolyte, indicating the electrolyte composition will influence the arrangement of TiO2 nanotube arrays. With the increasing degree of deformation, the corrosion potential Ecorr of the alloys had a positive displacement, which suggested an enhanced anticorrosion ability and resulted in nanotubes with smaller diameter. After heat treatment, anatase TiO2 was obtained. Due to the existence of lattice distortion, the grain size of TiO2 nanotubes prepared by Ti-35Nb-2Ta-3Zr alloy with deformations was smaller than that of with no deformation. However, when the reductions of alloy increased, there was a tendency to make the grain size larger, which was probably caused by the restriction of the wall thickness of nanotubes. The study about the nanotubes formed on Ti-35Nb-2Ta-3Zr alloy with different deformations provides a basis for its application on the drug-loading by Ti alloy prosthesis artificial joint.

  20. Structural and spectroscopic properties of high temperature prepared ZrO2-TiO2 mixed oxides

    NASA Astrophysics Data System (ADS)

    Gionco, Chiara; Battiato, Alfio; Vittone, Ettore; Paganini, Maria Cristina; Giamello, Elio

    2013-05-01

    ZrO2-TiO2 mixed oxides of various composition, with the molar fraction of TiO2 ranging from 0.1% to 15%, have been prepared via sol-gel synthesis and then calcined at 1273 K to check both their thermal stability and physicochemical properties. These solids are usually employed in photocatalytic processes and as active phase supports in heterogeneous catalysis. As indicated by X-ray diffraction and Raman spectroscopy, solid solutions based on Ti ions diluted in the ZrO2 matrix are formed in the whole range of Ti molar fraction examined. Materials with low Ti loading (0.1%-1%) are basically constituted by the monoclinic phase of ZrO2 while the tetragonal phase becomes prevalent at 15% of TiO2 molar fraction. The presence of Ti ions modify the electronic structure of the solid as revealed by investigation of the optical properties. The typical band gap transition of ZrO2 undergoes, in fact, a red shift roughly proportional to the Ti loading which reach the remarkable value of 1.6 eV for the sample with 10% of molar Ti concentration. Comparing chemical analysis of the solids with XPS data it has been put into evidence that the titanium ions distribution into the solid is not uniform and the concentration of Ti4+ tend to be higher in subsurface layers than in the crystal bulk. The introduction of titanium ions in the structure increases the reducibility of the solid. Annealing under vacuum at various temperatures causes oxygen depletion with consequent reduction of the solid which shows up mainly in terms of formation of Ti3+ reduced centres which are characterized by a typical EPR signal. Ti3+ defects forms, as also forecast by theoretical modelling of the solid, as their energy is lower than that of other possible reduced defective centers. The reduced solids are able to transfer electrons to adsorbed oxygen molecules in mild condition resulting in the formation of surface superoxide anions (O2•-) which are stabilized on surface Zr4+ or, alternatively, on Ti4+ ions

  1. Functional properties of multilayer vacuum-arc TiN/ZrN coatings

    NASA Astrophysics Data System (ADS)

    Plotnikov, S. V.; Pogrebnyak, A. D.; Tleukenov, Y. O.; Erdybaeva, N. K.

    2016-02-01

    Nanostructured multilayer Ti/ZrN coatings were synthesized by vacuum-arc deposition with a number of layers 134-533 and an average thickness 20-125nm of layers. A good planarity was revealed resulting in a range of nanometer layer from plasma streams in a reactive environment. Phase-structural changes mechanisms were established as a model of critical operating coatings’ conditions of in the surface layers under the action of an aggressive oxygen atmosphere at high temperature (700°C). The thickness parameter effect on its hardness of the multilayer system was shown. It was found that the maximum hardness of 42 GPa and the lowest abrasion of coating 1,3×10-5 mm3×H-1×mm-and counterbody 1,9×10-6 mm3×H-1×mm-1 inherent in TiN/ZrN system with the smallest layer thickness of 20 nm in the period. The results are explained by the influence of the size factor interphase boundaries magnified in a multilayer system with a nanometer thick layers.

  2. Unique local structures of Ca, Ti, Fe and Zr in natural glasses formed by meteorite impact

    NASA Astrophysics Data System (ADS)

    Yoshiasa, Akira; Tobase, Tsubasa; Okube, Maki; Wang, Ling; Isobe, Hiroshi; Mashimo, Tsutomu; Graduate School of Science; Technology Collaboration; Materials; Structures Laboratory, Tokyo Institute of Technology Collaboration

    2015-06-01

    The local structures of cation in tektite from six strewn fields, impact-related glass, and non-impact-related glass were studied by Ca, Ti, Fe and Zr K-edge X-ray absorption near edge structure (XANES) and extended X-ray absorption fine structure (EXAFS). Shock compression also causes local structural changes of gest and minor elements as well as transition of host structures. How to be left a record is peculiar by each element. The XAFS measurements were performed at the beam lines BL-NW10A and BL-9C, KEK, Japan. The comparison of XANES spectra and bonding distances between crystalline reference minerals and natural glasses was done. Based on the different valence states of iron, the degrees of oxidation states were estimated. The local structures of Ca, Ti and Zr ions are useful probe for physical conditions and formation process of glasses. Tektites experienced high quenching rates and a reduced atmospheric environment when they were ejected into outer space. Other impact-related glass, which was remained close to the crater, experienced a more complicated environment. The local structural changes of cation in the impact-related glass are rich in a variety. Analysis of local structure is help to compare their formation process and distinguish them.

  3. Dynamic recrystallization behavior of a biomedical Ti-13Nb-13Zr alloy.

    PubMed

    Bobbili, Ravindranadh; Madhu, V

    2016-06-01

    The dynamic recrystallization (DRX) behavior of a biomedical titanium Ti-13Nb-13Zr alloy has been investigated using the high temperature compression tests under wide range of strain rates (0.001-1/s) and temperatures 900-1050°C. A constitutive equation represented as a function of temperature, strain rate and true strain is developed and the hot deformation apparent activation energy is calculated about 534kJ/mol. By considering the exponential relationship between work-hardening rate (θ) and stress, a new mathematical model was proposed for predicting flow stress up to the critical strain during hot deformation. The mathematical model for predicting flow stress up to the critical strain exhibits better consistency and accuracy. The DRX kinetic equation of Ti-13Nb-13Zr alloy is described as XDRX=1-exp[-0.32(Ɛ-ƐcƐ(*))(2.3)] . The DRX kinetic model was validated by microstructure observation. It was also found that the process of DRX was promoted by decreasing strain rate and increasing deformation temperature. Eventually, the continuous dynamic recrystallization (CDRX) was identified to be the DRX mechanism using transmission electron microscope (TEM).

  4. Multibit ferroelectric field-effect transistor with epitaxial-like Pb(Zr,Ti)O3

    NASA Astrophysics Data System (ADS)

    Park, Jae Hyo; Kim, Hyung Yoon; Seok, Ki Hwan; Kiaee, Zohreh; Lee, Sol Kyu; Joo, Seung Ki

    2016-03-01

    Being able to control grain boundaries during the phase transformation when processing a ferroelectric thin-film is crucial for the successful development of practical multibit ferroelectric memory. A novel development of ferroelectric thin-film crystallization processing for realizing epitaxial-like single crystals via artificial nucleation by Pt-seeding is reported here. Dividing the nucleation and growth mechanism by Pt-seeding, it is possible to obtain large and uniform rectangular-shaped ferroelectric grains, large enough to fabricate a field-effect transistor (FET) in the inside of the crystal grain. The fabricated ferroelectric FET, Pt/Pb(Zr,Ti)O3/ZrTiO4/Si, showed a large memory window (˜2.2 V), a low operation voltage (˜6 V), and an ultra-fast program/erase speed (˜10-6 s). Moreover, there was no degradation after 1015 cycles of bipolar fatigue testing and the sample even showed a long retention time after 1 yr. All of these characteristics correspond to the best performance among all types of ferroelectric field-effect transistors reported thus far.

  5. Effect of annealing on atomic ordering of amorphous ZrTaTiNbSi alloy

    NASA Astrophysics Data System (ADS)

    Yang, Tsung-Han; Huang, Rong-Tang; Wu, Cheng-An; Chen, Fu-Rong; Gan, Jon-Yiew; Yeh, Jien-Wei; Narayan, Jagdish

    2009-12-01

    In this letter, we have reported on initial stages of atomic ordering in ZrTaTiNbSi amorphous films during annealing. The atomic ordering and structure evolution were studied in Zr17Ta16Ti19Nb22Si26 amorphous films as a function of annealing temperature in the temperature range from 473 to 1173 K. Up to annealing temperature of 1173 K, the films retained amorphous structure, but the degree of disorder is increased with the increase in temperature. The formation of Si-M covalent bonds, which contributed to the local atomic arrangement, occurred in the initial stages of ordering. The bonding reactions between Si and other metal species explain the anomalous structural changes which were observed in x-ray diffraction and transmission electron microscopy. We discuss the stages of phase transformation for amorphous films as a function of annealing temperature. From these results, we propose that annealing leads to formation of random Si-M4 tetrahedron, and two observed rings, a first and second in the electron diffraction patterns compared to M-M and Si-M bond length, respectively.

  6. Research Update: Magnetic phase diagram of EuTi1-xBxO3 (B = Zr, Nb)

    DOE PAGESBeta

    Li, Ling; Zhou, Haidong; Yan, Jiaqiang; Mandrus, David; Keppens, Veerle

    2014-11-21

    Herein, we report the magnetic phase diagram of EuTi1-xBxO3 (B = Zr, Nb), determined from magnetization and heat capacity measurements. Upon Zr-doping, the antiferromagnetic ordering temperature TN of EuTi1-xZrxO3 gradually decreases from 5.6 K (x = 0) to 4.1 K (x = 1). Whereas a similar decrease in TN is observed for small amounts of Nb doping (x ≤ 0.05), ferromagnetism is induced in EuTi1-xNbxO3 with x > 0.05. Lastly, the ferromagnetic interaction between localized Eu 4f spins mediated by itinerant electrons introduced by Nb doping results in the ferromagnetism in EuTi1-xNbxO3.

  7. Surface characteristics of TiN/ZrN coated nanotubular structure on the Ti-35Ta-xHf alloy for bio-implant applications

    NASA Astrophysics Data System (ADS)

    Moon, Byung-Hak; Choe, Han-Cheol; Brantley, William A.

    2012-01-01

    In this study, we investigated the surface characteristics of the TiN/ZrN-coated nanotubular structure on Ti-35Ta-xHf ternary alloys for bio-implant applications. These ternary alloys contained from 3 wt.% to 15 wt.% Hf contents and were manufactured in an arc-melting furnace. The Ti-35Ta-xHf alloys were heat treated in Ar atmosphere at 1000 °C for 24 h, followed by water quenching. Formation of the nanotubular structure was achieved by an electrochemical method in 1 M H3PO4 electrolytes containing 0.8 wt.% NaF. The TiN coating and ZrN coating were subsequently prepared by DC-sputtering on the nanotubular surface. Microstructures and nanotubular morphology of the alloys were examined by FE-SEM, EDX and XRD. The microstructure showed a duplex (α‧‧ + β) phase structure. Traces of martensite disappeared with increasing Hf content, and the Ti-35Nb-15Hf alloy had an entirely equiaxed structure of β phase. This research has shown that highly ordered, high aspect ratio, and nanotubular morphology surface oxide layers can be formed on the ternary titanium alloys by anodization. The TiN and ZrN coatings formed on the nanotubular surfaces were uniform and stable. The top of the nanotube layers was uniformly covered with the ZrN film compared to the TiN film when the Ti-35Ta-xHf alloys had high Hf content.

  8. Effect of TiO2, ZrO2, and TiO2-ZrO2 on the performance of CuO-ZnO catalyst for CO2 hydrogenation to methanol

    NASA Astrophysics Data System (ADS)

    Xiao, Jie; Mao, Dongsen; Guo, Xiaoming; Yu, Jun

    2015-05-01

    The influence of TiO2, ZrO2, and TiO2-ZrO2 mixed oxide on the catalytic performance of CuO-ZnO catalyst in the methanol synthesis from CO2 hydrogenation was studied. The catalysts were prepared by oxalate co-precipitation method and characterized by TGA, N2 adsorption, XRD, reactive N2O adsorption, XPS, H2-TPR, H2-TPD, and CO2-TPD techniques. Characterization results reveal that all the additives improve the CuO dispersion in the catalyst body and increase the Cu surface area and adsorption capacities of CO2 and H2. The results of catalytic test reveal that the additives increase both the CO2 conversion and methanol selectivity, and TiO2-ZrO2 mixed oxide is more effective than single components of TiO2 or ZrO2. Moreover, the activity of methanol synthesis is correlated directly with CO2 adsorption capacity over the catalysts.

  9. Characterization of a micro-roughened TiO2/ZrO2 coating: mechanical properties and HBMSC responses in vitro.

    PubMed

    Si, Jiawen; Zhang, Jianjun; Liu, Sha; Zhang, Wenbin; Yu, Dedong; Wang, Xudong; Guo, Lihe; Shen, Steve G F

    2014-07-01

    Previous studies have shown that using ZrO2 as a second phase to bioceramics can significantly increase the bonding strength of plasma-sprayed composite material. In the present study, micro-roughened titanium dioxide/zirconia (TiO2/ZrO2) (30 wt% ZrO2) coating and TiO2 coating were plasma-sprayed onto Ti plates. The micro-structural characteristics and mechanical properties of both coatings were investigated. Furthermore, the biological behavior and osteogenic differentiation of human bone marrow mesenchymal stem cells (HBMSCs) on both TiO2/ZrO2 and TiO2 coatings were compared. The results indicated that the shear bond strength and microhardness of TiO2/ZrO2 coating were statistically higher than those of TiO2 coating. Scanning electron microscope observation revealed that more irregularly shaped protuberances and denser pores were formed on the surface of TiO2/ZrO2 coating compared with those of TiO2 coating. Further comparative analysis of HBMSC proliferation and osteogenic differentiation on both coatings showed that significantly higher cellular alkaline phosphatase activity and expression levels of Runx2 and Osterix at day 10 after osteogenic culture were found on TiO2/ZrO2 coating compared with TiO2 coating, while no statistically significant difference in cell proliferation and extracellular calcium deposition was observed. The present study suggests that TiO2/ZrO2 coating may be favorable for dental implant applications.

  10. Isotropic plasticity of β-type Ti-29Nb-13Ta-4.6Zr alloy single crystals for the development of single crystalline β-Ti implants

    NASA Astrophysics Data System (ADS)

    Hagihara, Koji; Nakano, Takayoshi; Maki, Hideaki; Umakoshi, Yukichi; Niinomi, Mitsuo

    2016-07-01

    β-type Ti-29Nb-13Ta-4.6Zr alloy is a promising novel material for biomedical applications. We have proposed a ‘single crystalline β-Ti implant’ as new hard tissue replacements for suppressing the stress shielding by achieving a drastic reduction in the Young’s modulus. To develop this, the orientation dependence of the plastic deformation behavior of the Ti-29Nb-13Ta-4.6Zr single crystal was first clarified. Dislocation slip with a Burgers vector parallel to <111> was the predominant deformation mode in the wide loading orientation. The orientation dependence of the yield stress due to <111> dislocations was small, in contrast to other β-Ti alloys. In addition, {332} twin was found to be operative at the loading orientation around [001]. The asymmetric features of the {332} twin formation depending on the loading orientation could be roughly anticipated by their Schmid factors. However, the critical resolved shear stress for the {332} twins appeared to show orientation dependence. The simultaneous operation of <111> slip and {332} twin were found to be the origin of the good mechanical properties with excellent strength and ductility. It was clarified that the Ti-29Nb-13Ta-4.6Zr alloy single crystal shows the “plastically almost-isotropic and elastically highly-anisotropic” nature, that is desirable for the development of ‘single crystalline β-Ti implant’.

  11. Isotropic plasticity of β-type Ti-29Nb-13Ta-4.6Zr alloy single crystals for the development of single crystalline β-Ti implants

    PubMed Central

    Hagihara, Koji; Nakano, Takayoshi; Maki, Hideaki; Umakoshi, Yukichi; Niinomi, Mitsuo

    2016-01-01

    β-type Ti-29Nb-13Ta-4.6Zr alloy is a promising novel material for biomedical applications. We have proposed a ‘single crystalline β-Ti implant’ as new hard tissue replacements for suppressing the stress shielding by achieving a drastic reduction in the Young’s modulus. To develop this, the orientation dependence of the plastic deformation behavior of the Ti-29Nb-13Ta-4.6Zr single crystal was first clarified. Dislocation slip with a Burgers vector parallel to <111> was the predominant deformation mode in the wide loading orientation. The orientation dependence of the yield stress due to <111> dislocations was small, in contrast to other β-Ti alloys. In addition, {332} twin was found to be operative at the loading orientation around [001]. The asymmetric features of the {332} twin formation depending on the loading orientation could be roughly anticipated by their Schmid factors. However, the critical resolved shear stress for the {332} twins appeared to show orientation dependence. The simultaneous operation of <111> slip and {332} twin were found to be the origin of the good mechanical properties with excellent strength and ductility. It was clarified that the Ti-29Nb-13Ta-4.6Zr alloy single crystal shows the “plastically almost-isotropic and elastically highly-anisotropic” nature, that is desirable for the development of ‘single crystalline β-Ti implant’. PMID:27417073

  12. Surface structures and osteoblast response of hydrothermally produced CaTiO 3 thin film on Ti-13Nb-13Zr alloy

    NASA Astrophysics Data System (ADS)

    Park, Jin-Woo; Tustusmi, Yusuke; Lee, Chong Soo; Park, Chan Hee; Kim, Youn-Jeong; Jang, Je-Hee; Khang, Dongwoo; Im, Yeon-Min; Doi, Hisashi; Nomura, Naoyuki; Hanawa, Takao

    2011-06-01

    This study investigated the surface characteristics and in vitro biocompatibility of a titanium (Ti) oxide layer incorporating calcium ions (Ca) obtained by hydrothermal treatment with or without post heat-treatment in the Ti-13Nb-13Zr alloy. The surface characteristics were evaluated by scanning electron microscopy, thin-film X-ray diffractometry, X-ray photoelectron spectroscopy, atomic force microscopy and contact angle measurements. In vitro biocompatibility of the Ca-containing surfaces was assessed in comparison with untreated surfaces using a pre-osteoblast cell line. Hydrothermal treatment produced a crystalline CaTiO 3 layer. Post heat-treatment at 400 °C for 2 h in air significantly decreased water contact angles in the CaTiO 3 layer ( p < 0.001). The Ca-incorporated alloy surfaces displayed markedly increased cell viability and ALP activity compared with untreated surfaces ( p < 0.001), and also an upregulated expression of various integrin genes (α1, α2, α5, αv, β1 and β3) at an early incubation time-point. Post heat-treatment further increased attachment and ALP activity in cells grown on Ca-incorporated Ti-13Nb-13Zr alloy surfaces. The results indicate that the Ca-incorporated oxide layer produced by hydrothermal treatment and a simple post heat-treatment may be effective in improving bone healing in Ti-13Nb-13Zr alloy implants by enhancing the viability and differentiation of osteoblastic cells.

  13. Continuous production of granular or powder Ti, Zr and Hf or their alloy products

    DOEpatents

    White, Jack C.; Oden, Laurance L.

    1993-01-01

    A continuous process for producing a granular metal selected from the group consisting of Ti, Zr or Hf under conditions that provide orderly growth of the metal free of halide inclusions comprising: a) dissolving a reducing metal selected from the group consisting of Na, Mg, Li or K in their respective halide salts to produce a reducing molten salt stream; b) preparing a second molten salt stream containing the halide salt of Ti, Zr or Hf; c) mixing and reacting the two molten streams of steps a) and b) in a continuous stirred tank reactor; d) wherein steps a) through c) are conducted at a temperature range of from about 800.degree. C. to about 1100.degree. C. so that a weight percent of equilibrium solubility of the reducing metal in its respective halide salt varies from about 1.6 weight percent at about 900.degree. C. to about 14.4 weight percent at about 1062.degree. C.; and wherein a range of concentration of the halide salt of Ti, Zn or Hf in molten halides of Na, Mg, Li or K is from about 1 to about 5 times the concentration of Na, Mg, Li or K; e) placing the reacted molten stream from step c) in a solid-liquid separator to recover an impure granular metal product by decantation, centrifugation, or filtration; and f) removing residual halide salt impurity by vacuum evaporator or inert gas sweep at temperatures from about 850.degree. C. to 1000.degree. C. or cooling the impure granular metal product to ambient temperature and water leaching off the residual metal halide salt.

  14. Treatment of olive mill wastewater by photooxidation with ZrO2-doped TiO2 nanocomposite and its reuse capability.

    PubMed

    Sponza, Delia Teresa; Oztekin, Rukiye

    2016-01-01

    Zirconium dioxide (zirconia, ZrO2)-doped TiO2 (TiO2/ZrO2) nanocomposite was used for the photocatalytic oxidation of pollutant parameters [COD components (CODtotal, CODdissolved and CODinert)], polyphenols (catechol, 3-hydroxybenzoic acid, tyrosol and 4-hydroxybenzoic acid) and total polyaromatic amines [aniline, 4-nitroaniline, o-toluidine and o-anisidine] from the olive mill effluent wastewaters at different operational conditions such as at different mass ratios of ZrO2 (50, 25, 14, 10 and 5 wt%) in the TiO2/ZrO2 nanocomposite, at different TiO2/ZrO2 photocatalyst concentrations (1, 4, 15 and 50 mg/L) and pH values (4.0-7.0-10.0) under 300 W UV irradiations, respectively. Under the optimized conditions (pH = 4.6, 15 mg/L ZrO2/TiO2 nanocomposite with a ZrO2 mass ratio of 14 wt%, 300 W UV light, after 60 min photooxidation time, at 21°C), the maximum CODdissolved, total phenol and total aromatic amines photooxidation yields were 99%, 89% and 95%, respectively. High pollutant removal (89%) yields after sequential five times utilization of ZrO2/TiO2 nanocomposite show that this catalyst can be effectively used commercially in the treatment of olive mill effluent.

  15. β-Type Zr-Nb-Ti biomedical materials with high plasticity and low modulus for hard tissue replacements.

    PubMed

    Nie, Li; Zhan, Yongzhong; Hu, Tong; Chen, Xiaoxian; Wang, Chenghui

    2014-01-01

    In order to develop new biomedical materials for hard tissue replacements, Zr-20Nb-xTi (x=0, 3, 7, 11 and 15) alloys with required properties were designed and prepared by using the vacuum arc melting method for the first time. Phase analysis and microstructural observation showed that all the as cast samples consisted of equiaxed β-Zr phase. The mechanical properties and fracture behaviors of the Zr-20Nb-xTi alloys have been analyzed. It is found that these alloys exhibit high plasticity, moderate compressive strength (1044-1325MPa) and yield stress (854-1080MPa), high elastic energy (12-20MJ/m(3)) and low Young's modulus (28-31GPa). This good combination of mechanical properties makes them potential biomedical materials for hard tissue replacement.

  16. Synthesis and Characterization of Zr-BASED Amorphous and Crystalline Composite Coating on Ti Substrate by Laser Cladding

    NASA Astrophysics Data System (ADS)

    Tang, D. M.; Zhang, D. C.; Peng, W.; Luo, Z. C.; Wu, X. Q.; Wang, Y. M.; Lin, J. G.

    2014-02-01

    A thin strip of a Zr-based alloy with a composition of Zr60Cu25Fe5Al10 (in atom percent) was used as a raw material, and the composite coatings containing Zr-based amorphous phase and crystallites on Ti substrate were fabricated by a one-step laser cladding method without protection. The microstructure, phase constitution, microhardness and wear properties of the coatings were investigated. The results indicate that the microstructure of the coatings is strongly dependent on the laser scanning speed under the conditions of the laser power of 1300 W and laser beam diameter of 6 mm, and the composite coating mainly containing amorphous phase with a small amount of the crystallites can be obtained at the laser scanning speed of 10 mm/s. The composite coating exhibits much higher microhardness than the pure Ti substrate, and thus it behaves superior wear resistance in comparison with the substrate.

  17. β-Type Zr-Nb-Ti biomedical materials with high plasticity and low modulus for hard tissue replacements.

    PubMed

    Nie, Li; Zhan, Yongzhong; Hu, Tong; Chen, Xiaoxian; Wang, Chenghui

    2014-01-01

    In order to develop new biomedical materials for hard tissue replacements, Zr-20Nb-xTi (x=0, 3, 7, 11 and 15) alloys with required properties were designed and prepared by using the vacuum arc melting method for the first time. Phase analysis and microstructural observation showed that all the as cast samples consisted of equiaxed β-Zr phase. The mechanical properties and fracture behaviors of the Zr-20Nb-xTi alloys have been analyzed. It is found that these alloys exhibit high plasticity, moderate compressive strength (1044-1325MPa) and yield stress (854-1080MPa), high elastic energy (12-20MJ/m(3)) and low Young's modulus (28-31GPa). This good combination of mechanical properties makes them potential biomedical materials for hard tissue replacement. PMID:24036526

  18. Theoretical and experimental studies of formation and migration of oxygen vacancies in BaM x Ti1- x O3 (M = Zr, Ge)

    NASA Astrophysics Data System (ADS)

    Umeda, Yuji; Aman, Sanshiro; Kuwabara, Akihide; Moriwake, Hiroki

    2016-10-01

    The formation and migration energies of oxygen vacancies in pure BaTiO3, and BaM x Ti1- x O3 (M = Zr, Ge) are calculated by first-principles calculations to understand the effect of doping on the reliability of multilayer ceramic capacitors (MLCCs). The formation and migration energies of oxygen vacancies are found to be larger in BaZr x Ti1- x O3 than in BaTiO3. This finding could be one of the possible reasons behind the improved reliability of Zr-doped MLCCs materials. On the other hand, by substituting Ge, the migration energy of BaGe x Ti1- x O3 becomes larger than that of BaTiO3. This is despite the smaller oxygen vacancy formation energy in BaGe x Ti1- x O3 than in BaTiO3. Even though Zr and Ge are tetravalent in BaM x Ti1- x O3, their valence states are different after the formation of oxygen vacancies, providing an explanation for the differences in vacancy formation and migration energies between BaZr x Ti1- x O3 and BaGe x Ti1- x O3. Our theoretical results are further confirmed by experiments on these model systems.

  19. The comparison of photocatalytic activity of synthesized TiO 2 and ZrO 2 nanosize onto wool fibers

    NASA Astrophysics Data System (ADS)

    Moafi, Hadi Fallah; Shojaie, Abdollah Fallah; Zanjanchi, Mohammad Ali

    2010-04-01

    TiO 2 and ZrO 2 nanocrystals were successfully synthesized and deposited onto wool fibers using the sol-gel technique at low temperature. The photocatalytic activities of TiO 2-coated and ZrO 2-coated wool fibers were measured by studying photodegradation of methylene blue and eosin yellowish dyes. The initial and the treated samples were characterized by several techniques such as scanning electron microscopy (SEM), transmission electron microscopy (TEM), diffuse reflectance spectroscopy (DRS) and X-ray diffraction. The TEM study shows dispersed particles with 10-30 nm in size for TiO 2-coated and 20-40 nm in size for ZrO 2-coated samples on the fiber surface. Comparison of the photocatalytic activity of the coated samples reveals superiority of TiO 2 modified sample with respect to that of ZrO 2 for degradation of both dyes. Our observations indicate that by applying this technique to the fabrics, self-cleaning materials could be designed for practical application.

  20. Polymorphic structure evolution and large piezoelectric response of lead-free (Ba,Ca)(Zr,Ti)O{sub 3} ceramics

    SciTech Connect

    Tian, Ye; Chao, Xiaolian E-mail: yangzp@snnu.edu.cn; Wei, Lingling; Liang, Pengfei; Yang, Zupei E-mail: yangzp@snnu.edu.cn; Jin, Li

    2014-03-17

    The polymorphic structure evolution of (Ba,Ca)(Zr,Ti)O{sub 3} piezoelectric ceramics was investigated by analysis of the in situ X-ray diffraction and dielectric spectra. The results indicated that a confined orthorhombic (O) phase region induced by the approach of the rhombohedral (R) and tetragonal (T) phases existed in an extremely narrow temperature range of (Ba{sub 0.85}Ca{sub 0.15})(Zr{sub 0.1}Ti{sub 0.9})O{sub 3} composition. The electric properties near the O–T phase boundaries of (Ba{sub 0.95}Ca{sub 0.05})(Zr{sub 0.05}Ti{sub 0.95})O{sub 3} and (Ba{sub 0.85}Ca{sub 0.15})(Zr{sub 0.1}Ti{sub 0.9})O{sub 3} were compared. The results suggested that the confined O phase region is an important factor that contributes to the extremely large piezoelectric response.

  1. Phase Stability in the Mo-Ti-Zr-C System via Thermodynamic Modeling and Diffusion Multiple Validation

    NASA Astrophysics Data System (ADS)

    Kar, Sujoy Kumar; Dheeradhada, Voramon S.; Lipkin, Don M.

    2013-08-01

    Alloys in the Mo-rich corner of the Mo-Ti-Zr-C system have found broad applications in non-oxidizing environments requiring structural integrity well beyond 1273 K (1000 °C). Alloys such as TZM (Mo-0.5Ti-0.08Zr-0.03C by weight %) and TZC (Mo-1.2Ti-0.3Zr-0.1C by weight) owe much of their high temperature strength and microstructural stability to MC and M2C carbide phases. In turn, the stability of the respective carbides and the subsequent mechanical behavior of the alloys are strongly dependent on the alloying additions and thermal history. A CALPHAD-based thermodynamic modeling approach is employed to develop a quaternary thermodynamic database for the Mo-Ti-Zr-C system. The thermodynamic database thus developed is validated with diffusion multiple experiments and the validated database is exercised to elucidate the effects of alloying and thermal history on the phase equilibrium in Mo-rich alloys.

  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). PMID:24364974

  3. Corrosion-Resistant Ti- xNb- xZr Alloys for Nitric Acid Applications in Spent Nuclear Fuel Reprocessing Plants

    NASA Astrophysics Data System (ADS)

    Manivasagam, Geetha; Anbarasan, V.; Kamachi Mudali, U.; Raj, Baldev

    2011-09-01

    This article reports the development, microstructure, and corrosion behavior of two new alloys such as Ti-4Nb-4Zr and Ti-2Nb-2Zr in boiling nitric acid environment. The corrosion test was carried out in the liquid, vapor, and condensate phases of 11.5 M nitric acid, and the potentiodynamic anodic polarization studies were performed at room temperature for both alloys. The samples subjected to three-phase corrosion testing were characterized using scanning electron microscopy (SEM) and energy-dispersive X-ray microanalysis (EDAX). As Ti-2Nb-2Zr alloy exhibited inferior corrosion behavior in comparison to Ti-4Nb-4Zr in all three phases, weldability and heat treatment studies were carried out only on Ti-4Nb-4Zr alloy. The weldability of the new alloy was evaluated using tungsten inert gas (TIG) welding processes, and the welded specimen was thereafter tested for its corrosion behavior in all three phases. The results of the present investigation revealed that the newly developed near alpha Ti-4Nb-4Zr alloy possessed superior corrosion resistance in all three phases and excellent weldability compared to conventional alloys used for nitric acid application in spent nuclear reprocessing plants. Further, the corrosion resistance of the beta heat-treated Ti-4Nb-4Zr alloy was superior when compared to the sample heat treated in the alpha + beta phase.

  4. A new (Ba, Ca) (Ti, Zr)O3 based multiferroic composite with large magnetoelectric effect

    PubMed Central

    Naveed-Ul-Haq, M.; Shvartsman, Vladimir V.; Salamon, Soma; Wende, Heiko; Trivedi, Harsh; Mumtaz, Arif; Lupascu, Doru C.

    2016-01-01

    The lead-free ferroelectric 0.5Ba(Zr0.2Ti0.8)O3 − 0.5(Ba0.7Ca0.3)TiO3 (BCZT) is a promising component for multifunctional multiferroics due to its excellent room temperature piezoelectric properties. Having a composition close to the polymorphic phase boundary between the orthorhombic and tetragonal phases, it deserves a case study for analysis of its potential for modern electronics applications. To obtain magnetoelectric coupling, the piezoelectric phase needs to be combined with a suitable magnetostrictive phase. In the current article, we report on the synthesis, dielectric, magnetic, and magnetoelectric characterization of a new magnetoelectric multiferroic composite consisting of BCZT as a piezoelectric phase and CoFe2O4 (CFO) as the magnetostrictive phase. We found that this material is multiferroic at room temperature and manifests a magnetoelectric effect larger than that of BaTiO3 −CoFe2O4 bulk composites with similar content of the ferrite phase. PMID:27555563

  5. A Liquid-Liquid Transition in an Undercooled Ti-Zr-Ni Liquid

    NASA Technical Reports Server (NTRS)

    Lee, G. W.; Gangopadhyay, A. K.; Kelton, K. F.; Hyers, R. W.; Rathz, T. J.; Rogers, J. R.

    2003-01-01

    If crystallization can be avoided, liquids enter a metastable (undercooled) state below their equilibrium liquidus temperatures, TI, finally freezing into a glass below a characteristic temperature called the glass transition temperature, T,. In rare cases, the undercooled liquid may undergo a liquid-liquid phase transition (liquid polymorphism) before entering the glassy state. This has been suggested from experimental studies of HzO and Si4. Such phase transitions have been predicted in some stable liquids, i.e. above TI at atmospheric pressure, for Si02 and BeF;, but these have not been verified experimentally. They have been observed in liquids of P7, Sis and C9, but only under high pressure. All of these transitions are driven by an anomalous density change, i.e. change in local structure, with temperature or pressure. In this letter we present the first experimental evidence for a phase transition in a low viscosity liquid that is not driven by an anomalous density change, but by an approach to a constant configuration state. A maximum in the specific heat at constant pressure, similar to what is normally observed near T,, is reported here for undercooled low viscosity liquids of quasicrystal- forming Ti-Zr-Ni alloys. that includes cooperativity, by incorporating a temperature dependent excitation energy fits the data well, signaling a phase transition.

  6. A new (Ba, Ca) (Ti, Zr)O3 based multiferroic composite with large magnetoelectric effect

    NASA Astrophysics Data System (ADS)

    Naveed-Ul-Haq, M.; Shvartsman, Vladimir V.; Salamon, Soma; Wende, Heiko; Trivedi, Harsh; Mumtaz, Arif; Lupascu, Doru C.

    2016-08-01

    The lead-free ferroelectric 0.5Ba(Zr0.2Ti0.8)O3 ‑ 0.5(Ba0.7Ca0.3)TiO3 (BCZT) is a promising component for multifunctional multiferroics due to its excellent room temperature piezoelectric properties. Having a composition close to the polymorphic phase boundary between the orthorhombic and tetragonal phases, it deserves a case study for analysis of its potential for modern electronics applications. To obtain magnetoelectric coupling, the piezoelectric phase needs to be combined with a suitable magnetostrictive phase. In the current article, we report on the synthesis, dielectric, magnetic, and magnetoelectric characterization of a new magnetoelectric multiferroic composite consisting of BCZT as a piezoelectric phase and CoFe2O4 (CFO) as the magnetostrictive phase. We found that this material is multiferroic at room temperature and manifests a magnetoelectric effect larger than that of BaTiO3 ‑CoFe2O4 bulk composites with similar content of the ferrite phase.

  7. A new (Ba, Ca) (Ti, Zr)O3 based multiferroic composite with large magnetoelectric effect.

    PubMed

    Naveed-Ul-Haq, M; Shvartsman, Vladimir V; Salamon, Soma; Wende, Heiko; Trivedi, Harsh; Mumtaz, Arif; Lupascu, Doru C

    2016-01-01

    The lead-free ferroelectric 0.5Ba(Zr0.2Ti0.8)O3 - 0.5(Ba0.7Ca0.3)TiO3 (BCZT) is a promising component for multifunctional multiferroics due to its excellent room temperature piezoelectric properties. Having a composition close to the polymorphic phase boundary between the orthorhombic and tetragonal phases, it deserves a case study for analysis of its potential for modern electronics applications. To obtain magnetoelectric coupling, the piezoelectric phase needs to be combined with a suitable magnetostrictive phase. In the current article, we report on the synthesis, dielectric, magnetic, and magnetoelectric characterization of a new magnetoelectric multiferroic composite consisting of BCZT as a piezoelectric phase and CoFe2O4 (CFO) as the magnetostrictive phase. We found that this material is multiferroic at room temperature and manifests a magnetoelectric effect larger than that of BaTiO3 -CoFe2O4 bulk composites with similar content of the ferrite phase. PMID:27555563

  8. 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.

  9. Dielectric and piezoelectric properties of (110) oriented Pb(Zr1-x Ti x )O3 thin films

    NASA Astrophysics Data System (ADS)

    Jian-Hua, Qiu; Zhi-Hui, Chen; Xiu-Qin, Wang; Ning-Yi, Yuan; Jian-Ning, Ding

    2016-05-01

    A phenomenological Landau-Devonshire theory is developed to investigate the ferroelectric, dielectric, and piezoelectric properties of (110) oriented Pb(Zr1-x Ti x )O3 (x = 0.4, 0.5, 0.6, and 0.7) thin films. At room temperature, the tetragonal a 1 phase, the orthorhombic a 2 c phase, the triclinic γ 1 phase, and the triclinic γ 2 phase are stable. The appearance of the negative polarization component P 2 in the a 2 c phase and the γ 1 phase is attributed to the nonlinear coupling terms in the thermodynamic potential. The γ phase of the Pb(Zr1-x Ti x )O3 thin films has better dielectric and piezoelectric properties than the a 2 c phase and the a 1 phase. The largest dielectric and piezoelectric coefficients are obtained in the Pb(Zr0.5Ti0.5)O3 thin film. The piezoelectric coefficient of 110-150 pm/V is obtained in the (110) oriented Pb(Zr0.5Ti0.5)O3 thin film, and the Pb(Zr0.3Ti0.7)O3 thin film has the remnant polarization and relative dielectric constant of 50 μC/cm2 and 100, respectively, which are in agreement with the experimental measurements reported in the literature. Project supported by the Priority Academic Program Development of Jiangsu Higher Education Institutions, China, the Research Fund of Jiangsu Province Cultivation Base for State Key Laboratory of Photovoltaic Science and Technology, China, Major Projects of Natural Science Research in Jiangsu Province, China (Grant No. 15KJA43002), and Qing Lan Project of Education Department of Jiangsu Province, China.

  10. The effects of strain relaxation on the dielectric properties of epitaxial ferroelectric Pb(Zr0.2Ti0.8)TiO3 thin films

    NASA Astrophysics Data System (ADS)

    Khan, Asif Islam; Yu, Pu; Trassin, Morgan; Lee, Michelle J.; You, Long; Salahuddin, Sayeef

    2014-07-01

    We study the effects of strain relaxation on the dielectric properties of epitaxial 40 nm Pb(Zr0.2Ti0.8)TiO3 (PZT) films. A significant increase in the defect and dislocation density due to strain relaxation is observed in PZT films with tetragonality c/a < 1.07 grown on SrTiO3 (001) substrates, which results in significant frequency dispersion of the dielectric constant and strong Rayleigh type behavior in those samples. This combined structural-electrical study provides a framework for investigating strain relaxation in thin films and can provide useful insights into the mechanisms of fatigue in ferroelectric materials.

  11. Mechanical and Electronic Properties of A1-xBxHy (A and B =Ti, Zr, Hf) Hydride Alloys: A First-principles Study

    SciTech Connect

    Dai, Yunya; Yang, Li; Nie, JL; Fan, K. M.; Peng, SM; Long, XG; Zhou, Xiaosong; Bing, Wenzeng; Zu, Xiaotao; Gao, Fei

    2013-12-01

    Using ab initio calculations, we investigated the mechanical and electronic properties of Ti1-xHfxHy, Ti1-xZrxHy and Zr1-xHfxTHy (x=0, 0.25, 0.5, 0.75, 1; y=1.5, 1.75, 2). The calculated results in binary hydrides show that the β-phase MH1.5[100] (M=Ti, Zr, Hf) are more stable than other possible structures. At the Fermi level, the density of states for metal d state increases with increasing the H concentration in MHy (y ranged from 1.5 to 2), which leads to the instability of their fcc structures and induces the tetragonal distortion. Ti0.75Hf0.25H1.5 and Zr0.25Hf0.75H1.5 exhibit the highest mechanical stability, while Ti0.25Zr0.75H1.5 has the lowest mechanical stability among the corresponding ternary systems considered. Moreover, the systems studied in the present work are all anisotropic and show a ductile behavior. The tetragonal distortion in Ti1-xHfxH1.5, Ti1-xZrxH1.5 and Zr1-xHfxH1.5 is not observed, retaining their fcc structures. The electronic structure of A1-xBxHy (A and B =Ti, Hf, Zr) exhibits metallic character.

  12. Phase Stability and Pressure Dependence of Defect Formation in Gd2Ti2O7 and Gd2Zr2O7 Pyrochlores

    NASA Astrophysics Data System (ADS)

    Zhang, F. X.; Wang, J. W.; Lian, J.; Lang, M. K.; Becker, U.; Ewing, R. C.

    2008-02-01

    We report dramatically different behaviors between isostructural Gd2Ti2O7 and Gd2Zr2O7 pyrochlore at pressures up to 44 GPa, in which the substitution of Ti for Zr significantly increases structural stability. Upon release of pressure, the Gd2Ti2O7 becomes amorphous. In contrast, the high-pressure phase of Gd2Zr2O7 transforms to a disordered defect-fluorite structure. First-principle calculations for both compositions revealed that the response of pyrochlore to high pressure is controlled by the intrinsic energetics of defect formation.

  13. Phase stability and pressure dependence of defect formation in Gd2Ti2O7 and Gd2Zr2O7 pyrochlores.

    PubMed

    Zhang, F X; Wang, J W; Lian, J; Lang, M K; Becker, U; Ewing, R C

    2008-02-01

    We report dramatically different behaviors between isostructural Gd2Ti2O7 and Gd2Zr2O7 pyrochlore at pressures up to 44 GPa, in which the substitution of Ti for Zr significantly increases structural stability. Upon release of pressure, the Gd2Ti2O7 becomes amorphous. In contrast, the high-pressure phase of Gd2Zr2O7 transforms to a disordered defect-fluorite structure. First-principle calculations for both compositions revealed that the response of pyrochlore to high pressure is controlled by the intrinsic energetics of defect formation.

  14. Microsegregation in and Phase Stability of As-Cast Ti-Zr-Hf-Ni-Pd-Pt High-Entropy Alloys

    NASA Astrophysics Data System (ADS)

    Yokoyama, Yoshihiko; Itoh, Shun; Murakami, Yoshihiro; Narita, Issei; Wang, Gongyao; Liaw, Peter K.

    2015-04-01

    Microsegregation in as-cast Ti-Zr-Hf-Ni-Pd-Pt high-entropy alloys (HEAs) was examined by scanning electron microscopy and transmission electron microscopy. The structure of the microsegregated HEAs was composed of dendrite grains and grain boundaries. Since Hf, Zr, and Pt show both high melting temperatures and large negative mixing enthalpy, microsegregation on a micrometer scale occurred easily, similar to the spontaneous inoculation during solidification of copper-mold casts. In contrast, the grain boundaries were identified as being Ti- and Ni-enriched regions. Macroscopic X-ray data showed the combination of a distinct body-centered-cubic structure and broad halo peaks (amorphous structure). Microstructure analysis revealed that heteroamorphous and nanocrystalline regions are observed when the Ti group:Ni group molar ratio was 50/50. This unique microsegregated structure resulted in an ultimate compression strength of more than 2 GPa.

  15. Mixed electron emission from doped Pb(Zr,Ti)O{sub 3} ceramics: Microstructural aspects

    SciTech Connect

    Zhang, W.; Huebner, W.

    1998-06-01

    A mixed type electron emission, i.e., simultaneous ferroelectric and plasma emission, was observed with a negative driving pulse applied to doped Pb(Zr,Ti)O{sub 3} ceramics in the absence of any external potential on the electron collector. During these emission studies, significant microstructural changes on the emission surface were observed, and corresponded to the different emission modes. Erosion craters at the edge of the electrode and small particles near these craters reflected the formation of a dense plasma there. Comparatively, cavities, i.e., grain pullouts, accumulated on the bare ferroelectric surface, the frequency of which depended upon its distance from the grid. This phenomenon is proposed to be a result of fringing fields and the associated strain energy due to 90{degree} domain switching, which could be seen as an evidence that ferroelectric emission occurred in these areas. {copyright} {ital 1998 American Institute of Physics.}

  16. 200 keV Xe+ ions irradiation effects on Zr-Ti binary films

    NASA Astrophysics Data System (ADS)

    Wang, Weipeng; Chai, Maosheng; Feng, Wei; Li, Zhengcao; Zhang, Zhengjun

    2015-05-01

    200 keV Xenon irradiation experiments were performed on magnetron sputtered Zr-Ti films under different doses up to 9 * 1015 ions/cm2. XRD, FE-SEM, AFM, HRTEM, nano-indentation and white light interferometer characterizations were applied to study the structural and mechanical properties modification introduced by the bombardment. Upon Xenon irradiation, structure of film matrix kept stable while the crystallinity of the top surface degraded significantly. Meanwhile, properties of irradiated films such as hardness, modulus and sheet resistance evolved with the same tendency, i.e. increased firstly and decrease with further increasing the irradiation dose. By selective area irradiation, competition between the surface sputtering and swelling was revealed, by which surface defects evolution was highlighted. The micro-defects evolution during Xenon irradiation was believed to be responsible for the macro-properties' modification.

  17. Adsorption and desorption kinetics in ZrO2 TiO2 by photoacoustic techniques

    NASA Astrophysics Data System (ADS)

    Pinto Neto, A.; Moura, D.; Kuranaga, C.; Silva, M. D.; Miranda, L. C. M.

    2005-06-01

    In this paper we report on the photoacoustic (PA) characterization of ZrO2-TiO2 ceramic wafers as a sensing element for solvent adulteration evaluation. The experiments consisted of photoacoustic time dependent monitoring of the sorption and desorption of a droplet of a solvent deposited on the outer face of a ceramic wafer. The used solvents were isopropanol and chloroform. For the polar isopropanol molecule the results shown diffusion into the sample, with a characteristic diffusion time τ_1, accompanied by the evaporation at a rate with a time constant τ_2. Indeed, for the non polar chloroform, wetting-drying kinetics is adequately described by a simple diffusion-evaporation.

  18. On the kinetics of shrinking grains. [Ti-6Al-2V-2Zr

    SciTech Connect

    Marsh, S.P.; Imam, M.A.; Rath, B.B.; Pande, C.S. )

    1993-01-01

    Photoemission microscopy is used to observe grain boundary migrating during grain growth in a Ti-6Al-2V-2Zr (wt%) alloy. Analysis of the motion of the grain boundary/edge intercepts with the free surface is performed on disappearing grains. These grains exhibit parabolic shrinkage kinetics of the form (L)[sup 2](t) [minus] (L)[sup 2](0) = [minus]Ct. The characteristic length (L) (t) is defined as the geometric mean edge spacing of the grain at the free surface at time t, and C is a positive constant that depends on the topology and shape of the grain below the free surface. The significance of these results with respect to grain growth is discussed.

  19. Containerless Measurement of Thermophysical Properties of Ti-Zr-Ni Alloys

    NASA Technical Reports Server (NTRS)

    Hyers, Robert; Bradshaw, Richard C.; Rogers, Jan C.; Rathz, Thomas J.; Lee, Geun W.; Gangopadhyay, Anup K.; Kelton, Kenneth F.

    2004-01-01

    The surface tension, viscosity, density, and thermal expansion of Ti-Zr-Ni alloys were measured for a number of compositions by electrostatic levitation methods. Containerless methods greatly reduce heterogeneous nucleation, increasing access to the undercooled liquid regime at finite cooling rates. The density and thermal expansion are measured optically, while the surface tension and viscosity are measured by the oscillating drop method. The measured alloys include compositions which form a metastable quasicrystal phase from the undercooled liquid, and alloys close to the composition of several multi-component bulk metallic glass-forming alloys. Measurements of surface tension show behavior typical of transition metals at high temperature, but a sudden decrease in the deeply undercooled liquid for alloys near the quasicrystal-forming composition range, but not for compositions which form the solid-solution phase first.

  20. Glass forming ability and thermodynamic properties of Ti(Zr,Hf)NiCu shape memory alloys

    NASA Astrophysics Data System (ADS)

    Pasko, A.; Kolomytsev, V.; Babanly, M.; Sezonenko, A.; Ochin, P.; Portier, R.; Vermaut, Ph.

    2003-10-01

    Rapidly solidified amorphous and crystalline-amorphous ribbons have been produced from a number of quatemary Ti{50+z-x}(Zr,Hf){ x}Ni{50- z-y}Cu{ y} alloys where z =(-5, 0, 5). Structural states were checked by XRD, crystallization behaviour of amorphous phase and martensitic transformations in crystalline material were studied by DSC. The glass transition and crystallization temperatures have been measured at different heating rates, and the crystallization activation energy for each composition and heat event bas been calculated. Isothermal crystallization gives an alternative method of determining the activation energy according to the Arrhenius equation. Contradictory requirements for the conditions of martensitic transformation and good glass forming ability is discussed.

  1. Assessment of the Hf N, Zr N and Ti N phase diagrams at high pressures and temperatures: balancing between MN and M3N4 (M = Hf, Zr, Ti)

    NASA Astrophysics Data System (ADS)

    Kroll, Peter

    2004-04-01

    We study the nitrogen-rich part of the phase diagram Hf-N, Zr-N and Ti-N, employing first-principle calculations for an assessment of energy and enthalpy as a function of pressure. At zero pressure the novel cubic Th3P4-type structures are metastable modifications of M3N4 (M = Hf,Zr). The lowest energy configuration of both compounds is an orthorhombic Zr3N4-type. This orthorhombic structure will transform into the Th3P4-type at 9 and 6 GPa, for Hf3N4 and Zr3N4, respectively. The lowest energy configuration of Ti3N4 is a CaTi2O4-type structure. It will first transform into the orthorhombic Zr3N4-type at 3.8 GPa, then further transform into the cubic Th3P4-type at 15 GPa. The spinel type is metastable throughout the phase diagram for all three systems. The phase boundary between mononitrides MN and the M3N4-phases is accessed as a function of pressure. We include the entropy of gaseous nitrogen from tabulated data to estimate the free enthalpy DgrG of the nitride phases. The orthorhombic modification of Hf3N4 turns out to be thermodynamically stable with respect to a decomposition into the mononitrides and nitrogen for temperatures up to about 1000 °C. The stability of Zr3N4 is in question; within the estimated error no final conclusion can be drawn. Ti3N4, on the other hand, will only be metastable. At higher pressures, however, the free energy of nitrogen is substantially reduced and the 3:4 compositions become more stable. We reproduce the experimental requirements (18 GPa and 2800 K) for the synthesis of the novel Hf3N4. At 2800 K the pressures needed to synthesize cubic phases of Zr3N4 and Ti3N4 are estimated to be 40 and 100 GPa, respectively.

  2. Uranyl-sorption properties of amorphous and crystalline TiO₂/ZrO₂ millimeter-sized hierarchically porous beads.

    PubMed

    Chee Kimling, Maryline; Scales, Nicholas; Hanley, Tracey L; Caruso, Rachel A

    2012-07-17

    Hierarchically porous TiO(2)/ZrO(2) millimeter-sized beads were synthesized using a sol-gel templating technique, and investigated for suitability as radionuclide sorbents using uranyl as a radionuclide-representative probe. The bead properties were varied by altering either composition (22, 36, and 82 wt % Zr in the Ti/Zr composite) or calcination temperature (500 or 700 °C). Uranyl adsorption was higher for the crystalline beads (surface area: 52-59 m(2) g(-1)) than the amorphous beads (surface area: 95-247 m(2) g(-1)), reaching a maximum of 0.170 mmol g(-1) for the 22 wt % Zr sample. This was attributed to the higher surface hydroxyl density (OH nm(-2)), presence of limited microporosity, and larger mesopores in the crystalline beads. Mass transport properties of the crystalline beads were not compromised by the large bead diameter: sorption rates comparable to those reported for powders were achieved and rates were higher than exclusively mesoporous reported systems, thereby highlighting the importance of pore hierarchy in designing materials with improved kinetics. Chemical stability of the sorbent, an important property for processes involving corrosive effluents (e.g., radioactive waste), was also assessed. Crystalline beads displayed superior resistance against matrix leaching in HNO(3). Stability varied with composition: the 22 wt % Zr sample demonstrated the highest stability. PMID:22738810

  3. Tracking magmatic processes through Zr/Hf ratios in rocks and Hf and Ti zoning in zircons: An example from the Spirit Mountain batholith, Nevada

    USGS Publications Warehouse

    Lowery, Claiborne L.E.; Miller, C.F.; Walker, B.A.; Wooden, J.L.; Mazdab, F.K.; Bea, F.

    2006-01-01

    Zirconium and Hf are nearly identical geochemically, and therefore most of the crust maintains near-chondritic Zr/Hf ratios of ???35-40. By contrast, many high-silica rhyolites and granites have anomalously low Zr/Hf (15-30). As zircon is the primary reservoir for both Zr and Hf and preferentially incorporates Zr, crystallization of zircon controls Zr/ Hf, imprinting low Zr/Hf on coexisting melt. Thus, low Zr/Hf is a unique fingerprint of effective magmatic fractionation in the crust. Age and compositional zonation in zircons themselves provide a record of the thermal and compositional histories of magmatic systems. High Hf (low Zr/ Hf) in zircon zones demonstrates growth from fractionated melt, and Ti provides an estimate of temperature of crystallization (TTiZ) (Watson and Harrison, 2005). Whole-rock Zr/Hf and zircon zonation in the Spirit Mountain batholith, Nevada, document repeated fractionation and thermal fluctuations. Ratios of Zr/Hf are ???30-40 for cumulates and 18-30 for high-SiO2 granites. In zircons, Hf (and U) are inversely correlated with Ti, and concentrations indicate large fluctuations in melt composition and TTiZ (>100??C) for individual zircons. Such variations are consistent with field relations and ion-probe zircon geochronology that indicate a >1 million year history of repeated replenishment, fractionation, and extraction of melt from crystal mush to form the low Zr/Hf high-SiO2 zone. ?? 2006 The Mineralogical Society.

  4. In vitro bioactivity and corrosion resistance of Zr incorporated TiO2 nanotube arrays for orthopaedic applications

    NASA Astrophysics Data System (ADS)

    Indira, K.; KamachiMudali, U.; Rajendran, N.

    2014-10-01

    The present investigation deals with the incorporation of zirconium (Zr) ions onto TiO2 nanotube arrays (TNT) by simple dip coating method for biomedical implants. The electrochemical behaviour of the specimens were studied with potentiodynamic polarization (Tafel plots) and electrochemical impedance spectroscopy (EIS), while surface analysis involved field emission scanning electron microscopy (FE-SEM) with energy dispersive X-ray spectroscopy (EDS), atomic force microscopy (AFM), attenuated total reflectance fourier transform infrared (ATR-FTIR) spectroscopy, thin film x-ray diffraction (TF-XRD) and contact angle measurements. The FE-SEM morphology revealed that self-organised TNT was tightly arrayed with an average diameter of 110 ± 4 nm. The wall thickness and length of 15 ± 2 nm and 2.1 ± 0.3 μm respectively were developed by electrochemical anodization of titanium sheet in a mixture of ethylene glycol and NH4F electrolyte. The EDS, ATR-FTIR and TF-XRD studies were revealed the incorporation of Zr onto TNT specimens. Hydroxyapatite (HAp) was grown over Zr ions incorporated TNT (Zr-TNT) via in vitro immersion method. The HAp grown Zr-TNT exhibited higher bioactivity as well as enhanced corrosion resistance when compared to other specimen. Hence, Zr-TNT could be a viable material for the use as orthopaedic implant with good bioactivity and corrosion resistance.

  5. 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.

  6. Fatigue performance and cyto-toxicity of low rigidity titanium alloy, Ti-29Nb-13Ta-4.6Zr.

    PubMed

    Niinomi, Mitsuo

    2003-07-01

    A beta type titanium alloy, Ti-29Nb-13Ta-4.6Zr, was newly designed and developed for biomedical applications. The new alloy contains non-toxic elements such as Nb, Ta, and Zr. In the present study, phases that appeared in the new alloy through various aging treatments were characterized by hardness tests and microstructural observations in order to identify the phase transformation. Fatigue properties of the new alloy were investigated. Young's modulus and cyto-toxicity of the new alloy were also evaluated. Precipitated phases distribute homogeneously over the whole specimen, and they are alpha phase, a small amount of omega phase, and beta phase when the new alloys are subjected to aging treatment at 673K for 259.2ks after solution treatment at 1063K for 3.6ks. The fatigue strength of the new alloy subjected to aging at 673K for 259.2ks after solution treatment at 1063K for 3.6ks is much better than when subjected to other aging treatments. In this case, the fatigue limit is around 700MPa. Young's modulus of the new alloy is much smaller than that of Ti-6Al-4V ELI. The cyto-toxicity of the new alloy is equivalent to that of pure Ti. Therefore, it is proposed that the new alloy, Ti-29Nb-13Ta-4.6Zr, will be of considerable use in biomedical applications.

  7. K-shell ionization cross section for Ti, Fe, Cu, Zr, and Ag

    SciTech Connect

    Benka, O.; Geretschlager, M.

    1981-04-01

    Absolute K-shell ionisation cross sections have been measured for thin targets of Ti, Fe, Cu, Zr and Ag for protons in the energy range 85-790 keV and for thin targets of Ti, Fe and Cu for He ions in the energy range 190-750 keV. In addition the relative variation of the cross sections with energy has been determined with high accuracy. The experimental values are compared to the perturbed stationary state approximation (CPSSR) and the semiclassical approximation (SCA). The CPSSR theory provides the best overall agreement with experimental cross sections. For higher scaled energies the CPSSR theory predicts the energy dependence of the cross sections very well but in the lower energy range it overpredicts the cross sections by as much as a factor of two and this overprediction seems to increase with Z/sub 2/ at a fixed scaled energy y. The SCA theory predicts slightly too large ionisation cross sections except for the lowest pounds values. The relative variation of the cross sections with energy is not well described in either energy range.

  8. 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.

  9. Local structural distortion of BaZr[subscript x]Ti[subscript 1;#8722;x]O[subscript 3] nanocrystals synthesized at room temperature

    SciTech Connect

    Rabuffetti, Federico A.; Brutchey, Richard L.

    2012-02-07

    Single crystalline, sub-15 nm BaZr{sub x}Ti{sub 1-x}O{sub 3} (0 {<=} x {<=} 1) nanocrystals were synthesized at room temperature via the vapor diffusion sol-gel method. As-prepared nanocrystals exhibit noncentrosymmetric regions whose volume fraction increases significantly upon substitution of small amounts of Zr{sup 4+} for Ti{sup 4+} and reaches a maximum for substitution levels ranging from 10 to 20 mol%.

  10. Oriented and ordered mesoporous ZrO{sub 2}/TiO{sub 2} fibers with well-organized linear and spring structure

    SciTech Connect

    Zhu, Luyi; Liu, Benxue; Qin, Weiwei; Liu, Hongjing; Lin, Xuejun; Cai, Ningning; Wang, Xinqiang; Xu, Dong

    2015-08-15

    Graphical abstract: The ultra-stable order mesoporous ZrO{sub 2}/TiO{sub 2} fibers with well-organized linear and spring structure and large surface area under higher temperatures were prepared by a simple EISA process. - Highlights: • The ZrO{sub 2}/TiO{sub 2} fibers were prepared by EISA process combined with steam heat-treatment. • The mesoporous ZrO{sub 2}/TiO{sub 2} fibers have well-organized linear and spring structure. • The fibers were composed of oval rod nanocrystals of ZrTiO{sub 4}. - Abstract: The ultra-stable order mesoporous ZrO{sub 2}/TiO{sub 2} fibers with well-organized linear and spring structure and large surface areas under higher temperatures were prepared by a (simple evaporation-induced assembly) EISA process. The preparation, microstructures and formation processes were characterized by Fourier transformation infrared (FTIR), X-ray diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM) and N{sub 2} adsorption–absorption measurements. The fibers take on pinstripe configuration which is very orderly along or perpendicular to the axial direction of the fibers. The diameters of the pinstripe are in the region of 200–400 nm and arranges regularly, which are composed of oval rod nanocrystals of ZrTiO{sub 4}.

  11. Phenomenological thermodynamic potentials for bulk and thin-film Ba (Zr0.08 Ti 0.92 ) O 3 single crystals

    NASA Astrophysics Data System (ADS)

    Peng, J. L.; Li, Q.; Shan, D. L.; Pan, K.; Yu, G. S.; Liu, Y. Y.

    2016-05-01

    Phenomenological thermodynamic analysis is an important theoretical investigation method for ferroelectric materials, however, it cannot be implemented for Ba ( Zr x Ti 1 - x ) O 3 due to the lack of thermodynamic potential coefficients. In this paper, we have constructed a phenomenological thermodynamic potential for bulk Ba ( Zr 0.08 Ti 0.92 ) O 3 single crystals, which reproduces the three phase transition temperatures, dielectric and piezoelectric constants of bulk Ba ( Zr 0.08 Ti 0.92 ) O 3 single crystals well, suggesting that the constructed thermodynamic potential is reliable. Then the thermodynamic potential with appropriate modification is applied to predict misfit strain-temperature phase diagram and electromechanical properties of Ba ( Zr 0.08 Ti 0.92 ) O 3 thin films. It is found that compressive strain favors the tetragonal c phase with an out-of-plane polarization component, while tensile misfit strain favors orthorhombic aa phase with an in-plane polarization component. It also reveals that Ba ( Zr 0.08 Ti 0.92 ) O 3 thin films under appropriate compressive strain show higher piezoelectric coefficient d15 than that of their bulk counterpart. The constructed thermodynamic potential opens a new avenue to theoretical analysis on Ba ( Zr 0.08 Ti 0.92 ) O 3 .

  12. Deposition And Characterization of (Ti,Zr)N Thin Films Grown Through PAPVD By The Pulsed Arc Technique

    SciTech Connect

    Marulanda, D. M.; Trujillo, O.; Devia, A.

    2006-12-04

    The Plasma Assisted Physic Vapor Deposition (PAPVD) by the pulsed arc technique has been used for deposition of Titanium Zirconium Nitride (Ti,Zr)N coatings, using a segmented target of TiZr. The deposition was performed in a vacuum chamber with two faced electrodes (target and substrate) using nitrogen as working gas, and a power-controlled source used to produce the arc discharges. Films were deposited on stainless steel 304, and they were characterized using the X-Ray Photoelectron Spectroscopy (XPS), X-Ray Diffraction (XRD), Energy Dispersion Spectroscopy (EDS) and Scanning Probe Microscopy (SPM) techniques. The XRD patterns show different planes in which the film grows. Through SPM, using Atomic Force Microscopy (AFM) and Lateral Force Microscopy (LFM) modes, a nanotribologic study of the thin film was made, determining hardness and friction coefficient.

  13. Metastable phase transformation and hcp-ω transformation pathways in Ti and Zr under high hydrostatic pressures

    NASA Astrophysics Data System (ADS)

    Gao, Lei; Ding, Xiangdong; Lookman, Turab; Sun, Jun; Salje, E. K. H.

    2016-07-01

    The energy landscape of Zr at high hydrostatic pressure suggests that its transformation behavior is strongly pressure dependent. This is in contrast to the known transition mechanism in Ti, which is essentially independent of hydrostatic pressure. Generalized solid-state nudged elastic band calculations at constant pressure shows that α-Zr transforms like Ti only at the lowest pressure inside the stability field of ω-phase. Different pathways apply at higher pressures where the energy landscape contains several high barriers so that metastable states are expected, including the appearance of a transient bcc phase at ca. 23 GPa. The global driving force for the hcp-ω transition increases strongly with increasing pressure and reaches 23.7 meV/atom at 23 GPa. Much of this energy relates to the excess volume of the hcp phase compared with its ω phase.

  14. Studies of thin films of Ti- Zr -V as non-evaporable getter films prepared by RF sputtering

    SciTech Connect

    Gupta, Nidhi; Jagannath,; Sharma, R. K.; Gadkari, S. C.; Muthe, K. P.; Mukundhan, R.; Gupta, S. K.

    2013-02-05

    Non-Evaporable Getter (NEG) films of the Ti-Zr-V prepared on stainless steel substrates by Radio Frequency sputtering. To observe its getter behavior at the lowest activation temperature, the sample is heated continuously at different temperatures (100 Degree-Sign C, 150 Degree-Sign C, 200 Degree-Sign C and 250 Degree-Sign C) for 2 hours. The changes of the surface chemical composition at different temperaturesare analyzed by using XPS and SEM (Scanning Electron Microscopy) techniques. The volume elemental composition of the film has been measured by energy dispersive X-ray spectroscopy (EDX). The in-situ XPS measurements of the activated getter films show the disappearance of the superficial oxide layer through the variation in the oxygen stoichiometry during thermal activation. Results of these studies show that the deposited films of Ti-Zr-V could be used as NEG to produce extreme high vacuum.

  15. Structural and magnetic properties of TiZrNi thin films prepared by magnetron sputtering and thermal annealing.

    PubMed

    Shin, Hyemin; Choi, Soo-bin; Lee, Ik-jae; Yu, Chung-jong; Kim, Jae-yong

    2010-11-01

    Distinctive thin layers of TiZr and Ni were deposited by using a magnetron sputtering method and a thermal annealing was applied to discover metallic films of quasicrystals. After a heat treatment in vacuum, 70 nm thick deposited layers were well mixed with nominal compositions of 49.7, 29.3 and 21.0 for Ti, Zr and Ni, respectively, which is very close with the one forming a quasicrystalline phase. The magnetization values were significantly decreased from 0.286 to 0.142 emu/mm3 at 2000 Oe, after annealing, while a shape of magnetic hysteresis was maintained. It is believed that a different magnetic behavior after thermal annealing is due to the homogeneous mixing of atomic elements and possible existence of a metastable phase.

  16. 84 MeV C-ions irradiation effects on Zr-45Ti-5Al-3V alloy

    NASA Astrophysics Data System (ADS)

    Wang, Weipeng; Li, Zhengcao; Zhang, Zhengjun; Zhang, Chonghong

    2014-09-01

    Newly developed Zr-45Ti-5Al-3V alloy were irradiated by 84 MeV carbon ions with doses of 4 * 1015 ions/cm2 and 12 * 1015 ions/cm2, respectively. XRD, SEM, TEM, SAD and tensile tests were performed to study the microstructural evolution and mechanical properties modification upon high energy carbon ion irradiation. XRD patterns show no phase change while the diffraction peak position and intensity vary with irradiation doses. Tensile tests verify monotonic change of alloy strengths and elongations upon irradiation. Microstructure observations of the irradiated samples reveal the irradiation-induced precipitation of (Zr,Ti)3C2, which was believed contributing to the alloy hardening. Superlattice was discovered by the SAD patterns of original and irradiated samples and the high energy C-ions implantation was demonstrated to promote the disorder-order transition by introducing lattice defects.

  17. Highly transparent and flexible bio-based polyimide/TiO2 and ZrO2 hybrid films with tunable refractive index, Abbe number, and memory properties

    NASA Astrophysics Data System (ADS)

    Huang, Tzu-Tien; Tsai, Chia-Liang; Tateyama, Seiji; Kaneko, Tatsuo; Liou, Guey-Sheng

    2016-06-01

    The novel bio-based polyimide (4ATA-PI) and the corresponding PI hybrids of TiO2 or ZrO2 with excellent optical properties and thermal stability have been prepared successfully. The highly transparent 4ATA-PI containing carboxylic acid groups in the backbone could provide reaction sites for organic-inorganic bonding to obtain homogeneous hybrid films. These PI hybrid films showed a tunable refractive index (1.60-1.81 for 4ATA-PI/TiO2 and 1.60-1.80 for 4ATA-PI/ZrO2), and the 4ATA-PI/ZrO2 hybrid films revealed a higher optical transparency and Abbe's number than those of the 4ATA-PI/TiO2 system due to a larger band gap of ZrO2. By introducing TiO2 and ZrO2 as the electron acceptor into the 4ATA-PI system, the hybrid materials have a lower LUMO energy level which could facilitate and stabilize the charge transfer complex. Therefore, memory devices derived from these PI hybrid films exhibited tunable memory properties from DRAM, SRAM, to WORM with a different TiO2 or ZrO2 content from 0 wt% to 50 wt% with a high ON/OFF ratio (108). In addition, the different energy levels of TiO2 and ZrO2 revealed specifically unique memory characteristics, implying the potential application of the prepared 4ATA-PI/TiO2 and 4ATA-PI/ZrO2 hybrid films in highly transparent memory devices.The novel bio-based polyimide (4ATA-PI) and the corresponding PI hybrids of TiO2 or ZrO2 with excellent optical properties and thermal stability have been prepared successfully. The highly transparent 4ATA-PI containing carboxylic acid groups in the backbone could provide reaction sites for organic-inorganic bonding to obtain homogeneous hybrid films. These PI hybrid films showed a tunable refractive index (1.60-1.81 for 4ATA-PI/TiO2 and 1.60-1.80 for 4ATA-PI/ZrO2), and the 4ATA-PI/ZrO2 hybrid films revealed a higher optical transparency and Abbe's number than those of the 4ATA-PI/TiO2 system due to a larger band gap of ZrO2. By introducing TiO2 and ZrO2 as the electron acceptor into the 4ATA-PI system

  18. Near-stoichiometric Ti-diffused LiNbO(3) strip waveguide doped with Zr(4+).

    PubMed

    Zhang, De-Long; Yang, Xiao-Fei; Zhang, Qun; Wong, Wing-Han; Yu, Dao-Yin; Pun, Edwin Yue-Bun

    2015-11-15

    We report a near-stoichiometric Ti:Zr:LiNbO(3) strip waveguide fabricated from a congruent substrate with a technological process in the following sequence: Zr4+-diffusion-doping, diffusion of 8-μm-wide, 100-nm-thick Ti strips, and post-Li-rich vapor transport equilibration. We show that Zr(4+)-doping has little effect on the LiNbO(3) refractive index, and the waveguide is in a near-stoichiometric environment. The waveguide well supports both the TE and TM modes, shows weak polarization dependence, is in single mode at the 1.5 μm wavelength, and has a loss of ≤0.6/0.8 dB/cm for the TE/TM modes. A secondary ion mass spectrometry analysis shows that the Zr(4+)-profile part with a concentration above the threshold of photorefractive damage entirely covers the waveguide, implying that the waveguide would be optical-damage resistant.

  19. Strain effects on Coherent Epitaxial Ferroelectric Pb(Zr0.2Ti0.8)O3

    NASA Astrophysics Data System (ADS)

    Khan, Asif; Salahuddin, Sayeef

    2012-02-01

    A comprehensive study of strain coupling to ferroelectricity in coherent epitaxial Pb(Zr0.2Ti0.8)TiO3 thin films is presented. The epitaxial strain variants are obtained by growing coherent PZT thin films on three different substrates, SrTiO3, DyScO3 and GdScO3 by pulsed laser deposition technique. The strain sensitivity of remnant polarization is found to be less in the epitaxial strain variants with larger tetragonality. Despite the fact that the tetragonality of PZT is more sensitive to the epitaxial strain than that of BaTiO3, the polarization-strain coupling is weaker in PZT than in BTO. These results underpins that the strong sensitivity of ferroelectricity to epitaxial strain is not a universal characteristic of complex oxide ferroelectrics and may depend on the intricate details of individual material systems.

  20. Osteogenic differentiation of adipose tissue-derived mesenchymal stem cells on nanostructured Ti6Al4V and Ti13Nb13Zr.

    PubMed

    Marini, Francesca; Luzi, Ettore; Fabbri, Sergio; Ciuffi, Simone; Sorace, Sabina; Tognarini, Isabella; Galli, Gianna; Zonefrati, Roberto; Sbaiz, Fausto; Brandi, Maria Luisa

    2015-01-01

    Bone tissue engineering and nanotechnology enable the design of suitable substitutes to restore and maintain the function of human bone tissues in complex fractures and other large skeletal defects. Long-term stability and functionality of prostheses depend on integration between bone cells and biocompatible implants. Human adipose tissue-derived mesenchymal stem cells (hAMSCs) have been shown to possess the same ability to differentiate into osteoblasts and to produce bone matrix of classical bone marrow derived stem cells (BMMSCs). Ti6A14V and Ti13Nb13Zr are two different biocompatible titanium alloys suitable for medical bone transplantation. Preliminary results from our Research Group demonstrated that smooth Ti6Al4V surfaces exhibit an osteoconductive action on hAMSCs, granting their differentiation into functional osteoblasts and sustaining bone matrix synthesis and calcification. The purpose of this study is to assay the ability of nanostructured Ti6Al4V and Ti13Nb13Zr alloys to preserve the growth and adhesion of hAMSCs and, mostly, to sustain and maintain their osteogenic differentiation and osteoblast activity. The overall results showed that both nanostructured titanium alloys are capable of sustaining cell adhesion and proliferation, to promote their differentiation into osteoblast lineage, and to support the activity of mature osteoblasts in terms of calcium deposition and bone extracellular matrix protein production.

  1. Osteogenic differentiation of adipose tissue-derived mesenchymal stem cells on nanostructured Ti6Al4V and Ti13Nb13Zr

    PubMed Central

    Marini, Francesca; Luzi, Ettore; Fabbri, Sergio; Ciuffi, Simone; Sorace, Sabina; Tognarini, Isabella; Galli, Gianna; Zonefrati, Roberto; Sbaiz, Fausto; Brandi, Maria Luisa

    2015-01-01

    Summary Bone tissue engineering and nanotechnology enable the design of suitable substitutes to restore and maintain the function of human bone tissues in complex fractures and other large skeletal defects. Long-term stability and functionality of prostheses depend on integration between bone cells and biocompatible implants. Human adipose tissue-derived mesenchymal stem cells (hAMSCs) have been shown to possess the same ability to differentiate into osteoblasts and to produce bone matrix of classical bone marrow derived stem cells (BMMSCs). Ti6A14V and Ti13Nb13Zr are two different biocompatible titanium alloys suitable for medical bone transplantation. Preliminary results from our Research Group demonstrated that smooth Ti6Al4V surfaces exhibit an osteoconductive action on hAMSCs, granting their differentiation into functional osteoblasts and sustaining bone matrix synthesis and calcification. The purpose of this study is to assay the ability of nanostructured Ti6Al4V and Ti13Nb13Zr alloys to preserve the growth and adhesion of hAMSCs and, mostly, to sustain and maintain their osteogenic differentiation and osteoblast activity. The overall results showed that both nanostructured titanium alloys are capable of sustaining cell adhesion and proliferation, to promote their differentiation into osteoblast lineage, and to support the activity of mature osteoblasts in terms of calcium deposition and bone extracellular matrix protein production. PMID:26811701

  2. 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.

  3. Newly developed Ti-Nb-Zr-Ta-Si-Fe biomedical beta titanium alloys with increased strength and enhanced biocompatibility.

    PubMed

    Kopova, Ivana; Stráský, Josef; Harcuba, Petr; Landa, Michal; Janeček, Miloš; Bačákova, Lucie

    2016-03-01

    Beta titanium alloys are promising materials for load-bearing orthopaedic implants due to their excellent corrosion resistance and biocompatibility, low elastic modulus and moderate strength. Metastable beta-Ti alloys can be hardened via precipitation of the alpha phase; however, this has an adverse effect on the elastic modulus. Small amounts of Fe (0-2 wt.%) and Si (0-1 wt.%) were added to Ti-35Nb-7Zr-6Ta (TNZT) biocompatible alloy to increase its strength in beta solution treated condition. Fe and Si additions were shown to cause a significant increase in tensile strength and also in the elastic modulus (from 65 GPa to 85 GPa). However, the elastic modulus of TNZT alloy with Fe and Si additions is still much lower than that of widely used Ti-6Al-4V alloy (115 GPa), and thus closer to that of the bone (10-30 GPa). Si decreases the elongation to failure, whereas Fe increases the uniform elongation thanks to increased work hardening. Primary human osteoblasts cultivated for 21 days on TNZT with 0.5Si+2Fe (wt.%) reached a significantly higher cell population density and significantly higher collagen I production than cells cultured on the standard Ti-6Al-4V alloy. In conclusion, the Ti-35Nb-7Zr-6Ta-2Fe-0.5Si alloy proves to be the best combination of elastic modulus, strength and also biological properties, which makes it a viable candidate for use in load-bearing implants.

  4. 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. PMID:18464396

  5. Improving iron-enriched basalt with additions of ZrO{sub 2} and TiO{sub 2}

    SciTech Connect

    Reimann, G.A.; Kong, P.C.

    1993-06-01

    The iron-enriched basalt (IEB) waste form, developed at the Idaho National Engineering Laboratory a decade ago, was modified to IEB4 by adding sufficient ZrO{sub 2} and TiO{sub 2} to develop crystals of zirconolite upon cooling, in addition to the crystals that normally form in a cooling basalt. Zirconolite (CaZrTi{sub 2}O{sub 7}) is an extremely leach-resistant mineral with a strong affinity for actinides. Zirconolite crystals containing uranium and thorium have been found that have endured more than 2 billion years of natural processes. On this basis, zirconolite was considered to be an ideal host crystal for the actinides contained in transuranic (TRU)-contaminated wastes. Crystals of zirconolite were developed in laboratory melts of IEB4 that contained 5% each of ZrO{sub 2} and TiO{sub 2} and that were slow-cooled in the 1200--1000{degrees}C range. When actinide surrogates were added to IEB4, these oxides were incorporated into the crystals of zirconolite rather than precipitating in the residual glass phase. Zirconolite crystals developed in IEB4 should stabilize and immobilize the dilute TRUs in heterogeneous, buried low-level wastes as effectively as this same phase does in the various formulations of Synroc used for the more concentrated TRUs encountered in high-level wastes. Synroc requires hot-pressing equipment, while IEB4 precipitates zirconolite from a cooling basaltic melt.

  6. Influence of polyetheretherketone coatings on the Ti-13Nb-13Zr titanium alloy's bio-tribological properties and corrosion resistance.

    PubMed

    Sak, Anita; Moskalewicz, Tomasz; Zimowski, Sławomir; Cieniek, Łukasz; Dubiel, Beata; Radziszewska, Agnieszka; Kot, Marcin; Łukaszczyk, Alicja

    2016-06-01

    Polyetheretherketone (PEEK) coatings of 70-90μm thick were electrophoretically deposited from a suspension of PEEK powder in ethanol on near-β Ti-13Nb-13Zr titanium alloy. In order to produce good quality coatings, the composition of the suspension (pH) and optimized deposition parameters (applied voltage and time) were experimentally selected. The as-deposited coatings exhibited the uniform distribution of PEEK powders on the substrate. The subsequent annealing at a temperature above the PEEK melting point enabled homogeneous, semi-crystalline coatings with spherulitic morphology to be produced. A micro-scratch test showed that the coatings exhibited very good adhesion to the titanium alloy substrate. Coating delamination was not observed even up to a maximal load of 30N. The PEEK coatings significantly improved the tribological properties of the Ti-13Nb-13Zr alloy. The coefficient of friction was reduced from 0.55 for an uncoated alloy to 0.40 and 0.12 for a coated alloy in a dry sliding and sliding in Ringer's solution, respectively. The PEEK coatings exhibited excellent wear resistance in both contact conditions. Their wear rate was more than 200 times smaller compared with the wear rate of the uncoated Ti-13Nb-13Zr alloy. The obtained results indicate that electrophoretically deposited PEEK coatings on the near-β titanium alloy exhibit very useful properties for their prospective tribological applications in medicine. PMID:27040195

  7. Large irreversible non-180° domain switching after poling treatment in Pb(Zr, Ti)O3 films

    NASA Astrophysics Data System (ADS)

    Ehara, Yoshitaka; Yasui, Shintaro; Oikawa, Takahiro; Shiraishi, Takahisa; Oshima, Naoya; Yamada, Tomoaki; Imai, Yasuhiko; Sakata, Osami; Funakubo, Hiroshi

    2016-05-01

    (11 1 ¯ )/(111)-oriented rhombohedral Pb(Zr0.65Ti0.35)O3 films with different domain fractions were epitaxially grown on various single crystals. The volume fraction of (111)-polar-axis oriented domains in as-deposited films, Vpol.(as-depo.), was controlled by selecting a single crystal substrate with a different thermal expansion coefficient. Applying an electric field, referred to as "poling treatment", resulted in irreversible non-180° domain switching from the (11 1 ¯ )-oriented domain (non-polar-axis) to the (111)-oriented domain (polar-axis), which was observed by synchrotron X-ray diffraction. Remanent polarization (Pr) values were higher than those estimated using the proportional relationship with Vpol.(as-depo.). However, the experimental Pr values were in good agreement with the values estimated using the volume fraction of (111)-oriented domains after applying the poling treatment. In rhombohedral Pb(Zr0.65Ti0.35)O3 films, 30%-50% of the (11 1 ¯ )-oriented domains switched irreversibly to (111)-oriented domains as a result of the poling treatment. The present results show that the domain structures of films may change dramatically after the poling process, and both before and after the poling state should be characterized in order to interpret polarization and piezoelectric behaviors. This study helps to clarify the ferroelectric and piezoelectric properties of Pb(Zr, Ti)O3 films after poling treatment.

  8. Phase equilibria and elements partitioning in zirconolite-rich region of Ca-Zr-Ti-Al-Gd-Si-O system

    SciTech Connect

    Knyazev, O.A.; Stefanovsky, S.V.; Ioudintsev, S.V.; Nikonov, B.S.; Omelianenko, B.I.; Mokhov, A.V.; Yakushev, A.I.

    1997-12-31

    Zirconolite-rich ceramics were produced by the cold crucible melting technique in an air atmosphere, at 1550 {+-} 50 C and 1 atm. Four samples with overall composition (in wt.%): 4.9-14.3 CaO; 19.0-41.3 ZrO{sub 2}; 24.1-42.6 TiO{sub 2}; 1.3-11.3 Al{sub 2}O{sub 3}; 6.8-30.0 Gd{sub 2}O{sub 3}; and 1.1-8.5 SiO{sub 2} have been studied. Total phases in the ceramics consist of major zirconolite and minor rutile, perovskite, zirconia, aluminium titanate, and glass. The Gd{sub 2}O{sub 3} content in zirconolite reaches up to 31.4 wt.% corresponding to the formula: (Ca{sub 0.4},Gd{sub 0.7})Zr{sub 1.0}(Ti{sub 1.4},Al{sub 0.5})O{sub 7.0}. The data on the phase composition agree well with coupled Gd incorporation into the mineral structure: Ca(II) + Ti(IV) = Gd(III) + Al(III), and 2Gd(III) = Ca(II) + Zr(IV). The highest Gd contents observed in the other phases are 25.4% for zirconia, 12.6% in glass, 8.8% in perovskite, and 1.4% for rutile. The rest of the elements` distribution in the samples are analyzed.

  9. Effect of structural evolution on mechanical properties of ZrO2 coated Ti-6Al-7Nb-biomedical application

    NASA Astrophysics Data System (ADS)

    Zalnezhad, E.

    2016-05-01

    Zirconia (ZrO2) nanotube arrays were fabricated by anodizing pure zirconium (Zr) coated Ti-6Al-7Nb in fluoride/glycerol electrolyte at a constant potential of 60 V for different times. Zr was deposited atop Ti-6Al-7Nb via a physical vapor deposition magnetron sputtering (PVDMS) technique. Structural investigations of coating were performed utilizing X-ray diffraction (XRD) analysis. Field emission scanning electron microscopy (FESEM) and atomic force microscopy (AFM) were used to characterize the morphology and microstructure of coatings. Unannealed ZrO2 nanotube arrays were amorphous. Monoclinic and tetragonal ZrO2 appeared when the coated substrates were heat treated at 450 °C and 650 °C, while monoclinic ZrO2 was found at 850 °C and 900 °C. Mechanical properties, including nanohardness and modulus of elasticity, were evaluated at different annealing temperatures using a nanoindentation test. The nanoindentation results show that the nanohardness and modulus of elasticity for Ti-6AL-7Nb increased by annealing ZrO2 coated substrate at 450 °C. The nanohardness and modulus of elasticity for coated substrate decreased with annealing temperatures of 650, 850, and 900 °C. At an annealing temperature of 900 °C, cracks in the ZrO2 thin film coating occurred. The highest nanohardness and elastic modulus values of 6.34 and 218 GPa were achieved at an annealing temperature of 450 °C.

  10. Comparative characteristics of the mineralogical composition of Ti-Zr potential placer district

    NASA Astrophysics Data System (ADS)

    Ovchinnikova, Mary

    2016-04-01

    Russia has a great off-balance reserves of TiO2 and it is ranked fourth in the world after Ukraine, China and Australia. Inferred resources are also very significant. But today Russia produces titanium products only from imported raw materials. Exploration of Ti-raw material is carried out in Russia only as passing on comprehensive deposits. As a result of work conducted in 1959, Stavropolsky elevation was discovered Stavropolsky Ti-Zr alluvial basin. The same mineralogical composition has Ti-Zr Ergeninsky potential alluvial district, which is located north-eastern of Stavropolsky littoral basin. Administratively, Ergeninsky area, basically, covers territory of Kalmikia, and partially Rostovsky and Volgogradsky area. In terms of tectonics, it occupies an area of the junction of the East European platform and Karpinsky Ridge. Alluvial basin holds really magnificent range. There are two hypotheses as to where was the demolition of ore sand. According to the first demolition of the original ore material was from crumbling crystalline rocks southern East European platform. The second hypothesis links the formation of these placers due to the erosion of crystalline basement rocks of the Greater Caucasus, which is explained by the fact of the existence of the Sarmatian paleo sea. There are two productive horizons on the territory of Ergeninsky potential placer district. First - the lower productive horizon it has a capacity of 1.5 to 6.3 m and the total content of titanium and zirconium minerals 12 to 66 kg m³. Second - upper productive horizon. 1.5 to 4.3 m and the total content of titanium and zirconium minerals from 21 to 50 kg m³. Earlier in the study of the area, only samples from the upper productive horizon were considered. At the beginning petrophysical analysis of all available samples, was conducted. Before you choose a basic test, each of the 26 studied several petrophysical properties: 1. Magnetic susceptibility (κ, 10-5 units. C) 2. The density (d, g / cm

  11. Improvement of bio-corrosion resistance for Ti42Zr40Si15Ta3 metallic glasses in simulated body fluid by annealing within supercooled liquid region.

    PubMed

    Huang, C H; Lai, J J; Wei, T Y; Chen, Y H; Wang, X; Kuan, S Y; Huang, J C

    2015-01-01

    The effects of the nanocrystalline phases on the bio-corrosion behavior of highly bio-friendly Ti42Zr40Si15Ta3 metallic glasses in simulated body fluid were investigated, and the findings are compared with our previous observations from the Zr53Cu30Ni9Al8 metallic glasses. The Ti42Zr40Si15Ta3 metallic glasses were annealed at temperatures above the glass transition temperature, Tg, with different time periods to result in different degrees of α-Ti nano-phases in the amorphous matrix. The nanocrystallized Ti42Zr40Si15Ta3 metallic glasses containing corrosion resistant α-Ti phases exhibited more promising bio-corrosion resistance, due to the superior pitting resistance. This is distinctly different from the previous case of the Zr53Cu30Ni9Al8 metallic glasses with the reactive Zr2Cu phases inducing serious galvanic corrosion and lower bio-corrosion resistance. Thus, whether the fully amorphous or partially crystallized metallic glass would exhibit better bio-corrosion resistance, the answer would depend on the crystallized phase nature.

  12. Role of Hf on Phase Formation in Ti45Zr(38-x)Hf(x)Ni17 Liquids and Solids

    NASA Technical Reports Server (NTRS)

    Wessels, V.; Sahu, K. K.; Gangopadhyay, A. K.; Huett, V. T.; Canepari, S.; Goldman, A. I.; Hyers, R. W.; Kramer, M. J.; Rogers, J. R.; Kelton, K. F.; Robinson, D.

    2008-01-01

    Hafnium and zirconium are very similar, with almost identical sizes and chemical bonding characteristics. However, they behave differently when alloyed with Ti and Ni. A sharp phase formation boundary near 18-21 at.% Hf is observed in rapidly-quenched and as-cast Ti45Zr38-xHfxNi17 alloys. Rapidly-quenched samples that contain less than 18 at.% Hf form the icosahedral quasicrystal phase, whiles samples containing more than 21 at.% form the 3/2 rational approximant phase. In cast alloys, a C14 structure is observed for alloys with Hf lower than the boundary concentration, while a large-cell (11.93 ) FCC Ti2Ni-type structure is found in alloys with Hf concentrations above the boundary. To better understand the role of Hf on phase formation, the structural evolution with supercooling and the solidification behavior of liquid Ti45Zr38-xHfxNi17 alloys (x=0, 12, 18, 21, 38) were studied using the Beamline Electrostatic Levitation (BESL) technique using 125keV x-rays on the 6ID-D beamline at the Advanced Photon Source, Argonne National Laboratory. For all liquids primary crystallization was to a BCC solid solution phase; interestly, an increase in Hf concentration leads to a decrease in the BCC lattice parameter in spite of the chemical similarity between Zr and Hf. A Reitveld analysis confirmed that as in the cast alloys, the secondary phase that formed was the C14 below the phase formation boundary and a Ti2Ni-type structure at higher Hf concentrations. Both the liquidus temperature and the reduced undercooling change sharply on traversing the phase formation boundary concentration, suggesting a change in the liquid structure. Structural information from a Honeycutt-Anderson index analysis of reverse Monte Carlo fits to the S(q) liquid data will be presented to address this issue.

  13. Efficiency enhancement of dye-sensitized solar cells by use of ZrO2-doped TiO2 nanofibers photoanode.

    PubMed

    Mohamed, Ibrahim M A; Dao, Van-Duong; Barakat, Nasser A M; Yasin, Ahmed S; Yousef, Ahmed; Choi, Ho-Suk

    2016-08-15

    Due to the good stability and convenient optical properties, TiO2 nanostructures still the prominent photoanode materials in the Dye Sensitized Solar Cells (DSCs). However, the well-known low bandgap energy and weak adsorption affinity for the dye distinctly constrain the wide application. This work discusses the impact of Zr-doping and nanofibrous morphology on the performance and physicochemical properties of TiO2. Zr-doped TiO2 nanofibers (NFs), with various zirconia content (0, 0.5, 1, 1.5 and 2wt%) were prepared by calcination of electrospun mats composed of polyvinyl acetate, titanium isopropoxyl and zirconium n-propoxyl. For all formulations, the results have shown that the prepared materials are continuous, randomly oriented, and good morphology nanofibers. The average diameter decreased from 353.85nm to 210.78nm after calcination without a considerable influence on the nanofibrous structure regardless the zirconia content. XRD result shows that there is no Rutile nor Brookite phases in the obtained material and the average crystallite size of the sample is affected by the presence of Zr-doping and changed from 23.01nm to 37.63nm for TiO2 and Zr-doped TiO2, respectively. Optical studies have shown Zr-doped TiO2 NFs have more absorbance in the visible region than that of pristine TiO2 NFs; the maximum absorbance is corresponding to the NFs having 1wt% zirconia. The improved spectra of Zr-doped TiO2 in the visible region is attributed to the heterostructure composition resulting from Zr-doping. The absorption bandgaps were calculated using Tauc model as 3.202 and 3.217 for pristine and Zr (1wt%)-doped TiO2 NFs, respectively. Furthermore, in Dye-sensitized Solar Cells, utilizing Zr (1wt%)-doped TiO2 nanofibers achieved higher efficiency of 4.51% compared to the 1.61% obtained from the pristine TiO2 NFs.

  14. Preparation of (001)-oriented Pb(Zr,Ti)O3 thin films and their piezoelectric applications.

    PubMed

    Fujii, Eiji; Takayama, Ryoichi; Nomura, Kouji; Murata, Akiko; Hirasawa, Taku; Tomozawa, Atsushi; Fujii, Satoru; Kamada, Takeshi; Torii, Hideo

    2007-12-01

    Preparation of (001)-oriented Pb(Zr,Ti)O(3) (PZT) thin films and their applications to a sensor and actuators were investigated. These thin films, which have a composition close to the morphotropic phase boundary, were epitaxially grown on (100)MgO single-crystal substrates by RF magnetron sputtering. These (001)-oriented PZT thin films could be obtained on various kinds of substrates, such as glass and Si, by introducing (100)-oriented MgO buffer layers. In addition, the (001) oriented PZT thin films could be obtained on Si substrates without buffer layers by optimizing the sputtering conditions. All of these thin films showed excellent piezoelectric properties without the need for poling treatment. The PZT thin films on the MgO substrates had a high piezoelectric coefficient, d(31), of -100 pm/V, and an extremely low relative dielectric constant, epsilon(r), of 240. The PZT thin films on Si substrate had a very high d(31) of -150 pm/V and an epsilon(r) = 700. These PZT thin films were applied to an angular rate sensor with a tuning fork in a car navigation system, to a dual-stage actuator for positioning the magnetic head of a high-density hard disk drive, and to an actuator for an inkjet printer head for industrial on-demand printers.

  15. Subterahertz dielectric relaxation in lead-free Ba(Zr,Ti)O3 relaxor ferroelectrics

    PubMed Central

    Wang, D.; Bokov, A. A.; Ye, Z.-G.; Hlinka, J.; Bellaiche, L.

    2016-01-01

    Relaxors are complex materials with unusual properties that have been puzzling the scientific community since their discovery. The main characteristic of relaxors, that is, their dielectric relaxation, remains unclear and is still under debate. The difficulty to conduct measurements at frequencies ranging from ≃1 GHz to ≃1 THz and the challenge of developing models to capture their complex dynamical responses are among the reasons for such a situation. Here, we report first-principles-based molecular dynamic simulations of lead-free Ba(Zr0.5Ti0.5)O3, which allows us to obtain its subterahertz dynamics. This approach reproduces the striking characteristics of relaxors including the dielectric relaxation, the constant-loss behaviour, the diffuse maximum in the temperature dependence of susceptibility, the substantial widening of dielectric spectrum on cooling and the resulting Vogel–Fulcher law. The simulations further relate such features to the decomposed dielectric responses, each associated with its own polarization mechanism, therefore, enhancing the current understanding of relaxor behaviour. PMID:27040174

  16. Néel-like domain walls in ferroelectric Pb(Zr,Ti)O3 single crystals

    PubMed Central

    Wei, Xian-Kui; Jia, Chun-Lin; Sluka, Tomas; Wang, Bi-Xia; Ye, Zuo-Guang; Setter, Nava

    2016-01-01

    In contrast to the flexible rotation of magnetization direction in ferromagnets, the spontaneous polarization in ferroelectric materials is highly confined along the symmetry-allowed directions. Accordingly, chirality at ferroelectric domain walls was treated only at the theoretical level and its real appearance is still a mystery. Here we report a Néel-like domain wall imaged by atom-resolved transmission electron microscopy in Ti-rich ferroelectric Pb(Zr1−xTix)O3 crystals, where nanometre-scale monoclinic order coexists with the tetragonal order. The formation of such domain walls is interpreted in the light of polarization discontinuity and clamping effects at phase boundaries between the nesting domains. Phase-field simulation confirms that the coexistence of both phases as encountered near the morphotropic phase boundary promotes the polarization to rotate in a continuous manner. Our results provide a further insight into the complex domain configuration in ferroelectrics, and establish a foundation towards exploring chiral domain walls in ferroelectrics. PMID:27539075

  17. Ultrasonically assisted turning of Ti-6Al-2Sn-4Zr-6Mo

    NASA Astrophysics Data System (ADS)

    Muhammad, R.; Maurotto, A.; Roy, A.; Silberschmidt, V. V.

    2012-08-01

    Titanium alloys are widely used in the aerospace and offshore industries due to their high strength-to-weight ratio sustained at elevated temperatures, their fracture-resistance features and exceptionally good corrosion-resistance properties. However, poor thermal conductivity and high chemical affinity of these alloys to tool materials severely impair their machinability. As a result the machining processes of titanium alloys are typically characterized by low cutting feeds and speeds making production of components uneconomical. Recently, a non-conventional hybrid machining technique, namely, ultrasonically assisted turning has been shown to significantly improve the machinability of intractable alloys with a concomitant improvement in material removal rates, thus improving machining economics. In the current work, a 3D finite element model of turning of Ti-6Al-2Sn-4Zr-6Mo is developed in the commercial software, MSC Marc/Mentat. A constitutive behaviour of the workpiece material under large deformations and elevated temperatures is adequately represented by a Johnson-Cook material model. For validation of the developed numerical model, experimental tests were carried out. The numerical and experimental results were found to be in good agreement.

  18. Wear and corrosion behavior of oxygen implanted biomedical titanium alloy Ti-13Nb-13Zr

    NASA Astrophysics Data System (ADS)

    Mohan, L.; Anandan, C.

    2013-10-01

    Titanium alloy Ti-13Nb-13Zr was implanted with oxygen ions by plasma immersion ion implantation. The influence of oxygen ion implantation on the growth of apatite on the implanted sample was investigated by immersion in Hanks’ solution and also by potentiodynamic polarization studies in Hanks’ solution. XRD shows the formation of mainly anatase form of oxide. FESEM images of immersion tested samples show that growth of apatite is more with larger sized deposits on oxygen implanted surface as compared to that on the untreated substrate. XPS investigation of corrosion tested and 1 day immersed samples show higher amount of calcium, phosphorous and oxygen in hydroxide/phosphate form on the oxygen implanted sample. EDS results also confirm higher concentration of Ca and P on oxygen implanted sample. Polarization and electrochemical impedance spectroscopy studies show that the oxygen implanted layer behaves like a nearly ideal capacitor with better passivation characteristics. In sliding wear studies, the implanted layers displayed a lower friction coefficient as compared to the substrate one.

  19. Structural transformations and disordering in zirconolite (CaZrTi2O7) at high pressure.

    PubMed

    Salamat, Ashkan; McMillan, Paul F; Firth, Steven; Woodhead, Katherine; Hector, Andrew L; Garbarino, Gaston; Stennett, Martin C; Hyatt, Neil C

    2013-02-01

    There is interest in identifying novel materials for use in radioactive waste applications and studying their behavior under high pressure conditions. The mineral zirconolite (CaZrTi(2)O(7)) exists naturally in trace amounts in diamond-bearing deep-seated metamorphic/igneous environments, and it is also identified as a potential ceramic phase for radionuclide sequestration. However, it has been shown to undergo radiation-induced metamictization resulting in amorphous forms. In this study we probed the high pressure structural properties of this pyrochlore-like structure to study its phase transformations and possible amorphization behavior. Combined synchrotron X-ray diffraction and Raman spectroscopy studies reveal a series of high pressure phase transformations. Starting from the ambient pressure monoclinic structure, an intermediate phase with P2(1)/m symmetry is produced above 15.6 GPa via a first order transformation resulting in a wide coexistence range. Upon compression to above 56 GPa a disordered metastable phase III with a cotunnite-related structure appears that is recoverable to ambient conditions. We examine the similarity between the zirconolite behavior and the structural evolution of analogous pyrochlore systems under pressure. PMID:23339518

  20. Subterahertz dielectric relaxation in lead-free Ba(Zr,Ti)O3 relaxor ferroelectrics

    NASA Astrophysics Data System (ADS)

    Wang, D.; Bokov, A. A.; Ye, Z.-G.; Hlinka, J.; Bellaiche, L.

    2016-04-01

    Relaxors are complex materials with unusual properties that have been puzzling the scientific community since their discovery. The main characteristic of relaxors, that is, their dielectric relaxation, remains unclear and is still under debate. The difficulty to conduct measurements at frequencies ranging from ~=1 GHz to ~=1 THz and the challenge of developing models to capture their complex dynamical responses are among the reasons for such a situation. Here, we report first-principles-based molecular dynamic simulations of lead-free Ba(Zr0.5Ti0.5)O3, which allows us to obtain its subterahertz dynamics. This approach reproduces the striking characteristics of relaxors including the dielectric relaxation, the constant-loss behaviour, the diffuse maximum in the temperature dependence of susceptibility, the substantial widening of dielectric spectrum on cooling and the resulting Vogel-Fulcher law. The simulations further relate such features to the decomposed dielectric responses, each associated with its own polarization mechanism, therefore, enhancing the current understanding of relaxor behaviour.

  1. An Ultrasonic Study of Hydrogen Motion in a Ti-Zr-Ni Quasicrystalline Material

    NASA Astrophysics Data System (ADS)

    Hightower, J. E.; Foster, K.; Leisure, R. G.; Kim, J. Y.; Kelton, K. F.

    2000-09-01

    Previous ultrasonic attenuation measurements^1 for a Ti-Zr-Ni quasicrystalline material have been extended to cover a temperature range up to 425K. The samples were charged to a hydrogen to metal ratio of 0.79 for the quasicrystal and 0.20 for the related crystalline approximant. Hydrogen motion within these materials causes a peak in the ultrasonic loss as a function of temperature. The present higher temperature measurements complement the previous data and give a more reliable determination of the parameters of the hydrogen motion. The results suggest that the hydrogen motion is about an order of magnitude faster in the quasicrystal than in the approximant. The current measurements cannot determine whether this is due to basic differences between the two materials or to hydrogen concentration dependence. The research at Colorado State University was supported by NSF Grant No. DMR-0070808. The work at Washington University was supported by NSF Grant No. DMR-9705202. ^1K. Foster, R. G. Leisure, J. B. Shaklee, J. Y. Kim, and K. F. Kelton, Phys. Rev. B 61, 241 (2000).

  2. Anomalous polarization switching related to grain size in Pb(Zr,Ti)O3 polycrystalline films

    NASA Astrophysics Data System (ADS)

    Guo, Huifen; Cheng, Gang; Yong, Yongliang; Li, Liben

    2016-04-01

    Pb(Zr,Ti)O3 films of various grain size were prepared by the sol-gel technique. X-ray diffraction results show that these films are of single tetragonal phase with no evidence of preferential orientation. Anomalous polarization switching (APS) was induced in the films with average grain size ~150 nm by using the tip of a scanning force microscope. After scanning an area by the tip with constant poling parameter, the polarization of some grains orient opposite to the applied electric field irrespective of applied field polarity, exhibiting APS; while the rest switch in a normal way. The ratio of the APS grains to the total number decreases with the decrease of average grain size. Pulse poling experiments reveal that APS is likely to be related to the intrinsic characteristic of grains. Control experiments of poling (during and after) exclude backswitching after the removal of the external field due to the charge injection effect or the built-in field; both of which are possible reasons for APS. It is suggested that coupling between the temporary stress created in grains during field-induced normal switching and the applied field probably plays a key role in APS.

  3. Néel-like domain walls in ferroelectric Pb(Zr,Ti)O3 single crystals

    NASA Astrophysics Data System (ADS)

    Wei, Xian-Kui; Jia, Chun-Lin; Sluka, Tomas; Wang, Bi-Xia; Ye, Zuo-Guang; Setter, Nava

    2016-08-01

    In contrast to the flexible rotation of magnetization direction in ferromagnets, the spontaneous polarization in ferroelectric materials is highly confined along the symmetry-allowed directions. Accordingly, chirality at ferroelectric domain walls was treated only at the theoretical level and its real appearance is still a mystery. Here we report a Néel-like domain wall imaged by atom-resolved transmission electron microscopy in Ti-rich ferroelectric Pb(Zr1-xTix)O3 crystals, where nanometre-scale monoclinic order coexists with the tetragonal order. The formation of such domain walls is interpreted in the light of polarization discontinuity and clamping effects at phase boundaries between the nesting domains. Phase-field simulation confirms that the coexistence of both phases as encountered near the morphotropic phase boundary promotes the polarization to rotate in a continuous manner. Our results provide a further insight into the complex domain configuration in ferroelectrics, and establish a foundation towards exploring chiral domain walls in ferroelectrics.

  4. Mechanical and corrosion resistance of a new nanostructured Ti-Zr-Ta-Nb alloy.

    PubMed

    Raducanu, D; Vasilescu, E; Cojocaru, V D; Cinca, I; Drob, P; Vasilescu, C; Drob, S I

    2011-10-01

    In this work, a multi-elementary Ti-10Zr-5Nb-5Ta alloy, with non-toxic alloying elements, was used to develop an accumulative roll bonding, ARB-type procedure in order to improve its structural and mechanical properties. The alloy was obtained by cold crucible semi-levitation melting technique and then was ARB deformed following a special route. After three ARB cycles, the total deformation degree per layer is about 86%; the calculated medium layer thickness is about 13 μm. The ARB processed alloy has a low Young's modulus of 46 GPa, a value very close to the value of the natural cortical bone (about 20 GPa). Data concerning ultimate tensile strength obtained for ARB processed alloy is rather high, suitable to be used as a material for bone substitute. Hardness of the ARB processed alloy is higher than that of the as-cast alloy, ensuring a better behaviour as a implant material. The tensile curve for the as-cast alloy shows an elastoplastic behaviour with a quite linear elastic behaviour and the tensile curve for the ARB processed alloy is quite similar with a strain-hardening elastoplastic body. Corrosion behaviour of the studied alloy revealed the improvement of the main electrochemical parameters, as a result of the positive influence of ARB processing. Lower corrosion and ion release rates for the ARB processed alloy than for the as-cast alloy, due to the favourable effect of ARB thermo-mechanical processing were obtained. PMID:21783152

  5. Matrix isolation spectra of metal atoms and ions: Ti, Zr, and Mo in Ar and Kr

    NASA Astrophysics Data System (ADS)

    Steinbrüchel, Christoph; Gruen, Dieter M.

    1981-01-01

    UV-absorption spectra are reported of neutral atoms and ions of Ti, Zr, and Mo in Ar and Kr matrices. The matrix-isolated species are produced by ion bombardment of a bulk metal target. Thermal and photoannealing experiments indicate that sputtered neutral atoms may occupy one or two distinct matrix sites, depending on the system. Sputtered ions, after being neutralized in the matrix, either go preferentially into the higher energy site, i.e., the site whose absorption bands are shifted farther to the blue, when atoms already populate two sites, or they create a new site at higher energy when there is only one site for atoms. Deconvolution of matrix isolation spectra into contributions from individual sites shows that spectra due to atoms in a particular site correspond much better to gas phase spectra than do total matrix isolation spectra. Matrix shifts of atomic absorption bands for both sites can be rationalized using a model by McCarty and Robinson if allowance is made for matrix distortion around solute atoms. The blue, or close-packed, site is found to correspond to a solute atom replacing a single matrix atom without inducing appreciable matrix distortion, whereas the red, or expanded, site requires the cage around a solute atom to be enlarged by a few percent.

  6. Mechanical and corrosion resistance of a new nanostructured Ti-Zr-Ta-Nb alloy.

    PubMed

    Raducanu, D; Vasilescu, E; Cojocaru, V D; Cinca, I; Drob, P; Vasilescu, C; Drob, S I

    2011-10-01

    In this work, a multi-elementary Ti-10Zr-5Nb-5Ta alloy, with non-toxic alloying elements, was used to develop an accumulative roll bonding, ARB-type procedure in order to improve its structural and mechanical properties. The alloy was obtained by cold crucible semi-levitation melting technique and then was ARB deformed following a special route. After three ARB cycles, the total deformation degree per layer is about 86%; the calculated medium layer thickness is about 13 μm. The ARB processed alloy has a low Young's modulus of 46 GPa, a value very close to the value of the natural cortical bone (about 20 GPa). Data concerning ultimate tensile strength obtained for ARB processed alloy is rather high, suitable to be used as a material for bone substitute. Hardness of the ARB processed alloy is higher than that of the as-cast alloy, ensuring a better behaviour as a implant material. The tensile curve for the as-cast alloy shows an elastoplastic behaviour with a quite linear elastic behaviour and the tensile curve for the ARB processed alloy is quite similar with a strain-hardening elastoplastic body. Corrosion behaviour of the studied alloy revealed the improvement of the main electrochemical parameters, as a result of the positive influence of ARB processing. Lower corrosion and ion release rates for the ARB processed alloy than for the as-cast alloy, due to the favourable effect of ARB thermo-mechanical processing were obtained.

  7. Vanadium Oxide Thin Films Alloyed with Ti, Zr, Nb, and Mo for Uncooled Infrared Imaging Applications

    NASA Astrophysics Data System (ADS)

    Ozcelik, Adem; Cabarcos, Orlando; Allara, David L.; Horn, Mark W.

    2013-05-01

    Microbolometer-grade vanadium oxide (VO x ) thin films with 1.3 < x < 2.0 were prepared by pulsed direct-current (DC) sputtering using substrate bias in a controlled oxygen and argon environment. These films were systematically alloyed with Ti, Nb, Mo, and Zr using a second gun and radiofrequency (RF) reactive co-sputtering to probe the effects of the transition metals on the film charge transport characteristics. The results reveal that the temperature coefficient of resistance (TCR) and resistivity are unexpectedly similar for alloyed and unalloyed films up to alloy compositions in the ˜20 at.% range. Analysis of the film structures for the case of the 17% Nb-alloyed film by glancing-angle x-ray diffraction and transmission electron microscopy shows that the microstructure remains even with the addition of high concentrations of alloy metal, demonstrating the robust character of the VO x films to maintain favorable electrical transport properties for bolometer applications. Postdeposition thermal annealing of the alloyed VO x films further reveals improvement of electrical properties compared with unalloyed films, indicating a direction for further improvements in the materials.

  8. Néel-like domain walls in ferroelectric Pb(Zr,Ti)O3 single crystals.

    PubMed

    Wei, Xian-Kui; Jia, Chun-Lin; Sluka, Tomas; Wang, Bi-Xia; Ye, Zuo-Guang; Setter, Nava

    2016-01-01

    In contrast to the flexible rotation of magnetization direction in ferromagnets, the spontaneous polarization in ferroelectric materials is highly confined along the symmetry-allowed directions. Accordingly, chirality at ferroelectric domain walls was treated only at the theoretical level and its real appearance is still a mystery. Here we report a Néel-like domain wall imaged by atom-resolved transmission electron microscopy in Ti-rich ferroelectric Pb(Zr1-xTix)O3 crystals, where nanometre-scale monoclinic order coexists with the tetragonal order. The formation of such domain walls is interpreted in the light of polarization discontinuity and clamping effects at phase boundaries between the nesting domains. Phase-field simulation confirms that the coexistence of both phases as encountered near the morphotropic phase boundary promotes the polarization to rotate in a continuous manner. Our results provide a further insight into the complex domain configuration in ferroelectrics, and establish a foundation towards exploring chiral domain walls in ferroelectrics. PMID:27539075

  9. Evaluation of Ti-Zr-V (NEG) Thin Films for their pumping speed and pumping Capacity

    NASA Astrophysics Data System (ADS)

    Bansod, Tripti; Sindal, B. K.; Kumar, K. V. A. N. P. S.; Shukla, S. K.

    2012-11-01

    Deposition of NEG thin films onto the interior walls of the vacuum chambers is an advanced technique to convert a vacuum chamber from a gas source to an effective pump. These films offer considerably large pumping speed for reactive gases like CO, H2 etc. A UHV compatible pumping speed measurement system was developed in-house to measure the pumping speed of NEG coated chambers. To inject the fixed quantity of CO and H2 gas in pumping speed measurement set-up a calibrated leak was also developed. Stainless steel chambers were sputter coated with thin film of Ti-Zr-V getter material using varied parameters for different compositions and thickness. Pumping capacity which is a function of sorbed gas quantities was also studied at various activation temperatures. In order to optimize the activation temperature for maximum pumping speed for CO and H2, pumping speeds were measured at room temperature after activation at different temperatures. The experimental system detail, pumping performance of the NEG film at various activation temperatures and RGA analysis are presented.

  10. Coexistence of diode-like volatile and multilevel nonvolatile resistive switching in a ZrO2/TiO2 stack structure

    NASA Astrophysics Data System (ADS)

    Li, Yingtao; Yuan, Peng; Fu, Liping; Li, Rongrong; Gao, Xiaoping; Tao, Chunlan

    2015-10-01

    Diode-like volatile resistive switching as well as nonvolatile resistive switching behaviors in a Cu/ZrO2/TiO2/Ti stack are investigated. Depending on the current compliance during the electroforming process, either volatile resistive switching or nonvolatile resistive switching is observed. With a lower current compliance (<10 μA), the Cu/ZrO2/TiO2/Ti device exhibits diode-like volatile resistive switching with a rectifying ratio over 106. The permanent transition from volatile to nonvolatile resistive switching can be obtained by applying a higher current compliance of 100 μA. Furthermore, by using different reset voltages, the Cu/ZrO2/TiO2/Ti device exhibits multilevel memory characteristics with high uniformity. The coexistence of nonvolatile multilevel memory and diode-like volatile resistive switching behaviors in the same Cu/ZrO2/TiO2/Ti device opens areas of applications in high-density storage, logic circuits, neural networks, and passive crossbar memory selectors.

  11. Coexistence of diode-like volatile and multilevel nonvolatile resistive switching in a ZrO2/TiO2 stack structure.

    PubMed

    Li, Yingtao; Yuan, Peng; Fu, Liping; Li, Rongrong; Gao, Xiaoping; Tao, Chunlan

    2015-10-01

    Diode-like volatile resistive switching as well as nonvolatile resistive switching behaviors in a Cu/ZrO₂/TiO₂/Ti stack are investigated. Depending on the current compliance during the electroforming process, either volatile resistive switching or nonvolatile resistive switching is observed. With a lower current compliance (<10 μA), the Cu/ZrO₂/TiO₂/Ti device exhibits diode-like volatile resistive switching with a rectifying ratio over 10(6). The permanent transition from volatile to nonvolatile resistive switching can be obtained by applying a higher current compliance of 100 μA. Furthermore, by using different reset voltages, the Cu/ZrO₂/TiO₂/Ti device exhibits multilevel memory characteristics with high uniformity. The coexistence of nonvolatile multilevel memory and diode-like volatile resistive switching behaviors in the same Cu/ZrO₂/TiO₂/Ti device opens areas of applications in high-density storage, logic circuits, neural networks, and passive crossbar memory selectors.

  12. Linking large piezoelectric coefficients to highly flexible polarization of lead free BaTiO3-CaTiO3-BaZrO3 ceramics

    NASA Astrophysics Data System (ADS)

    Benabdallah, F.; Simon, A.; Khemakhem, H.; Elissalde, C.; Maglione, M.

    2011-06-01

    We report a large d31 piezoelectric coefficient and corresponding electromechanical coupling factor, Kp, of 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 (BCTZ50) and 0.68Ba(Zr0.2Ti0.8)O3-0.32(Ba0.7Ca0.3)TiO3 (BCTZ32) lead-free piezoceramics. The piezoelectric coefficient, d31, reaches a high value of 200 pC/N for BCTZ50 at room temperature which is comparable to the one of the soft PZT. This confirms the previously reported d33 for the same material. A useful way to achieve such performances at the expense of a smaller thermal budget is suggested, enabling better control of the ceramics composition and microstructure. Based on pyroelectric and ferroelectric hysteresis loops measurements, we show that such outstanding properties are likely due to the high flexibility of polarization under thermal and electric stresses.

  13. Polarization switching dynamics in thin-film BaTiO3/PbZr0.2Ti0.8O3 bilayer capacitors

    NASA Astrophysics Data System (ADS)

    Salev, Pavel; Grigoriev, Alexei

    2013-03-01

    In this work, we compare polarization switching and dielectric properties of single- (PbZr0.2Ti0.8O3 (PZT)) and bi-layer (BaTiO3/PbZr0.2Ti0.8O3 (BTO/PZT)) ferroelectric thin-film materials. The ferroelectric films were grown by radio-frequency magnetron sputtering on SrRuO3/SrTiO3 (001) substrates. Pt top electrodes ranging in diameter from 50 um to 200 um were fabricated on top of ferroelectric films. Electrical measurements of switching dynamics and dielectric response revealed a significant difference in polarization switching between single- and bi-layer capacitors. Average remnant polarization in the bilayer was reduced to 60 uC/cm2 from 90 uC/cm2 polarization in a single layer capacitor, and the switching speed was reduced significantly. In this presentation, we will discuss effects of interfaces and polarization coupling on polarization dynamics and on the dielectric response in ferroelectric multilayers.

  14. Evaluation of antibacterial activity and osteoblast-like cell viability of TiN, ZrN and (Ti1-xZrx)N coating on titanium

    PubMed Central

    Park, Sang-Won; Lee, Kwangmin; Kang, In-Chol; Kim, Hyun-Seung

    2015-01-01

    PURPOSE The aim of this study was to evaluate antibacterial activity and osteoblast-like cell viability according to the ratio of titanium nitride and zirconium nitride coating on commercially pure titanium using an arc ion plating system. MATERIALS AND METHODS Polished titanium surfaces were used as controls. Surface topography was observed by scanning electron microscopy, and surface roughness was measured using a two-dimensional contact stylus profilometer. Antibacterial activity was evaluated against Streptococcus mutans and Porphyromonas gingivalis with the colony-forming unit assay. Cell compatibility, mRNA expression, and morphology related to human osteoblast-like cells (MG-63) on the coated specimens were determined by the XTT assay and reverse transcriptase-polymerase chain reaction. RESULTS The number of S. mutans colonies on the TiN, ZrN and (Ti1-xZrx)N coated surface decreased significantly compared to those on the non-coated titanium surface (P<0.05). CONCLUSION The number of P. gingivalis colonies on all surfaces showed no significant differences. TiN, ZrN and (Ti1-xZrx)N coated titanium showed antibacterial activity against S. mutans related to initial biofilm formation but not P. gingivalis associated with advanced periimplantitis, and did not influence osteoblast-like cell viability. PMID:25932316

  15. High temperature stability of the dielectric and insulating properties of Ca(Ti, Zr)SiO5 ceramics

    NASA Astrophysics Data System (ADS)

    Kimura, Junichi; Taniguchi, Hiroki; Iijima, Takashi; Shimizu, Takao; Yasui, Shintaro; Itoh, Mitsuru; Funakubo, Hiroshi

    2016-02-01

    Useful dielectric properties for high-temperature ceramic capacitors are demonstrated in a non-perovskite oxide, Ca(Ti0.85 Zr0.15)SiO5, which is mainly composed of one-dimensional chains of oxygen octahedra that are mutually linked by SiO4 tetrahedra. Its dielectric constant and low temperature coefficient of capacitance were found to be 43 and -102 ppm/K, respectively, over the wide temperature range of 300-780 K. The high insulating performance was also indicated by the high resistivity, exceeding 1011 Ω cm up to 523 K. The systematic dielectric measurements for Ca(Ti1-x Zrx)SiO5 as functions of the composition and temperature indicate that the suppression of the anti-ferroelectric phase transition of CaTiSiO5 by Zr4+-substitution is a key to improve the temperature-stability and the high-resistivity in Ca(Ti1-x Zrx)SiO5. The present results shed light on the development of a designing principle for ceramic capacitors for the high-temperature use.

  16. Influence of boron addition to Ti-13Zr-13Nb alloy on MG63 osteoblast cell viability and protein adsorption.

    PubMed

    Majumdar, P; Singh, S B; Dhara, S; Chakraborty, M

    2015-01-01

    Cell proliferation, cell morphology and protein adsorption on near β-type Ti-13Zr-13Nb (TZN) alloy and Ti-13Zr-13Nb-0.5B (TZNB) composite have been investigated and compared to evaluate the effect of boron addition which has been added to the Ti alloy to improve their poor tribological properties by forming in situ TiB precipitates. MG63 cell proliferation on substrates with different chemistry but the same topography was compared. The MTT assay test showed that the cell viability on the TZN alloy was higher than the boron containing TZNB composite after 36 h of incubation and the difference was pronounced after 7 days. However, both the materials showed substantially higher cell attachment than the control (polystyrene). For the same period of incubation in fetal bovine serum (FBS), the amount of protein adsorbed on the surface of boron free TZN samples was higher than that in the case of boron containing TZNB composite. The presence of boron in the TZN alloy influenced protein adsorption and cell response and they are lower in TZNB than in TZN as a result of the associated difference in chemical characteristics.

  17. Research Update: Magnetic phase diagram of EuTi{sub 1−x}B{sub x}O{sub 3} (B = Zr, Nb)

    SciTech Connect

    Li, Ling; Keppens, Veerle; Zhou, Haidong; Yan, Jiaqiang; Mandrus, David

    2014-11-01

    We report the magnetic phase diagram of EuTi{sub 1−x}B{sub x}O{sub 3} (B = Zr, Nb), determined from magnetization and heat capacity measurements. Upon Zr-doping, the antiferromagnetic ordering temperature T{sub N} of EuTi{sub 1−x}Zr{sub x}O{sub 3} gradually decreases from 5.6 K (x = 0) to 4.1 K (x = 1). Whereas a similar decrease in T{sub N} is observed for small amounts of Nb doping (x ≤ 0.05), ferromagnetism is induced in EuTi{sub 1−x}Nb{sub x}O{sub 3} with x > 0.05. The ferromagnetic interaction between localized Eu 4f spins mediated by itinerant electrons introduced by Nb doping results in the ferromagnetism in EuTi{sub 1−x}Nb{sub x}O{sub 3}.

  18. Research Update: Magnetic phase diagram of EuTi1-xBxO3 (B = Zr, Nb)

    SciTech Connect

    Li, Ling; Zhou, Haidong; Yan, Jiaqiang; Mandrus, David; Keppens, Veerle

    2014-11-21

    Herein, we report the magnetic phase diagram of EuTi1-xBxO3 (B = Zr, Nb), determined from magnetization and heat capacity measurements. Upon Zr-doping, the antiferromagnetic ordering temperature TN of EuTi1-xZrxO3 gradually decreases from 5.6 K (x = 0) to 4.1 K (x = 1). Whereas a similar decrease in TN is observed for small amounts of Nb doping (x ≤ 0.05), ferromagnetism is induced in EuTi1-xNbxO3 with x > 0.05. Lastly, the ferromagnetic interaction between localized Eu 4f spins mediated by itinerant electrons introduced by Nb doping results in the ferromagnetism in EuTi1-xNbxO3.

  19. The preparation and thermoelectric properties of Ti0.5Zr0.25Hf0.25Co1-xNixSb half-Heusler compounds

    NASA Astrophysics Data System (ADS)

    Xie, Wenjie; Jin, Qiao; Tang, Xinfeng

    2008-02-01

    Ni doping Ti0.5Zr0.25Hf0.25Co1-xNixSb (x=0-0.05) half-Heusler compounds have been fabricated by combining high-frequency induction melting with spark plasma sintering technique, and their thermoelectric transport properties have been investigated in the temperature range of 300-900K. With the increase of Ni doping content, the electrical conductivity increases significantly, and withal the Seebeck coefficient of all doped samples improve to some extent compared with the undoped Ti0.5Zr0.25Hf0.25CoSb compound. These lead to a great improvement in the power factor, and the highest power factor of 1.63×10-3Wm-1K-1 is obtained at 715K for Ti0.5Zr0.25Hf0.25Co0.95Ni0.05Sb compound. Furthermore, thermal conductivity of Ti0.5Zr0.25Hf0.25Co1-xNixSb compounds decrease remarkably due to Zr and Hf substitutions on Ti site and Ni doping on Co site. Compared with ternary TiCoSb compound, the thermal conductivity of Ti0.5Zr0.25Hf0.25Co1-xNixSb compound decreases 415%-430% at room temperature, and compared with undoped Ti0.5Zr0.25Hf0.25CoSb compound, the thermal conductivity of Ti0.5Zr0.25Hf0.25Co0.95Ni0.05Sb decreases 34% at 300K and 21% at 900K, respectively. A maximum dimensionless figure of merit ZT of 0.51 has been achieved for Ti0.5Zr0.25Hf0.25Co0.95Ni0.05Sb compound at 813K.

  20. Texture and microstructure in co-sputtered Mg-M-O (M = Mg, Al, Cr, Ti, Zr, and Y) films

    NASA Astrophysics Data System (ADS)

    Saraiva, M.; Depla, D.

    2012-05-01

    Mg-M-O solid solution films (M = Mg, Al, Cr, Ti, Zr, and Y) with various M contents are grown employing reactive co-sputtering by varying the target-to-substrate distance. It is shown that all films are biaxially aligned. When the two cathodes are equipped with the same target material (Mg), the in-plane alignment is determined by the cathode closest to the substrate, i.e., by the largest material flux. In the case of nearly equal material fluxes from the two cathodes, double in-plane orientation is observed. This is also the case for the Mg-Al-O and Mg-Cr-O films, while the Mg-Ti-O, Mg-Zr-O and Mg-Y-O films exhibit single in-plane orientation. Pole figures indicate that the grains in Mg-M-O (M different than Mg) are titled; in the Mg-Al-O, Mg-Cr-O, and Mg-Ti-O films, the grains tilt towards the Al, Cr, and Ti metal flux, respectively, while the grain tilt of the Mg-Zr-O and Mg-Y-O films is found to be towards the Mg metal flux. Furthermore, SEM cross-sectional images of the Mg-M-O films reveal columnar microstructure with columns tilted to the same direction as the grains. A mechanism which is based on the cation radius change upon the incorporation of an M atom in the MgO lattice is proposed to explain the tilting.

  1. Surface Characteristics of Nano-Structured Silicon/Hydroxyapatite Deposition onto the Ti-Nb-Zr Alloy.

    PubMed

    Jeong, Yong-Hoon; Kim, Jeong-Jae; Choe, Han-Cheol

    2016-02-01

    The Ti-Nb-Zr alloy was manufactured with 35 wt% of Nb and 10 wt% of Zr by arc melting furnace to be a beta phase. Electrochemical deposition of Si substituted Ca/P was performed by pulsing the potential with a method of cyclic voltammetry, and changed cyclic time between 10, 30, 70, and 150. The electrolyte was prepared by dissolving the reagent-grade chemicals: Ca(NO3)2, NH4H2PO4, and Na2SiO3 x 9H20 to be 1.67 of Ca/P ratio and silicon contents were controlled to be 1 wt%. The surface characteristics were observed by field-emission scanning electron microscopy, X-ray diffractometer, and electrochemical corrosion as a potentiodynamic test. The Si substituted hydroxyapatite layer was successfully formed on the Ti-35Nb-10Zr alloy substrate by electrochemical deposition. A surface morphologies showed needle like shape at 10 cycles, then changed to be a circular with increment of cycles. The Ca/P ratio was the range between 1.5 and 2.0, the crystalline of hydroxyapatite could be confirmed. The corrosion behavior of Si-HA deposition was related with surface shape and thickness by increment, of cyclic times. Higher cyclic times of deposition had higher corrosion potential and current density than that of lower cyclic surface. PMID:27433670

  2. Electrochemical Characteristics of Cell Cultured Ti-Nb-Zr Alloys After Nano-Crystallized Si-HA Coating.

    PubMed

    Jeong, Yong-Hoon; Choe, Han-Cheol

    2015-01-01

    The aim of this study was to investigate the electrochemical characteristics of nano crystallized Si-HA coating on Ti-Nb-Zr alloy after human osteoblast like (HOB) cell attachment. The Ti-Nb-Zr alloy was manufactured with 35 wt.% of Nb and 10 wt.% of Zr by arc melting furnace to appropriate physical properties as biomaterials. The HA and Si-substituted coatings were prepared by electron-beam physical vapor deposition method with 0.5, 0.8 and 1.2 wt.% of Si contents, and nano aging treatment was performed 500 degrees C for 1 h. The characteristics of coating surface were analyzed by field emission scanning electron microscopy, energy dispersive X-ray spectroscopy, and X-ray diffraction, respectively. To evaluate of cell attachment on cell cultured surface, the potentiodynamic test was performed on the surface using HOB cells. The results showed that the Si-HA coating surface showed higher tendency of cell attachment than that of single HA coating, corrosion resistance value was increased by dense of cell attachment.

  3. Efficient fabrication of ZrO2-doped TiO2 hollow nanospheres with enhanced photocatalytic activity of rhodamine B degradation.

    PubMed

    Sun, Chuanzhi; Liu, Lichen; Qi, Lei; Li, Hao; Zhang, Hongliang; Li, Changshun; Gao, Fei; Dong, Lin

    2011-12-15

    ZrO(2)-doped TiO(2) hollow nanospheres with anatase phase are efficiently fabricated via functionalized negatively charged polystyrene (PS) spheres without any surfactant or polyelectrolyte. The resulting Ti(1-)(x)Zr(x)O(2) (hereafter denoted as TZ) hollow nanospheres are characterized by scanning electron microscopy (SEM), transmission electron microscopy (TEM), powder X-ray diffraction (XRD), Laser Raman spectroscopy (LRS), X-ray photoelectron spectroscopy (XPS), X-ray fluorescence spectroscopy (XRF), nitrogen sorption, and UV-vis diffuse reflectance spectroscopy (UV-vis). The Zr(4+) incorporation decreases the anatase crystallite size, increases the specific surface area, and changes the pore size distribution. Furthermore, it induces enrichment of electron charge density around Ti(4+) ions and blueshift of absorption edges. The TZ hollow nanospheres doped with moderate ZrO(2) (molar ratio, Ti:Zr=10:1) exhibit better photocatalytic activity than the other samples for the degradation of rhodamine B in aqueous solution, which is correlated with the effect of Zr(4+) doping on the physicochemical properties in terms of surface structures, phase structures, and the electronic structures.

  4. Phase composition, microstructure, and mechanical properties of porous Ti-Nb-Zr alloys prepared by a two-step foaming powder metallurgy method.

    PubMed

    Rao, X; Chu, C L; Zheng, Y Y

    2014-06-01

    Porous Ti-Nb-Zr alloys with different porosities from 6.06 to 62.8% are prepared by a two-step foaming powder metallurgy method using TiH2, Nb, and Zr powders together with 0 to 50wt% of NH4HCO3. The effects of the amounts of Nb and Zr as well as the sintering temperature (1473 to 1673K) on their phase composition, porosity, morphology, and mechanical characteristics are investigated. By controlling the porosity, Nb and Zr concentrations as well as the sintering temperature, porous Ti-Nb-Zr alloys with different mechanical properties can be obtained, for example, the hardness between 290 and 63HV, the compressive strength between 1530.5 and 73.4MPa, and the elastic modulus between 10.8 and 1.2GPa. The mechanical properties of the sintered porous Ti-Nb-Zr alloys can be tailored to match different requirements for the human bones and are thus potentially useful in the hard tissue implants.

  5. Electrical characteristics of p-Si/TiO2/Al and p-Si/TiO2-Zr/Al Schottky devices

    NASA Astrophysics Data System (ADS)

    Hüdai Taşdemir, İbrahim; Vural, Özkan; Dökme, İlbilge

    2016-06-01

    Electrical devices involve different types of diode in prospective electronics is of great importance. In this study, p-type Si surface was covered with thin film of TiO2 dispersion in H2O to construct p-Si/TiO2/Al Schottky barrier diode (D1) and the other one with TiO2 dispersion doped with zirconium to construct p-Si/TiO2-Zr/Al diode (D2) by drop-casting method in the same conditions. Electrical properties of as-prepared diodes and effect of zirconium as a dopant were investigated. Current-voltage (I-V) characteristics of these devices were measured at ambient conditions. Some parameters including ideality factor (n), barrier height (ΦB0), series resistance (Rs) and interface state density (Nss) were calculated from I-V behaviours of diodes. Structural comparisons were based on SEM and EDX measurements. Experimental results indicated that electrical parameters of p-Si/TiO2/Al Schottky device were influenced by the zirconium dopant in TiO2.

  6. Influence of N2 partial pressure on structural and microhardness properties of TiN/ZrN multilayers deposited by Ar/N2 vacuum arc discharge

    NASA Astrophysics Data System (ADS)

    Naddaf, M.; Abdallah, B.; Ahmad, M.; A-Kharroub, M.

    2016-08-01

    The influence of N2 partial pressure on structural, mechanical and wetting properties of multilayered TiN/ZrN thin films deposited on silicon substrates by vacuum arc discharge of (N2 + Ar) gas mixtures is investigated. X-ray diffraction (XRD) results show that the average texturing coefficient of (1 1 1) orientation and the grain size of both TiN and ZrN individual layers increase with increasing the N2 partial pressure. The Rutherford back scattering (RBS) measurements and analysis reveal that incorporation of the nitrogen in the film increases with increasing the N2 partial pressure and both TiN and ZrN individual layers have a nitrogen over-stoichiometry for N2 partial pressure ⩾50%. The change in the film micro-hardness is correlated to the changes in crystallographic texture, grain size, stoichiometry and the residual stress in the film as a function of the N2 partial pressure. In particular, stoichiometry of ZrN and TiN individual is found to play the vital role in determining the multilayer hardness. The multilayer film deposited at N2 partial pressure of 25% has the best stoichiometric ratio of both TiN and ZrN layers and the highest micro-hardness of about 32 GPa. In addition, water contact angle (WCA) measurements and analysis show a decrease in the work of adhesion on increasing the N2 partial pressure.

  7. Location and energy of interstitial hydrogen in the 1/1 approximant W-TiZrNi of the icosahedral TiZrNi quasicrystal: Rietveld refinement of x-ray and neutron diffraction data and density-functional calculations

    SciTech Connect

    Hennig, R. G.; Majzoub, E. H.; Kelton, K. F.

    2006-05-01

    We present a determination of hydrogen sites in the 1/1 approximant structure of the icosahedral TiZrNi quasicrystal. A Rietveld refinement of neutron and x-ray diffraction data determines the locations of interstitial hydrogen atoms. Density-functional methods calculate the energy of hydrogen on all possible interstitial sites. The Rietveld refinement shows that the hydrogen atoms are preferentially located in the two lowest-energy sites. The filling of the remaining hydrogen sites is dominated by the repulsive hydrogen-hydrogen interaction at short distances.

  8. Properties of the Ti40Zr10Cu36Pd14 BMG Modified by Sn and Nb Additions

    NASA Astrophysics Data System (ADS)

    Sypien, Anna; Stoica, Mihail; Czeppe, Tomasz

    2016-03-01

    The results of investigation of the influence of additions of 2 and 3 at.% of Sn and simultaneously of Sn and 3 at.% Nb on microstructure and properties of the bulk metallic glasses of composition (Ti40Cu36- x Zr10Pd14Sn x )100- y Nb y are reported. It was found that the additions of Sn increased the temperatures of glass transition (T g), primary crystallization (T x ), melting, and liquidus as well as supercooled liquid range (Δ T) and glass forming ability (GFA). The nanohardness and elastic modulus decreased in alloys with 2 and 3 at.% Sn additions, revealing similar values. The 3 at.% Nb addition to the Sn-containing amorphous phase decreased as well all the T g, T x , T L, and T m temperatures as Δ T and GFA; however, relatively larger values of this parameters in alloys containing larger Sn content were preserved. In difference to the previously published results, in the case of the amorphous alloys containing small Nb and Sn additions, a noticeable amount of the quenched-in crystalline phases was not confirmed, at least of the micrometric sizes. In the case of the alloys containing Sn or both Sn and Nb, two slightly different amorphous phase compositions were detected, suggesting separation in the liquid phase. Phase composition of the alloys determined after amorphous phase crystallization was similar for all compositions. The phases Cu8Zr3, CuTiZr, and Pd3Zr were mainly identified in the proportions dependent on the alloy compositions.

  9. A Novel Liquid-Liquid Transition in Undercooled Ti-Zr-Ni Liquids

    NASA Technical Reports Server (NTRS)

    Lee, G. W.; Gangopadhyay, A. K.; Kelton, K. F.; Bradshaw, R. C.; Hyers, R. W.; Rathz, T. J.; Rogers, J. R.

    2004-01-01

    If crystallization can be avoided, liquids enter a metastable (undercooled) state below their equilibrium liquidus temperatures, T(sub l), finally 'freezing' into a glass below a characteristic temperature called the glass transition temperature, T(sub g). In rare cases, the undercooled liquid may undergo a liquid-liquid phase transition (liquid polymorphism) before entering the glassy state. This has been suggested from experimental studies of H2O and Si. Such phase transitions have been predicted in some stable liquids, ie. above T(sub l) at atmospheric pressure, for SiO2 and BeF2, but these have not been verified experimentally. They have been observed in liquids of P, Si and C, but only under high pressure. In this letter we present the first experimental evidence for a phase transition in a low viscosity metallic liquid that is driven by an approach to a constant entropy configuration state and correlated with a growing icosahedral order in the liquid. A maximum in the specific heat at constant pressure, similar to what is normally observed near T(sub g), is reported for undercooled liquids of quasicrystal-forming Ti-Zr-Ni alloys. A two-state excitation model that includes cooperativity by incorporating a temperature-dependent excitation energy, fits the specific heat data well, signaling a phase transition. An inflection in the liquid density with decreasing temperature instead of a discontinuity indicates that this is not a typical first order phase transition; it could be a weakly first order or higher order transition. While showing many similarities to a glass transition, this liquid-liquid phase transition occurs in a mobile liquid, making it novel.

  10. Containerless measurements of thermophysical properties of Zr54Ti8Cu20Al10Ni8.

    PubMed

    Bradshaw, R C; Warren, M E; Rogers, J R; Rathz, T J; Gangopadhyay, A K; Kelton, K F; Hyers, R W

    2006-09-01

    High-temperature measurement and study of reactive materials can be difficult with conventional processing methods because contamination from the measuring apparatus and container walls can adversely affect measurements. Containerless processing techniques can be employed to isolate samples from their environment, reducing contamination. Benefits of containerless processing include reduction in heterogeneous nucleation sites, which in turn delays the onset of solidification and allows the study of meta-stable undercooled phases. However, property measurements must use noncontact methods as well. Fortunately, several optical-based methods have been developed and successfully employed to measure thermophysical properties, including surface tension, viscosity, density, and thermal expansion. Combining these techniques with the electrostatic levitator (ESL) located at the NASA Marshall Space Flight Center (MSFC) has resulted in an excellent facility to perform containerless material studies which support microgravity flight projects. Currently, studies of the thermophysical properties of liquid quasi-crystal forming and related alloys ranging from superheated to deeply undercooled states are being done with this facility in support of the NASA-funded flight project Quasi-crystalline Undercooled Alloys for Space Investigation (QUASI). While the primary purpose of these measurements is to support planned flight experiments, they are also a desirable resource for future manufacturing considerations and for fundamental insight in the physics of icosahedral ordering in liquids and solids. Presented here is an overview of the contactless measuring methods for surface tension, viscosity, density, and thermal expansion applied to Zr54Ti8Cu20Al10Ni8, for the superheated and meta-stable undercooled liquid phases, in support of QUASI. PMID:17124115

  11. Effect of Cr, Ti, V, and Zr Micro-additions on Microstructure and Mechanical Properties of the Al-Si-Cu-Mg Cast Alloy

    NASA Astrophysics Data System (ADS)

    Shaha, S. K.; Czerwinski, F.; Kasprzak, W.; Friedman, J.; Chen, D. L.

    2016-05-01

    Uniaxial static and cyclic tests were used to assess the role of Cr, Ti, V, and Zr additions on properties of the Al-7Si-1Cu-0.5Mg (wt pct) alloy in as-cast and T6 heat-treated conditions. The microstructure of the as-cast alloy consisted of α-Al, eutectic Si, and Cu-, Mg-, and Fe-rich phases Al2.1Cu, Al8.5Si2.4Cu, Al5.2CuMg4Si5.1, and Al14Si7.1FeMg3.3. In addition, the micro-sized Cr/Zr/Ti/V-rich phases Al10.7SiTi3.6, Al6.7Si1.2TiZr1.8, Al21.4Si3.4Ti4.7VZr1.8, Al18.5Si7.3Cr2.6V, Al7.9Si8.5Cr6.8V4.1Ti, Al6.3Si23.2FeCr9.2V1.6Ti1.3, Al92.2Si16.7Fe7.6Cr8.3V1.8, and Al8.2Si30.1Fe1.6Cr18.8V3.3Ti2.9Zr were present. During solution treatment, Cu-rich phases were completely dissolved, while the eutectic silicon, Fe-, and Cr/Zr/Ti/V-rich intermetallics experienced only partial dissolution. Micro-additions of Cr, Zr, Ti, and V positively affected the alloy strength. The modified alloy in the T6 temper during uniaxial tensile tests exhibited yield strength of 289 MPa and ultimate tensile strength of 342 MPa, being significantly higher than that for the Al-Si-Cu-Mg base. Besides, the cyclic yield stress of the modified alloy in the T6 state increased by 23 pct over that of the base alloy. The fatigue life of the modified alloy was substantially longer than that of the base alloy tested using the same parameters. The role of Cr, Ti, V, and Zr containing phases in controlling the alloy fracture during static and cyclic loading is discussed.

  12. TiO2-ZrO2 affinity chromatography polymeric microchip for phosphopeptide enrichment and separation.

    PubMed

    Tsougeni, Katerina; Zerefos, Panagiotis; Tserepi, Angeliki; Vlahou, Antonia; Garbis, Spiros D; Gogolides, Evangelos

    2011-09-21

    We fabricated a TiO(2)-ZrO(2) affinity chromatography micro-column on 2 mm PMMA plates, and demonstrated the enrichment and separation of (a) a standard mono- and tetra-phosphopeptide, and (b) phosphopeptides contained in a tryptic digest of β-Casein. The chromatography column consisted of 32 parallel microchannels with common input and output ports and was fabricated by lithography directly on the polymeric substrate followed by plasma etching (i.e. standard MEMS processing) and sealed with lamination. The liquid deposited TiO(2)-ZrO(2) stationary phase was characterized by X-ray diffraction and was found to be mostly TiO(2) and ZrO(2) in crystalline phases. Off-chip UV detection and MALDI MS identification of the separated effluents were used. The chip had a capacity of >1.4 μg (0.7 nmol) of a prototype mono-phosphopeptide and a recovery of 94 ± 3%, and can be used with small samples (less than 0.1 μL depending on the syringe pump used). The chip design allows an expansion of its capacity by means of increasing the number of parallel microchannels at a constant sample volume. Our approach provided an alternative to off-line extraction tips (with typical capacities of 1-2 μg and sample volumes of 1-10 μL), and to on-chip efforts based on packed bed and frit formats. PMID:21796280

  13. Fabrication and characterization of (111)-epitaxial Pb(Zr0.35Ti0.65)O3/Pb(Zr0.65Ti0.35)O3 artificial superlattice thin films

    NASA Astrophysics Data System (ADS)

    Yamada, Tomoaki; Ebihara, Youhei; Kiguchi, Takanori; Sakata, Osami; Morioka, Hitoshi; Shimizu, Takao; Funakubo, Hiroshi; Konno, Toyohiko J.; Yoshino, Masahito; Nagasaki, Takanori

    2016-10-01

    Artificial superlattice thin films consisting of two different compositions of Pb(Zr,Ti)O3 (PZT), which are in tetragonal and rhombohedral phases at room temperature in the bulk state, were grown on (111) c SrRuO3/(111)SrTiO3 by pulsed laser deposition. Fairly perfect periodicity with sharp interfaces was observed by X-ray diffraction and scanning transmission electron microscopy. It was found that the film with each layer of 5 nm thickness had a single-domain structure for both PZT layers, which would arise from the strong mechanical and electrical coupling between PZT layers. The fabricated superlattice thin films showed saturated P-E hysteresis curves. Larger electromechanical response was observed in the films with smaller layer thickness.

  14. Precipitation of heusler phase (Ni2TiAl) from B2-TiNi in Ni-Ti-Al and Ni-Ti-Al-X (X=Hf, Zr) alloys

    NASA Astrophysics Data System (ADS)

    Jung, J.; Ghosh, G.; Isheim, D.; Olson, G. B.

    2003-06-01

    The precipitation of Heusler phase (L21: Ni2TiAl) from a supersaturated B2 (TiNi-based) matrix at 600°C and 800°C is studied using transmission electron microscopy (TEM), analytical electron microscopy (AEM), and three-dimensional atom-probe (3DAP) microscopy in Ni-Ti-Al and Ni-Ti-Al-X (X=Hf and Zr) alloys. The B2/L21 two-phase system, with ordered structures based on the bcc lattice, is chosen for its microstructural analogy to the classical γ/ γ' system with an fcc lattice. Knowledge of the temperature-dependent partitioning of alloying elements and their atomic volumes in the B2-TiNi and L21 phases is desired to support design of high-performance shape-memory alloys (SMAs) with controlled misfit strain and transformation temperatures. After aging at 600°C for up to 2000 hours, the L21 precipitates remain fully coherent at a particle diameter of ˜20 nm. The observed effects of a misfit strain of -1.9 pct on the microstructure of the B2/L21 system are similar to those theoretically predicted and experimentally observed for the γ/ γ' system. The similarities are demonstrated in terms of the precipitate shape, spatial distribution, and minimum distance of separation between L21 precipitates. However, all these effects disappear after aging the alloys at 800°C for 1000 hours, when the L21 precipitates become semicoherent at particle diameters above ˜400 nm. A simple analysis of the size evolution of L21 precipitates after an isochronal aging (1000 hours) experiment suggests that they follow coarsening kinetics at 600°C and growth kinetics at 800°C, consistent with the Langer-Schwartz theory of precipitation kinetics, which predicts that a high supersaturation suppresses the growth regime. Microanalysis using AEM and 3DAP microscopy define the TiNi-Ni2TiAl phase boundaries at 800°C and 600°C. At 800°C, Hf and Zr partition to the B2-TiNi, while at 600°C, they partition slightly to the L21 phase, reducing the lattice misfit to -1.7 and -0.011 pct

  15. Differential-mode vibrational noise cancellation structure for Metglas/Pb(Zr,Ti)O₃ fiber magnetoelectric laminates.

    PubMed

    Gao, Junqi; Zhai, Junyi; Shen, Ying; Shen, Liangguo; Gray, David; Li, Jiefang; Finkel, Peter; Viehland, D

    2011-08-01

    A differential structure which has the ability to reject external vibrational noise for Metglas/Pb(Zr,Ti)O(3) (PZT) fiber-based magnetoelectric (ME) heterostructures has been studied. This type of ME structure functions better than conventional sensors as a magnetic sensor when used in an environment in which vibrational isolation is impractical. Sensors fabricated with this differential mode structure can attenuate external vibrational noise by about 10 to 20 dB at different frequencies, while simultaneously having a doubled ME voltage coefficient. Interestingly, in addition to offering a means of mitigating vibrational noise, this ME structure offers the potential to be a hybrid sensor, separating magnetic and acoustical signals.

  16. The Study of Complex (Ti, Zr, Cs) Nanopowder Influencing the Effective Ionization Potential of Arc Discharge When Mma Welding

    NASA Astrophysics Data System (ADS)

    Sapozhkov, S. B.; Burakova, E. M.

    2016-08-01

    Strength is one of the most important characteristics of a weld joint. Mechanical properties of a weld metal can be improved in a variety of ways. One of the possibilities is to add a nanopowder to the weld metal. Authors of the paper suggest changing the production process of MMA welding electrodes via adding nanopowder Ti, Zr, Cs to electrode components through liquid glass. Theoretical research into the nanopowder influence on the effective ionization potential (Ueff) of welding arc discharge is also necessitated. These measures support arcing stability, improve strength of a weld joint, as the consequence, ensure quality enhancing of a weld joint and the structure on the whole.

  17. Effect of deformation on corrosion behavior of Ti-23Nb-0.7Ta-2Zr-O alloy

    SciTech Connect

    Guo, W.Y.; Sun, J. Wu, J.S.

    2009-03-15

    The influence of deformation on the corrosion behavior of a newly developed multifunctional beta titanium alloy Ti-23Nb-0.7Ta-2Zr-O (mol%) in Ringer's solution at 310 K was evaluated using an electron backscatter diffraction technique and electrochemical measurements. The results showed that the effect of deformation on the corrosion resistance of the beta titanium alloy is complicated. Small levels of plastic deformation are detrimental to the corrosion resistance, whereas large deformations tend to eliminate this detrimental effect.

  18. Effect of ZrO2 particle on the performance of micro-arc oxidation coatings on Ti6Al4V

    NASA Astrophysics Data System (ADS)

    Li, Hong; Sun, Yezi; Zhang, Jin

    2015-07-01

    This paper investigates the effect of ZrO2 particle on the oxidation resistance and wear properties of coatings on a Ti6Al4V alloy generated using the micro-arc oxidation (MAO) technique. Different concentrations micron ZrO2 particles were added in phosphate electrolyte and dispersed by magnetic stirring apparatus. The composition of coating was characterized using X-ray diffraction and energy dispersive spectrum, and the morphology was examined using SEM. The high temperature oxidation resistance of the coating sample at 700 °C was investigated. Sliding wear behaviour was tested by a wear tester. The results showed that the coating consisted of ZrTiO4, ZrO2, TiO2. With ZrO2 particle addition, the ceramic coating's forming time reduced by the current dynamic curve. It was shown that the addition of ZrO2 particles (3 g/L, 6 g/L) expressed an excellent oxidation resistance at 700 °C and wear resistance.

  19. Properties of the ZrO2 and TiO2 coatings deposited by plasma-assisted arc spraying onto an E110 zirconium alloy

    NASA Astrophysics Data System (ADS)

    Chernov, I. P.; Berezneeva, E. V.; Pushilina, N. S.; Kudiyarov, V. N.; Koval', N. N.; Krysina, O. V.; Shugurov, V. V.; Ivanova, S. V.; Nikolaeva, A. N.

    2015-02-01

    The structure, the physicomechanical properties, and the hydrogen penetration in the volume of an E110 alloy with a ZrO2 or TiO2 coating deposited by a vacuum-arc plasma-assisted method are studied. These coatings increase the wear resistance, the hardness, and the adhesion properties of the zirconium alloy. The ZrO2 coating is found to decrease the rate of hydrogen absorption by a Zr-1% Nb alloy as compared to the initial material at a hydrogenation temperature of 450°C.

  20. Syntheses and structures of metallocene methyltrihydroborate derivativies: Cp2ZrCl[(mu-H)2BHCH3], Cp2Zr[(mu-H)2BHCH3]2, and Cp2Ti[(mu-H)2BHCH3].

    PubMed

    Liu, Fu-Chen; Chen, Ko-Yu; Chen, Jung-Hua; Lee, Gene-Hsian; Peng, Shie-Ming

    2003-03-10

    In reactions of zirconocene dichloride, Cp(2)ZrCl(2), with 1 equiv and an excess amount of LiBH(3)CH(3), the methyltrihydroborate complexes, Cp(2)ZrCl[(mu-H)(2)BHCH(3)], 1, and Cp(2)Zr[(mu-H)(2)BHCH(3)](2), 2, were isolated. The reaction of titanocene dichloride, Cp(2)TiCl(2), with an excess amount of LiBH(3)CH(3) produced the monosubstituted methyltrihydroborate complex, Cp(2)Ti[(mu-H)(2)BHCH(3)], 3. The titanium was reduced from Ti(IV) to Ti(III), producing a 17-electron, paramagnetic titanocene complex. Under a dynamic vacuum at room temperature, compound 2 decomposed and produced the zirconium hydride compound Cp(2)ZrH[(mu-H)(2)BHCH(3)]. Single crystal X-ray structures of 1, 2, and 3 were determined. Crystal data for 1: space group P2(1)/c, a = 13.7921(3) A, b = 13.4227(3) A, c = 13.0868(3) A, beta = 91.6448(12) degrees, Z = 8. Crystal data for 2: space group Pna2(1), a = 15.2949(4) A, b = 9.3417(2) A, c = 9.3211(2) A, Z = 4. Crystal data for 3: space group Fmm2, a = 9.1795(3) A, b = 13.0993(5) A, c = 8.8520(3) A, Z = 4. PMID:12611550

  1. 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).

  2. Temperature-dependent local structural properties of redox Pt nanoparticles on TiO2 and ZrO2 supports

    SciTech Connect

    Jeong, Eun -Suk; Park, Chang -In; Jin, Zhenlan; Hwang, In -Hui; Son, Jae -Kwan; Kim, Mi -Young; Choi, Jae -Soon; Han, Sang -Wook

    2015-01-21

    This paper examined the local structural properties of Pt nanoparticles on SiO2, TiO2–SiO2, and ZrO2–SiO2 supports to better understand the impact of oxide-support type on the performance of Pt-based catalysts. In situ X-ray absorption fine structure (XAFS) measurements were taken for the Pt L3-edge in a temperature range from 300 to 700 K in He, H2, and O2 gas environments. The XAFS measurements demonstrated that Pt atoms were highly dispersed on TiO2–SiO2 and ZrO2–SiO2 forming pancake-shaped nanoparticles, whereas Pt atoms formed larger particles of hemispherical shapes on SiO2 supports. Contrary to the SiO2 case, the coordination numbers for Pt, Ti, and Zr around Pt atoms on the TiO2–SiO2 and ZrO2–SiO2 supports were nearly constant from 300 to 700 K under the different gas environments. These results are consistent with the improvements in thermal stability of Pt nanoparticles achieved by incorporating TiO2 or ZrO2 on the surface of SiO2 supports. XAFS analysis further indicated that the enhanced dispersion and stability of Pt were a consequence of the strong metal support interaction via Pt–Ti and Pt–Zr bonds.

  3. Temperature-dependent local structural properties of redox Pt nanoparticles on TiO2 and ZrO2 supports

    DOE PAGESBeta

    Jeong, Eun -Suk; Park, Chang -In; Jin, Zhenlan; Hwang, In -Hui; Son, Jae -Kwan; Kim, Mi -Young; Choi, Jae -Soon; Han, Sang -Wook

    2015-01-21

    This paper examined the local structural properties of Pt nanoparticles on SiO2, TiO2–SiO2, and ZrO2–SiO2 supports to better understand the impact of oxide-support type on the performance of Pt-based catalysts. In situ X-ray absorption fine structure (XAFS) measurements were taken for the Pt L3-edge in a temperature range from 300 to 700 K in He, H2, and O2 gas environments. The XAFS measurements demonstrated that Pt atoms were highly dispersed on TiO2–SiO2 and ZrO2–SiO2 forming pancake-shaped nanoparticles, whereas Pt atoms formed larger particles of hemispherical shapes on SiO2 supports. Contrary to the SiO2 case, the coordination numbers for Pt, Ti,more » and Zr around Pt atoms on the TiO2–SiO2 and ZrO2–SiO2 supports were nearly constant from 300 to 700 K under the different gas environments. These results are consistent with the improvements in thermal stability of Pt nanoparticles achieved by incorporating TiO2 or ZrO2 on the surface of SiO2 supports. XAFS analysis further indicated that the enhanced dispersion and stability of Pt were a consequence of the strong metal support interaction via Pt–Ti and Pt–Zr bonds.« less

  4. Large electrical manipulation of permittivity in BaTiO{sub 3} and Pb(Zr,Ti)O{sub 3} bimorph heterostructure

    SciTech Connect

    Ci, Penghong; Liu, Guoxi; Dong, Shuxiang; Zhang, Li

    2014-08-18

    We report a strain-mediated electric field manipulation of permittivity in BaTiO{sub 3} (barium titanate, BT) ceramic by a Pb(Zr,Ti)O{sub 3} (PZT) bimorph. This BT/PZT heterostructure exhibited a relatively large permittivity tunability of BT up to ±10% in a wide frequency range under an electric field of ±4 kV/cm applied to the PZT bimorph. The permittivity tunability is attributed to the strain in BT produced by the PZT bimorph. Calculations of the relationship between permittivity and applied electric field were developed, and corresponded well with measurements. The BT/PZT heterostructure has potential for applications in broadband field tunable smart electronic devices.

  5. Room-temperature poling of PbTiO3/Pb(Zr,Ti)O3 sol-gel composite films by pulse discharge

    NASA Astrophysics Data System (ADS)

    Kouyama, Hikaru; Kibe, Taiga; Fujimoto, Shota; Namihira, Takao; Kobayashi, Makiko

    2016-07-01

    The PbTiO3/Pb(Zr,Ti)O3 (PT/PZT) sol-gel composite is a promising piezoelectric material because of its high piezoelectricity and temperature stability up to 360 °C. However, the poling of PT/PZT required high temperature owing to the high coercive field of PT, which made the poling of PT/PZT troublesome. In this research, conventional DC corona poling and pulse discharge at room temperature were attempted for PT/PZT samples. As a result, PT/PZT poled by pulse discharge generation at room temperature showed comparable ultrasonic responses to that poled by DC corona discharge generation at a high temperature. Therefore, room-temperature poling of PT/PZT was successfully carried out by pulse discharge, and poling time was markedly reduced from ˜15 min to 15 s.

  6. High-temperature-immersion ultrasonic probe without delay line using PbTiO3/Pb(Zr,Ti)O3 ultrasonic transducer

    NASA Astrophysics Data System (ADS)

    Kibe, Taiga; Inoue, Takuo; Namihira, Takao; Kobayashi, Makiko

    2015-07-01

    The behavior of a high-temperature-immersion ultrasonic probe without a delay line using a PbTiO3/Pb(Zr,Ti)O3 (PT/PZT) ultrasonic transducer was investigated empirically. A ∼100-µm-thick PT/PZT film was fabricated on a 200-µm-thick stainless steel substrate. After PT/PZT film fabrication, the substrate was bonded to a stainless steel pipe using a high-temperature waterproof adhesive material. The probe was tested in a water bath from room temperature to 100 °C for system verification. During three thermal cycles, the ultrasonic echoes had a high signal-to-noise ratio (SNR) and reasonable repeatability. After that, the same probe was verified by testing it in the silicone oil from room temperature to 200 °C. The test was also repeated three times and the probe successfully demonstrated high-temperature durability, a high SNR, and repeatability throughout the experiments.

  7. Submicron patterning of epitaxial PbZr0.52Ti0.48O3 heterostructures

    NASA Astrophysics Data System (ADS)

    Banerjee, N.; Koster, G.; Rijnders, G.

    2013-04-01

    Epitaxial PbZr0.52Ti0.48O3 (PZT 52/48) heterostructures incorporating SrRuO3 electrodes were patterned through a single step epitaxial lift-off technique without using any acidic etching. This procedure enables patterning of high temperature grown perovskite multilayers through the use of a pre-patterned AlOx mask which acts as a high temperature sacrificial template. Ferroelectric properties of structured PZT grown on (001) SrTiO3 substrates as well as on commercially important platinized Si were investigated in capacitor configuration analogous to structures previously prepared through wet etching. In addition, the patterning technique is shown to be compatible with e-beam lithography for preparation of sub-micron device structures consisting of ferroelectric perovskite materials.

  8. Matrix Infrared Spectra and Quantum Chemical Calculations of Ti, Zr, and Hf Dihydride Phosphinidene and Arsinidene Molecules.

    PubMed

    Andrews, Lester; Cho, Han-Gook

    2016-09-01

    Laser ablated Ti, Zr, and Hf atoms react with phosphine during condensation in excess argon or neon at 4 K to form metal hydride insertion phosphides (H2P-MH) and metal dihydride phosphinidenes (HP═MH2) with metal phosphorus double bonds, which are characterized by their intense metal-hydride stretching frequencies. Both products are formed spontaneously on annealing the solid matrix samples, which suggests that both products are relaxed from the initial higher energy M-PH3 intermediate complex, which is not observed. B3LYP (DFT) calculations show that these phosphinidenes are strongly agostic with acute H-P═M angles in the 60° range, even smaller than those for the analogous methylidenes (carbenes) (CH2═MH2) and in contrast to the almost linear H-N═Ti subunit in the imines (H-N═TiH2). Comparison of calculated agostic and terminal bond lengths and covalent bond radii for HP═TiH2 with computed bond lengths for Al2H6 finds that these strong agostic Ti-H bonds are 18% longer than single covalent bonds, and the bridged bonds in dialane are 10% longer than the terminal Al-H single bonds, which show that these agostic bonds can also be considered as bridged bonds. The analogous arsinidenes (HAs═MH2) have 4° smaller agostic angles and almost the same metal-hydride stretching frequencies and double bond orders. Calculations with fixed H-P-Ti and H-As-Ti angles (170.0°) and Cs symmetry find that electronic energies increased by 36 and 44 kJ/mol, respectively, which provide estimates for the agostic/bridged bonding energies.

  9. Matrix Infrared Spectra and Quantum Chemical Calculations of Ti, Zr, and Hf Dihydride Phosphinidene and Arsinidene Molecules.

    PubMed

    Andrews, Lester; Cho, Han-Gook

    2016-09-01

    Laser ablated Ti, Zr, and Hf atoms react with phosphine during condensation in excess argon or neon at 4 K to form metal hydride insertion phosphides (H2P-MH) and metal dihydride phosphinidenes (HP═MH2) with metal phosphorus double bonds, which are characterized by their intense metal-hydride stretching frequencies. Both products are formed spontaneously on annealing the solid matrix samples, which suggests that both products are relaxed from the initial higher energy M-PH3 intermediate complex, which is not observed. B3LYP (DFT) calculations show that these phosphinidenes are strongly agostic with acute H-P═M angles in the 60° range, even smaller than those for the analogous methylidenes (carbenes) (CH2═MH2) and in contrast to the almost linear H-N═Ti subunit in the imines (H-N═TiH2). Comparison of calculated agostic and terminal bond lengths and covalent bond radii for HP═TiH2 with computed bond lengths for Al2H6 finds that these strong agostic Ti-H bonds are 18% longer than single covalent bonds, and the bridged bonds in dialane are 10% longer than the terminal Al-H single bonds, which show that these agostic bonds can also be considered as bridged bonds. The analogous arsinidenes (HAs═MH2) have 4° smaller agostic angles and almost the same metal-hydride stretching frequencies and double bond orders. Calculations with fixed H-P-Ti and H-As-Ti angles (170.0°) and Cs symmetry find that electronic energies increased by 36 and 44 kJ/mol, respectively, which provide estimates for the agostic/bridged bonding energies. PMID:27558006

  10. Improving High-Temperature Tensile and Low-Cycle Fatigue Behavior of Al-Si-Cu-Mg Alloys Through Micro-additions of Ti, V, and Zr

    NASA Astrophysics Data System (ADS)

    Shaha, S. K.; Czerwinski, F.; Kasprzak, W.; Friedman, J.; Chen, D. L.

    2015-07-01

    High-temperature tensile and low-cycle fatigue tests were performed to assess the influence of micro-additions of Ti, V, and Zr on the improvement of the Al-7Si-1Cu-0.5Mg (wt pct) alloy in the as-cast condition. Addition of transition metals led to modification of microstructure where in addition to conventional phases present in the Al-7Si-1Cu-0.5Mg base, new thermally stable micro-sized Zr-Ti-V-rich phases Al21.4Si4.1Ti3.5VZr3.9, Al6.7Si1.2TiZr1.8, Al2.8Si3.8V1.6Zr, and Al5.1Si35.4Ti1.6Zr5.7Fe were formed. The tensile tests showed that with increasing test temperature from 298 K to 673 K (25 °C to 400 °C), the yield stress and tensile strength of the present studied alloy decreased from 161 to 84 MPa and from 261 to 102 MPa, respectively. Also, the studied alloy exhibited 18, 12, and 5 pct higher tensile strength than the alloy A356, 354 and existing Al-Si-Cu-Mg alloy modified with additions of Zr, Ti, and Ni, respectively. The fatigue life of the studied alloy was substantially longer than those of the reference alloys A356 and the same Al-7Si-1Cu-0.5Mg base with minor additions of V, Zr, and Ti in the T6 condition. Fractographic analysis after tensile tests revealed that at the lower temperature up to 473 K (200 °C), the cleavage-type brittle fracture for the precipitates and ductile fracture for the matrix were dominant while at higher temperature fully ductile-type fracture with debonding and pull-out of cracked particles was identified. It is believed that the intermetallic precipitates containing Zr, Ti, and V improve the alloy performance at increased temperatures.

  11. Continuous cross-over from ferroelectric to relaxor state and piezoelectric properties of BaTiO3-BaZrO3-CaTiO3 single crystals

    NASA Astrophysics Data System (ADS)

    Benabdallah, F.; Veber, P.; Prakasam, M.; Viraphong, O.; Shimamura, K.; Maglione, M.

    2014-04-01

    Optimal properties like piezoelectricity can be found in polarizable materials for which the structure changes sharply under small composition variations in the vicinity of their morphotropic phase boundary or the triple point in their isobaric temperature-composition phase diagram. In the latter, lead-free (Ba0.850Ca0.150)(Ti0.900Zr0.100)O3 ceramics exhibit outstanding piezoelectric coefficients. For the first time, we report the growth of piezoelectric lead-free single crystals in the BaTiO3-BaZrO3-CaTiO3 pseudo-ternary system. The stoichiometry control in the CaO-BaO-TiO2-ZrO2 solid solution led to single crystals with various compositions ranging from (Ba0.857Ca0.143)(Ti0.928Zr0.072)O3 to (Ba0.953Ca0.047)(Ti0.427Zr0.573)O3. We evidenced a continuous cross-over from a ferroelectric state at high titanium content to a relaxor one on increasing the zirconium content. Such a property tuning is rather seldom observed in lead-free ferroelectrics and confirms what was already reported for ceramics. Single crystal with (Ba0.838Ca0.162)(Ti0.854Zr0.146)O3 composition, which has been grown and oriented along [001] crystallographic direction, displayed electromechanical coefficients d31 and k31 of 93 pC.N-1 and 0.18, respectively, near the room temperature (T = 305 K).

  12. Continuous cross-over from ferroelectric to relaxor state and piezoelectric properties of BaTiO{sub 3}-BaZrO{sub 3}-CaTiO{sub 3} single crystals

    SciTech Connect

    Benabdallah, F.; Veber, P. Prakasam, M.; Viraphong, O.; Maglione, M.; Shimamura, K.

    2014-04-14

    Optimal properties like piezoelectricity can be found in polarizable materials for which the structure changes sharply under small composition variations in the vicinity of their morphotropic phase boundary or the triple point in their isobaric temperature-composition phase diagram. In the latter, lead-free (Ba{sub 0.850}Ca{sub 0.150})(Ti{sub 0.900}Zr{sub 0.100})O{sub 3} ceramics exhibit outstanding piezoelectric coefficients. For the first time, we report the growth of piezoelectric lead-free single crystals in the BaTiO{sub 3}-BaZrO{sub 3}-CaTiO{sub 3} pseudo-ternary system. The stoichiometry control in the CaO-BaO-TiO{sub 2}-ZrO{sub 2} solid solution led to single crystals with various compositions ranging from (Ba{sub 0.857}Ca{sub 0.143})(Ti{sub 0.928}Zr{sub 0.072})O{sub 3} to (Ba{sub 0.953}Ca{sub 0.047})(Ti{sub 0.427}Zr{sub 0.573})O{sub 3}. We evidenced a continuous cross-over from a ferroelectric state at high titanium content to a relaxor one on increasing the zirconium content. Such a property tuning is rather seldom observed in lead-free ferroelectrics and confirms what was already reported for ceramics. Single crystal with (Ba{sub 0.838}Ca{sub 0.162})(Ti{sub 0.854}Zr{sub 0.146})O{sub 3} composition, which has been grown and oriented along [001] crystallographic direction, displayed electromechanical coefficients d{sub 31} and k{sub 31} of 93 pC.N{sup −1} and 0.18, respectively, near the room temperature (T = 305 K)

  13. 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.

  14. A thermo-mechanical treatment to improve the superelastic performances of biomedical Ti-26Nb and Ti-20Nb-6Zr (at.%) alloys.

    PubMed

    Sun, F; Hao, Y L; Nowak, S; Gloriant, T; Laheurte, P; Prima, F

    2011-11-01

    A flash-thermal treatment technique has been developed very recently to improve both the critical stress to induce the martensitic transformation (MT) and the recoverable deformation of the metastable β type titanium alloys. In this paper, this strategy is applied to both Ti-26Nb and Ti-20Nb-6Zr (at.%) alloys. Since both alloys have identical martensite start (Ms) temperature, it makes possible to investigate the effect of Zr on mechanical properties after the flash-thermal treatment. It is clearly shown that a flash treatment of 360 s at 873 K on heavily cold-rolled samples results in good balance between the tensile strength, the ductility and the recoverable strains. Such contribution is more significant in the ternary alloy in which balanced properties combining high martensitic critical stress over 400 MPa and the large fully recoverable strains up to 3.0% can be achieved. These improvements are due to the flash treatment effects, resulting in ultra-fine β grains with sizes 1-2 μm with nano-sized α and ω phases precipitation in the β matrix. PMID:22098885

  15. A thermo-mechanical treatment to improve the superelastic performances of biomedical Ti-26Nb and Ti-20Nb-6Zr (at.%) alloys.

    PubMed

    Sun, F; Hao, Y L; Nowak, S; Gloriant, T; Laheurte, P; Prima, F

    2011-11-01

    A flash-thermal treatment technique has been developed very recently to improve both the critical stress to induce the martensitic transformation (MT) and the recoverable deformation of the metastable β type titanium alloys. In this paper, this strategy is applied to both Ti-26Nb and Ti-20Nb-6Zr (at.%) alloys. Since both alloys have identical martensite start (Ms) temperature, it makes possible to investigate the effect of Zr on mechanical properties after the flash-thermal treatment. It is clearly shown that a flash treatment of 360 s at 873 K on heavily cold-rolled samples results in good balance between the tensile strength, the ductility and the recoverable strains. Such contribution is more significant in the ternary alloy in which balanced properties combining high martensitic critical stress over 400 MPa and the large fully recoverable strains up to 3.0% can be achieved. These improvements are due to the flash treatment effects, resulting in ultra-fine β grains with sizes 1-2 μm with nano-sized α and ω phases precipitation in the β matrix.

  16. Electron-stimulated desorption from polished and vacuum fired 316LN stainless steel coated with Ti-Zr-Hf-V

    SciTech Connect

    Malyshev, Oleg B. Valizadeh, Reza; Hogan, Benjamin T.; Hannah, Adrian N.

    2014-11-01

    In this study, two identical 316LN stainless steel tubular samples, which had previously been polished and vacuum-fired and then used for the electron-stimulated desorption (ESD) experiments, were coated with Ti-Zr-Hf-V with different morphologies: columnar and dense. ESD measurement results after nonevaporable getter (NEG) activation to 150, 180, 250, and 350 °C indicated that the values for the ESD yields are significantly (2–20 times) lower than the data from our previous study with similar coatings on nonvacuum-fired samples. Based on these results, the lowest pressure and best long-term performance in particle accelerators will be achieved with a vacuum-fired vacuum chamber coated with dense Ti-Zr-Hf-V coating activated at 180 °C. This is likely due to the following facts: after NEG activation, the hydrogen concentration inside the NEG was lower than in the bulk stainless steel substrate; the NEG coating created a barrier for gas diffusion from the sample bulk to vacuum; the dense NEG coating performed better as a barrier than the columnar NEG coating.

  17. Aging characteristics of the Al-Si-Cu-Mg cast alloy modified with transition metals Zr, V and Ti

    NASA Astrophysics Data System (ADS)

    Czerwinski, F.; Shaha, S. K.; Kasprzak, W.; Friedman, J.; Chen, D. L.

    2016-03-01

    The hypoeutectic Al-7Si-1Cu-0.5Mg base alloy was modified with different contents of Zr, V and Ti. The wedge-shape samples with varying solidification rates during casting were subjected to isochronal aging at temperatures up to 500 °C. Moreover, as-cast and solution treated alloys were subjected to long-term isothermal aging at 150°C. As a reference, the A380 alloy, seen as commercial standard for the automotive application target, was used. The modified alloys exerted different aging characteristics than the A380 grade with higher peak hardness and lower temperature of alloy softening. Besides, the influence of the applied solidification rates on hardness after aging was less pronounced in modified alloys than in the A380 grade. For three combinations of Zr, V and Ti tested with contents of individual elements ranging from 0.14 to 0.47%, no essential differences in aging characteristics were recorded. The results are discussed in terms of the role of chemistry and heat treatment in generating precipitates contributing to the thermal stability of Al based alloys.

  18. Investigation of low field dielectric properties of anisotropic porous Pb(Zr,Ti)O3 ceramics: Experiment and modeling

    NASA Astrophysics Data System (ADS)

    Olariu, C. S.; Padurariu, L.; Stanculescu, R.; Baldisserri, C.; Galassi, C.; Mitoseriu, L.

    2013-12-01

    Anisotropic porous Pb(Zr,Ti)O3 ceramics with various porosity degrees have been studied in order to determine the role of the pore shape and orientation on the low-field dielectric properties. Ceramic samples with formula Pb(Zr0.52Ti0.48)0.976Nb0.024O3 with different porosity degrees (dense, 10%, 20%, 40% vol.) have been prepared by solid state reaction. Taking into consideration the shape and orientation of the pore inclusions, the dielectric properties of porous ceramics have been described by using adapted mixing rules models. Rigorous bounds, derived on the basis on Variational Principle, were used to frame dielectric properties of porous composites. The finite element method (FEM) was additionally used to simulate the dielectric response of the porous composites under various applied fields. Among the few effective medium approximation models adapted for anisotropic oriented inclusions, the best results were obtained in case of needle-like shape inclusions (which do not correspond to the real shape of microstructure inclusions). The general case of Wiener bounds limited well the dielectric properties of anisotropic porous composites in case of parallel orientation. Among the theoretical approaches, FEM technique allowed to simulate the distribution of potential and electric field inside composites and provided a very good agreement between the computed permittivity values and experimental ones.

  19. 3D surface topography study of the biofunctionalized nanocrystalline Ti-6Zr-4Nb/Ca-P

    SciTech Connect

    Jakubowicz, J.; Adamek, G.; Jurczyk, M.U.; Jurczyk, M.

    2012-08-15

    In this work surface of the sintered Ti-6Zr-4Nb nanocrystalline alloy was electrochemically biofunctionalized. The porous surface was produced by anodic oxidation in 1 M H{sub 3}PO{sub 4} + 2%HF electrolyte at 10 V for 30 min. Next the calcium-phosphate (Ca-P) layer was deposited, onto the formed porous surface, using cathodic potential - 5 V kept for 60 min in 0.042 M Ca(NO{sub 3}){sub 2} + 0.025 M (NH{sub 4}){sub 2}HPO{sub 4} + 0.1 M HCl electrolyte. The deposited Ca-P layer anchored in the pores. The biofunctionalized surface was studied by XRD, SEM and EDS. In vitro tests culture of normal human osteoblast (NHOst) cells showed very good cells proliferation, colonization and multilayering. Using optical profiler, roughness and hybrid 3D surface topography parameters were estimated. Correlation between surface composition, morphology, roughness and biocompatibility results was done. It has been shown by us that surface with appropriate chemical composition and topography, after combined electrochemical anodic and cathodic surface treatment, supports osteoblast adhesion and proliferation. 3D topography measurements using optical profiler play a key role in the biomaterials surface analysis. - Highlights: Black-Right-Pointing-Pointer Nanocrystalline Ti-6Zr-4Nb/Ca-P material was produced for hard tissue implant applications. Black-Right-Pointing-Pointer Calcium-phosphate results in surface biofunctionalization. Black-Right-Pointing-Pointer The biofunctionalized surface shows good in-vitro behavior.

  20. 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.

  1. Characterization and Evaluation of Ti-Zr-V Non-evaporable Getter Films Used in Vacuum Systems

    NASA Astrophysics Data System (ADS)

    Ferreira, M. J.; Seraphim, R. M.; Ramirez, A. J.; Tabacniks, M. H.; Nascente, P. A. P.

    Among several methods used to obtain ultra-high vacuum (UHV) for particles accelerators chambers, it stands out the internal coating with metallic films capable of absorbing gases, called NEG (non-evaporable getter). Usually these materials are constituted by elements of great chemical reactivity and solubility (such as Ti, Zr, and V), at room temperature for oxygen and other gases typically found in UHV, such as H2, CO, and CO2. Gold and ternary Ti-Zr-V films were produced by magnetron sputtering, and their composition, structure, morphology, and aging characteristics were characterized by energy-dispersive X-ray spectroscopy (EDS), X-ray photoelectron spectroscopy (XPS), X-ray diffraction (XRD), field emission gun sc anning electronmicroscopy (FEG-SEM), atomic force microscopy (AFM), high resolution transmission electron microscopy (HRTEM). The comparison between the produced films and commercial samples indicated that the desirable characteristics depend on the nanometric structure of the films and that this structure is sensitive to the heat treatments.

  2. Ti insertion in the MTe(5) (M = Zr, Hf) structure type: Hf(0.78)Ti(0.22)Te(5).

    PubMed

    Yu, Jaemin; Yun, Hoseop

    2012-03-01

    The group 5 mixed-metal telluride, Hf(0.78)Ti(0.22)Te(5) (hafnium titanium penta-telluride), is isostructural with the binary phases HfTe(5) and ZrTe(5) and forms a layered structure extending parallel to (010). The layers are made up from chains of bicapped metal-centered trigonal prisms and zigzag Te chains. The metal site (site symmetry m2m) is occupied by statistically disordered Hf [78.1 (5)%] and Ti [21.9 (5)%]. In addition to the regular Te-Te pair [2.7448 (13) Å] forming the short base of the equilateral triangle of the trigonal prism, an inter-mediate Te⋯Te separation [2.9129 (9) Å] is also found. The classical charge balance of the compound can be described as [M(4+)][Te(2-)][Te(2) (2-)][Te(2) (0)] (M = Hf, Ti). The individual metal content can vary in different crystals, apparently forming a random substitutional solid solution (Hf(1-x)Ti(x))Te(5), with 0.15 ≤ x ≤ 0.22.

  3. Electrochemical and surface analyses of nanostructured Ti-24Nb-4Zr-8Sn alloys in simulated body solution.

    PubMed

    Li, J; Li, S J; Hao, Y L; Huang, H H; Bai, Y; Hao, Y Q; Guo, Z; Xue, J Q; Yang, R

    2014-06-01

    The use of nanostructuring to improve the stability of passive thin films on biomaterials can enhance their effectiveness in corrosion resistance and reduce the release of ions. The thickness of the ultrathin films that cover Ti and Ti alloys (only several nanometers) has prevented researchers from establishing systematic methods for their characterization. This study employed a multifunctional biomedical titanium alloy Ti-24Nb-4Zr-8Sn (wt.%) as a model material. Coarse-grained (CG) and nanostructured (NS) alloys were analyzed in 0.9% NaCl solution at 37°C. To reveal the details of the passive film, a method of sample preparation producing a passive layer suitable for transmission electron microscope analysis was developed. Electrochemical corrosion behavior was evaluated by potentiodynamic polarization tests and Mott-Schottky measurements. Surface depth chemical profile and morphology evolution were performed by X-ray photoelectron spectroscopy and in situ atomic force microscopy, respectively. A mechanism was proposed on the basis of the point defect model to compare the corrosion resistance of the passive film on NS and CG alloys. Results showed that the protective amorphous film on NS alloy is thicker, denser and more homogeneous with fewer defects than that on CG alloy. The film on NS alloy contains more oxygen and corrosion-resistant elements (Ti and Nb), as well as their suboxides, compared with the film on CG alloy. These characteristics can be attributed to the rapid, uniform growth of the passive film facilitated by nanostructuring.

  4. 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.

  5. New surface-hardened, low-modulus, corrosion-resistant Ti-13Nb-13Zr alloy for total hip arthroplasty.

    PubMed

    Davidson, J A; Mishra, A K; Kovacs, P; Poggie, R A

    1994-01-01

    To optimize the performance of total hip replacement, scientists and clinicians are seeking new materials and noncemented, press-fit designs that can improve load transfer to the bone and reduce the incidence of loosening and thigh pain. Currently used Co-Cr-Mo alloy has a relatively high elastic modulus (E = 227 GPa), which limits its ability to transfer load to the surrounding bone in the proximal calcar region. Thus to improve load transfer, designs are considered with less cross-sectional area to increase flexibility, but at the expense of fit and fill, and thus stability of the implant within the bone. Should stem loosening occur, the stem stresses may exceed the relatively low fatigue strength of the Co-Cr-Mo alloy and lead to stem breakage. To improve these conditions, lower modulus Ti-6Al-4V alloy (E = 115 GPa) is being used. More recently, a new lower-modulus (E = 79 GPa) Ti-13Nb-13Zr alloy has been developed which does not contain any elemental constituents associated with adverse cell response (i.e., Co, Cr, Mo, Ni, Fe, Al, V), and which possesses comparable or superior strength and toughness to existing Ti-6Al-4V alloy. The carefully selected Nb and Zr constituents improve bone biocompatibility and corrosion resistance compared to that of currently used implant metals. Additionally, a unique diffusion hardening (DH) treatment can be conducted during the age-hardening process of this near-beta alloy to produce a hardened surface with abrasion resistance superior to that of Co-Cr-Mo alloy. This also provides an improvement in the micro-fretting tendencies that may occur within femoral head-neck taper regions and modular interfaces of other implant designs. The present study describes the metallurgy and mechanical properties of this unique low modulus Ti-13Nb-13Zr alloy, and the heat treatments used to obtain the high strength, corrosion resistance, and surface hardening that renders this biocompatible alloy well-suited for press fit hip replacement

  6. Electrochemical characterization of pulsed layer deposited hydroxyapatite-zirconia layers on Ti-21Nb-15Ta-6Zr alloy for biomedical application

    NASA Astrophysics Data System (ADS)

    Izquierdo, Javier; Bolat, Georgiana; Cimpoesu, Nicanor; Trinca, Lucia Carmen; Mareci, Daniel; Souto, Ricardo Manuel

    2016-11-01

    A new titanium base Ti-21Nb-15Ta-6Zr alloy covered with hydroxyapatite-zirconia (HA-ZrO2) by pulsed laser deposition (PLD) technique was characterized regarding its corrosion resistance in simulated physiological Ringer's solution at 37 °C. For the sake of comparison, Ti-6Al-4V standard implant alloy, with and without hydroxyapatite-zirconia coating, was also characterized. Multiscale electrochemical analysis using both conventional averaging electrochemical techniques, namely electrochemical impedance spectroscopy (EIS) and potentiodynamic polarization, and spatially-resolved microelectrochemical techniques (scanning electrochemical microscopy, SECM) were used to investigate the electrochemical behaviour of the materials. In addition, scanning electron microscopy evidenced that no relevant surface morphology changes occurred on the materials upon immersion in the simulated physiological solution, despite variations in their electrochemical behaviour. Although uncoated metals appear to show better performances during conventional corrosion tests, the response is still quite similar for the HA-ZrO2 coated materials while providing superior resistance towards electron transfer due to the formation of a more dense film on the surface, thus effectively behaving as a passive material. It is believed corrosion of the HA-ZrO2 coated Ti-21Nb-15Ta-6Zr alloy will have negligible effect upon biochemical and cellular events at the bone-implant interface and could facilitate osseointegration.

  7. Analysis of structure and P-c-T curve of hydrogenated Ti53Zr27xNi20Pd(x) quasicrystals.

    PubMed

    Jo, Youngsoo; Lee, Sang-Hwa; Shin, Hong Sik; Kim, Jaeyong

    2013-12-01

    The potential application of TiZrNi quasicrystals was evaluated by measuring the pressure-composition-temperature curves after replacing Zr by Pd to the limit maintaining the host structure for the samples made with Ti53Zr27(-x)Ni20Pd(x), where 0 < or = x < or = 8. The results of X-ray diffraction data revealed that the samples keep the pure quasicrystal structure to the maximum value of x = 8. All diffracted peaks uniformly shifted to the low angle of 2 theta in X-ray diffraction pattern suggesting that hydrogen atoms homogeneously diffuse in the quasicrystals and uniformly expand the quasilattice constants without modification of the structure. After hydrogenation at elevated temperature, the quasi-lattice constants increased from 5.12 to 5.34 angstroms for the samples made with x = 0 without appearing an impurity phase. When Zr was replaced by 8 at.% of Pd, the equilibrium vapor pressures significantly increased to 3.41 from 0.41 Torr at 300 degrees C although the total amount of hydrogen decreased as increasing Pd concentration. These results demonstrate that Pd will play a critical role in application for the TiZrNi quasicrystals as hydrogen storage materials. PMID:24266172

  8. Structural and tunable characteristics of Ba(Zr x Ti1- x )O3 films prepared by RF-magnetron sputtering using a metal target

    NASA Astrophysics Data System (ADS)

    Kim, Jin-Woong; Shima, Hiromi; Nishida, Ken; Yamamoto, Takashi; Funakubo, Hiroshi

    2014-08-01

    Ba(Zr x Ti1- x )O3 (BZT) thin films with different Zr contents were deposited on (100)MgO and (100)Pt/(100)MgO substrates by RF-magnetron sputtering using metal targets. The BZT thin films epitaxially grew on MgO substrates with only a (001)/(100) orientation and had a single perovskite phase. In all cases, Ba/Ti ratio was stoichiometric and the BZT films possessed a dense microstructure. The grain size decreased with increasing Zr content. At room temperature, a dielectric constant as a function of the DC bais (tunability) of nearly 30% was achieved at 1 MHz; meanwhile, a relatively low dielectric loss was obtained. Moreover, after a post-annealing process, the tunability was increased significantly. These results indicate that we succeeded in depositing high-quality, and potential tunable ferroelectrics.

  9. Electronic structure and magnetism of new ilmenite compounds for spintronic devices: FeBO3 (B = Ti, Hf, Zr, Si, Ge, Sn)

    NASA Astrophysics Data System (ADS)

    Ribeiro, R. A. P.; Camilo, A.; de Lazaro, S. R.

    2015-11-01

    First-principles calculations were performed in the framework of Density Functional Theory (DFT) within hybrid functional (B3LYP) to study the electronic structure and magnetic properties of new ilmenite FeBO3 (B=Ti, Hf, Zr, Si, Ge, Sn) materials. In particular, the magnetic exchange interaction between Fe2+ layers is dependent on the interlayer distance and it can be controlled by ionic radius of B-site cation. Thus, Fe(Ti, Si, Ge)O3 are antiferromagnetic materials, while Fe(Zr, Hf, Sn)O3 are ferromagnetic. We also argue that antiferromagnetic materials and FeZrO3 are convectional semiconductors, whereas FeHfO3 and FeSnO3 exhibit intrinsic half-metallic behavior, making them promising candidates for spintronic devices.

  10. Phase Relations at 1500°C in the Ternary System ZrO 2-Gd 2O 3-TiO 2

    NASA Astrophysics Data System (ADS)

    Feighery, A. J.; Irvine, J. T. S.; Zheng, C.

    2001-09-01

    Phase relations at 1500°C in the ternary system ZrO2-Gd2O3-TiO2 have been determined by the powder X-ray diffraction of samples prepared by standard solid state reaction. A large area of this ternary oxide system centered on the Gd2Ti2O7-Gd2Zr2O7 join was shown to exhibit the pyrochlore and defect fluorite structures. The pyrochlore structure was observed for stoichiometries as far from the ideal M4O7 as M4O6.7 and M4O7.4, although the degree of disorder seemed much higher at these stoichiometries. On further deviation from the ideal M4O7 stoichiometry a smooth transition to fluorite average structure was observed for Zr-rich compositions. None of the other binary phases were observed to show significant extent of solid solution into the ternary region.

  11. Tribological and corrosion behaviors of warm-and hot-rolled Ti-13Nb-13Zr alloys in simulated body fluid conditions.

    PubMed

    Lee, Taekyung; Mathew, Eshaan; Rajaraman, Santhosh; Manivasagam, Geetha; Singh, Ashok Kumar; Lee, Chong Soo

    2015-01-01

    Development of submicrocrystalline structure in biomedical alloy such as Ti-13Nb-13Zr (in wt%) through warm-rolling process has been found to enhance mechanical properties compared to conventional thermomechanical processing routes including hot-rolling process. The present study investigated the tribological and corrosion behaviors of warm-rolled (WR) and hot-rolled Ti-13Nb-13Zr alloys which have not been studied to date. Both tribological and corrosion experiments were carried out in simulated body fluid conditions (Hank's solution at 37°C) based on the fact that the investigated alloys would be used in a human body as orthopedic implants. The WR Ti-13Nb-13Zr demonstrated a submicrocrystalline structure that provided a significant enhancement in hardness, strength, and corrosion resistance. Meanwhile, there was no notable difference in wear resistance between the WR and hot-rolled samples despite the different microstructure and hardness. The present study confirmed the enormous potential of WR Ti-13Nb-13Zr with not only great mechanical properties but also high corrosion resistance in the simulated body fluid. PMID:26491322

  12. A study on the corrosion and erosion behavior of electroless nickel and TiAlN/ZrN duplex coatings on ductile iron

    NASA Astrophysics Data System (ADS)

    Lin, Chung-Kwei; Hsu, Cheng-Hsun; Cheng, Yin-Hwa; Ou, Keng-Liang; Lee, Sheng-Long

    2015-01-01

    This study utilized electroless nickel (EN) and cathodic arc evaporation (CAE) technologies to deposit protective coatings onto ductile iron. Polarization corrosion tests were performed in 3.5 wt.% sodium chloride, and also erosion tests were carried out by using Al2O3 particles (∼177 μm in size and Mohr 7 scale) of about 5 g. Surface morphologies of the corroded and eroded specimens were observed separately. To further understand the coating effects on both the corrosive and erosive behavior of ductile iron, coating structure, morphology, and adhesion were analyzed using X-ray diffractormeter, scanning electron microscopy, and Rockwell-C indenter, respectively. The results showed that the EN exhibited an amorphous structure while the CAE-TiAlN/ZrN coating was a multilayered nanocrystalline. When the TiAlN/ZrN coated specimen with EN interlayer could effectively increase the adhesion strength between the CAE coating and substrate. Consequently, the combination of TiAlN/ZrN and EN delivered a better performance than did the monolithic EN or TiAlN/ZrN for both corrosion and erosion protection.

  13. Screening of in vitro cytotoxicity, antioxidant potential and bioactivity of nano- and micro-ZrO2 and -TiO2 particles.

    PubMed

    Karunakaran, Gopalu; Suriyaprabha, Rangaraj; Manivasakan, Palanisamy; Yuvakkumar, Rathinam; Rajendran, Venkatachalam; Kannan, Narayanasamy

    2013-07-01

    Nanometal oxides are used in tissue engineering and implants. The increased use of nanoparticles suggests the need to study their adverse effects on biological systems. The present investigation explores in vitro cytotoxicity, antioxidant potential, and bioactivity of nano- and micro-particles such as zirconia (ZrO2) and titania (TiO2) on biological systems such as National Institute of Health (NIH) 3T3 mouse embryonic fibroblasts cell line, di(phenyl)-(2,4,6-trinitrophenyl) iminoazanium (DPPH) and simulated body fluid (SBF). The cell line viability % indicated that nano ZrO2 and TiO2 were less toxic than microparticles up to 200µgml(-1). DPPH assay revealed that the free radical scavenging potential of tested particles were higher for nano ZrO2 (76.9%) and nano TiO2 (73.3%) at 100mg than that for micron size particles. Calcium deposition percentage of micro- and nano-ZrO2 particles, after SBF study, showed 0.066% and 0.094% respectively, whereas for micro- and nano-TiO2, it was 0.251% and 0.615% respectively. FTIR results showed a good bioactivity through hydroxyapatite formation. The present investigation clearly shows that nanoparticles possess good antioxidant potential and better biocompatibility under in vitro conditions which are dose and size dependent. Hence, cytotoxicity itself is not promising evaluation method for toxicity rather than particles individual characterisation using antioxidant and bioactivity analysis.

  14. Evaluation of AlGaN/GaN high electron mobility transistors grown on ZrTi buffer layers with sapphire substrates

    DOE PAGESBeta

    Ren, Fan; Pearton, Stephen J.; Ahn, Shihyun; Lin, Yi -Hsuan; Machuca, Francisco; Weiss, Robert; Welsh, Alex; McCartney, Martha R.; Smith, David J.; Kravchenko, Ivan I.

    2016-09-21

    Here, AlGaN/GaN high electron mobility transistors (HEMTs) have been grown on sapphire substrates, using ZrTi buffer layers to provide in-plane lattice-matching to hexagonal GaN. X-ray diffraction (XRD) as well as cross-section transmission electron microscopy (TEM) were used to assess the quality of the HEMT structure. The XRD 2θ scans showed full-width-at-half-maximum values of 0.16°, 0.07°, and 0.08° for ZrTi alloy, GaN buffer layer, and the entire HEMT structure, respectively. TEM studies of the GaN buffer layer and the AlN/ZrTi/AlN stack showed the importance of growing thin AlN buffer layers on the ZrTi layer prior to growth of the GaN buffermore » layer. The density of threading dislocations in the GaN channel layer of the HEMT structure was estimated to be in the 108 cm–2 range. The HEMT device exhibited a saturation drain current density of 820 mA/mm, and the channel of the fabricated HEMTs could be well modulated. A cutoff frequency (fT) of 8.9 GHz and a maximum frequency of oscillation (fmax) of 17.3 GHz were achieved for HEMTs with gate dimensions of 1 × 200 μm.« less

  15. A thermal study on the structural changes of bimetallic ZrO2-modified TiO2 nanotubes synthesized using supercritical CO2.

    PubMed

    Lucky, R A; Charpentier, P A

    2009-05-13

    In this study the thermal behavior of bimetallic ZrO(2)-TiO(2) (10/90 mol/mol) nanotubes are discussed which were synthesized via a sol-gel process in supercritical carbon dioxide (scCO(2)). The effects of calcination temperature on the morphology, phase structure, mean crystallite size, specific surface area and pore volume of the nanotubes were investigated by using a variety of physiochemical techniques. We report that SEM and TEM images showed that the nanotubular structure was preserved at up to 800 degrees C calcination temperature. When exposed to higher temperatures (900-1000 degrees C) the ZrO(2)-TiO(2) tubes deformed and the crystallites fused together, forming larger crystallites, and a bimetallic ZrTiO(4) species was detected. These results were further examined using TGA, FTIR, XRD and HRTEM analysis. The BET textural properties demonstrated that the presence of a small amount of Zr in the TiO(2) matrix inhibited the grain growth, stabilized the anatase phase and increased the thermal stability. PMID:19420640

  16. Tribological and corrosion behaviors of warm-and hot-rolled Ti-13Nb-13Zr alloys in simulated body fluid conditions

    PubMed Central

    Lee, Taekyung; Mathew, Eshaan; Rajaraman, Santhosh; Manivasagam, Geetha; Singh, Ashok Kumar; Lee, Chong Soo

    2015-01-01

    Development of submicrocrystalline structure in biomedical alloy such as Ti-13Nb-13Zr (in wt%) through warm-rolling process has been found to enhance mechanical properties compared to conventional thermomechanical processing routes including hot-rolling process. The present study investigated the tribological and corrosion behaviors of warm-rolled (WR) and hot-rolled Ti-13Nb-13Zr alloys which have not been studied to date. Both tribological and corrosion experiments were carried out in simulated body fluid conditions (Hank’s solution at 37°C) based on the fact that the investigated alloys would be used in a human body as orthopedic implants. The WR Ti-13Nb-13Zr demonstrated a submicrocrystalline structure that provided a significant enhancement in hardness, strength, and corrosion resistance. Meanwhile, there was no notable difference in wear resistance between the WR and hot-rolled samples despite the different microstructure and hardness. The present study confirmed the enormous potential of WR Ti-13Nb-13Zr with not only great mechanical properties but also high corrosion resistance in the simulated body fluid. PMID:26491322

  17. Electrical and dielectric properties of ZnO and CeO{sub 2} doped ZrTi{sub 2}O{sub 6} ceramic

    SciTech Connect

    George, Aneesh; Thomas, Jijimon K.; John, Annamma; Solomon, Sam

    2014-01-28

    Zirconium oxide (ZrO{sub 2}) and titanium dioxide (TiO{sub 2}) are the important catalyst supports, since it has acidic and basic properties. The intermediate phase zirconium titanate ZrTi{sub 2}O{sub 6}, which is a solid solution with Zr:Ti ratio 1:2 has outstanding dielectric properties. The effects of doping of ZnO and CeO{sub 2} on the dielectric and electrical properties of ZrTi{sub 2}O{sub 6} ceramic are investigated. On adding 0.5 wt% ZnO, the dielectric constant is increased but, on adding CeO{sub 2}, the dielectric constant is decreased. The bulk density of pure sample sintered at 1530 °C is 91% of theoretical density while that of the doped samples sintered at 1450 °C is more than 94% of theoretical density. Scanning electron micrographs reveal that the samples are well sintered with minimum porosity. The semicircle behavior in the Cole-Cole plots at room temperature reveals that the samples are good ionic conductor. The induced impedance is reduced for doped samples and this can be used as a material for electrolyte in Solid Oxide Fuel Cell.

  18. Tribological and corrosion behaviors of warm-and hot-rolled Ti-13Nb-13Zr alloys in simulated body fluid conditions.

    PubMed

    Lee, Taekyung; Mathew, Eshaan; Rajaraman, Santhosh; Manivasagam, Geetha; Singh, Ashok Kumar; Lee, Chong Soo

    2015-01-01

    Development of submicrocrystalline structure in biomedical alloy such as Ti-13Nb-13Zr (in wt%) through warm-rolling process has been found to enhance mechanical properties compared to conventional thermomechanical processing routes including hot-rolling process. The present study investigated the tribological and corrosion behaviors of warm-rolled (WR) and hot-rolled Ti-13Nb-13Zr alloys which have not been studied to date. Both tribological and corrosion experiments were carried out in simulated body fluid conditions (Hank's solution at 37°C) based on the fact that the investigated alloys would be used in a human body as orthopedic implants. The WR Ti-13Nb-13Zr demonstrated a submicrocrystalline structure that provided a significant enhancement in hardness, strength, and corrosion resistance. Meanwhile, there was no notable difference in wear resistance between the WR and hot-rolled samples despite the different microstructure and hardness. The present study confirmed the enormous potential of WR Ti-13Nb-13Zr with not only great mechanical properties but also high corrosion resistance in the simulated body fluid.

  19. Phase evolution studies in CaZrTi2O7-RE2Ti2O7 (RE = Nd3+, Sm3+) system: Futuristic ceramic host matrices for nuclear waste immobilization

    NASA Astrophysics Data System (ADS)

    Jafar, M.; Achary, S. N.; Tyagi, A. K.

    2014-04-01

    Series of compositions with general stoichiometry as Ca1-xZr1-xRE2xTi2O7 (RE = Nd3+, Sm3+) were prepared by solid state reaction and characterized by powder x-ray diffraction technique to unravel the phase fields in the title systems. The phase fields in CaZrTi2O7-Nd2Ti2O7 and CaZrTi2O7-Sm2Ti2O7 systems differed significantly at the rareearth rich regions. The common phase fields like zirconolite-2M, zirconolite-4M, cubic perovskite are observed at the zirconolite rich regions of both systems. Depending on the structure of RE2Ti2O7 phase, the cubic pyrochlore or monoclinic RE2Ti2O7 phases are observed in the studied system. The observed phase fields in these two systems indicate ionic radius of the rare-earth ion has a dominating role in the phase relations. Further details of the phases and their homogeneity are explained in the text of the manuscript.

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

    SciTech Connect

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

    2007-02-15

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

  1. Controlled Ti seed layer assisted growth and field emission properties of Pb(Zr0.52Ti0.48)O3 nanowire arrays.

    PubMed

    Datta, Anuja; Mukherjee, Devajyoti; Hordagoda, Mahesh; Witanachchi, Sarath; Mukherjee, Pritish; Kashid, Ranjit V; More, Mahendra A; Joag, Dilip S; Chavan, Padmakar G

    2013-07-10

    We report on the directed upright growth of ferroelectric (FE) Pb(Zr0.52Ti0.48)O3 (PZT) nanowire (NW) arrays with large aspect ratios of >60 using a Ti seed layer assisted hydrothermal process over large surface areas on ITO/glass substrates. In a two-step growth process, Ti seed layer of low surface roughness with a thickness of ~500 nm and grain size of ~100 nm was first deposited by radio frequency (RF) sputtering which was subsequently used as substrates for the growth of highly dense, single crystalline PZT NWs by controlled nucleation. The electron emission properties of the PZT NWs were investigated using the as-grown NWs as FE cathodes. A low turn-on field of ~3.4 V/μm was obtained from the NW arrays, which is impressively lower than that from other reported values. The results reported in this work give direction to the development of a facile growth technique for PZT NWs over large surfaces and also are of interest to the generation of high current electron beam from FE NW based cathodes for field emitter applications.

  2. Enhancement of the Electrical Properties in BaTiO3/PbZr0.52Ti0.48O3 Ferroelectric Superlattices.

    PubMed

    He, Bin; Wang, Zhanjie

    2016-03-01

    In this study, BaTiO3/Pb(Zr0.52Ti0.48)O3 (BTO/PZT) ferroelectric superlattices have been grown on the Nb-doped SrTiO3 (NSTO) single-crystal substrate by pulsed laser deposition, and their electrical properties were investigated in detail. The leakage current was reduced significantly in the BTO/PZT superlattices, and the conduction mechanism could be interpreted as the bulk-limited mechanism. In addition, a more symmetric hysteresis loop was observed in the BTO/PZT superlattices compared with the pure PZT and BTO films. The BTO/PZT superlattices with the modulation thickness of 9.8 nm showed remarkably improved dielectric properties with dielectric constant and loss of 684 and 0.02, respectively, measured at the frequency of 10 kHz. Based on these experimental results, it can be considered that the BTO/PZT interfaces play a very important role for the enhanced electrical properties of the BTO/PZT superlattices. PMID:26913563

  3. Deformation-induced ω phase in modified Ti-29Nb-13Ta-4.6Zr alloy by Cr addition.

    PubMed

    Li, Qiang; Niinomi, Mitsuo; Hieda, Junko; Nakai, Masaaki; Cho, Ken

    2013-08-01

    For spinal-fixation applications, implants should have a high Young's modulus to reduce springback during operations, though a low Young's modulus is required to prevent stress shielding for patients after surgeries. In the present study, Ti-29Nb-13Ta-4.6Zr alloy (TNTZ) with a low Young's modulus was modified by adding Cr to obtain a higher deformation-induced Young's modulus in order to satisfy these contradictory requirements. Two newly designed alloys, TNTZ-8Ti-2Cr and TNTZ-16Ti-4Cr, possess more stable β phases than TNTZ. These alloys consist of single β phases and exhibit relatively low Young's moduli of <65GPa after solution treatment. However, after cold rolling, they exhibit higher Young's moduli owing to a deformation-induced ω-phase transformation. These modified TNTZ alloys show significantly less springback than the original TNTZ alloy based on tensile and bending loading-unloading tests. Thus, the Cr-added TNTZ alloys are beneficial for spinal-fixation applications. PMID:23624220

  4. Effect of Pore Structure Regulation on the Properties of Porous TiNbZr Shape Memory Alloys for Biomedical Application

    NASA Astrophysics Data System (ADS)

    Lai, Ming; Gao, Yan; Yuan, Bin; Zhu, Min

    2015-01-01

    Recently, porous Ti-Nb-based shape memory alloys have been considered as promising implants for biomedical application, because of their non-toxic elements, low elastic modulus, and stable superelasticity. However, the inverse relationship between pore characteristics and superelasticity of porous SMAs will strongly affect their clinical application. Until now, there have been few works specifically focusing on the effect of pore structure on the mechanical properties and superelasticity of porous Ti-Nb-based SMAs. In this study, the pore structure, including porosity and pore size, of porous Ti-22Nb-6Zr alloys was successfully regulated by adjusting the amount and size of space-holder particles. XRD and SEM investigation showed that all these porous alloys had homogeneous composition. Compression tests indicated that porosity played an important role in the mechanical properties and superelasticity of these porous alloys. Those alloys with porosity in the range of 38.5%-49.7% exhibited mechanical properties approaching to cortical bones, with elastic modulus, compressive strength, and recoverable strain in the range of 7.2-11.4 GPa, 188-422 MPa, and 2.4%-2.6%, respectively. Under the same porosity, the alloys with larger pores exhibited lower elastic modulus, while the alloys with smaller pores presented higher compressive strength.

  5. Ab initio calculations of SrTiO3, BaTiO3, PbTiO3, CaTiO3, SrZrO3, PbZrO3 and BaZrO3 (001), (011) and (111) surfaces as well as F centers, polarons, KTN solid solutions and Nb impurities therein

    NASA Astrophysics Data System (ADS)

    Eglitis, R. I.

    2014-03-01

    In this paper, the review of recent results of calculations of surface relaxations, energetics, and bonding properties for ABO3 perovskite (001), (011) and (111) surfaces using mostly a hybrid description of exchange and correlation is presented. Both AO and BO2-terminations of the nonpolar (001) surface and A, BO, and O terminations of the polar (011) surface, as well as B and AO3-terminations of the polar (111) surface were considered. On the AO-terminated (001) surface, all upper-layer A atoms relax inwards, while all second layer atoms relax outwards. For the BO2-terminated (001) surface, in most cases, the largest relaxations are on the second-layer metal atoms. For almost all ABO3 perovskites, the surface rumpling is much larger for the AO-terminated than for the BO2-terminated (001) surface, but their surface energies are always quite similar. In contrast, different terminations of the (011) ABO3 surface lead to very different surface energies for the O-terminated, A-terminated, and BO-terminated (011) surface, respectively. A considerable increase in the Ti-O or Zr-O, respectively, chemical bond covalency near the (011) surface as compared both to the bulk and to the (001) surface in ABO3 perovskites were predicted. According to the results of ab initio calculations for Nb doped SrTiO3, Nb is a shallow donor; six nearest O ions are slightly displaced outwards from the Nb ion. The F center in ABO3 perovskites resembles electron defects in the partially-covalent SiO2 crystal rather than usual F centers in ionic crystals like MgO and alkali halides. The results of calculations for several perovskite KNbxTa1-xO3 (KTN) solid solutions, as well as hole and electron polarons in ABO3 perovskites are analyzed.

  6. Comparison of bio-mineralization behavior of Ti-6Al-4V-1Nb and Zr-1Nb nano-tubes formed by anodization

    NASA Astrophysics Data System (ADS)

    Choi, Yong; Hong, Sun I.

    2014-12-01

    Nano-tubes of titanium and zirconium alloys like Ti-6Al-4V-1Nb and Zr-1Nb were prepared by anodization followed by coating with hydroxylapatite (HA) and their bio-mineralization behaviors were compared to develop a bio-compatible material for implants in orthopedics, dentistry and cardiology. Ti-6Al-4V-1Nb weight gain in a simulated body solution increased gradually. The bigger tube diameter was, the heavier HA was deposited. Surface roughness of both alloys increased highly with the increasing diameter of nano-tube. Their surface roughness decreased by HA deposition due to the removal of the empty space of the nano-tubes. Zr-1Nb alloy had faster growth of nano-tubes layers more than Ti-6Al-4V-1Nb alloy.

  7. Corrosion behaviour of heat treated boron free and boron containing Ti-13Zr-13Nb (wt%) alloy in simulated body fluid.

    PubMed

    Majumdar, P; Singh, S B; Chatterjee, U K; Chakraborty, M

    2011-04-01

    The corrosion behaviour of heat treated Ti-13Zr-13Nb (TZN) and Ti-13Zr-13Nb-0.5B (TZNB) alloys in Hank's solution has been investigated. The microstructure of the heat treated TZN alloy consisted of α, β or martensite. Addition of boron to TZN alloy led to the formation of dispersed TiB particles and modification of microstructure. In general, the furnace cooled TZN sample showed lower corrosion potential (E(corr)) than the air cooled sample. Aging of water quenched samples decreased the E(corr) value. The passive current density of TZN samples varied within a narrow range. Presence of boron in TZN alloy decreased the corrosion potential and substantially increased the passive current density. Results showed that boron deteriorated the corrosion resistance of TZN alloy.

  8. Effect of electron count and chemical complexity in the Ta-Nb-Hf-Zr-Ti high-entropy alloy superconductor

    DOE PAGESBeta

    von Rohr, Fabian; Winiarski, Michał J.; Tao, Jing; Klimczuk, Tomasz; Cava, Robert Joseph

    2016-11-01

    High-entropy alloys are made from random mixtures of principal elements on simple lattices, stabilized by a high mixing entropy. The recently discovered body-centered cubic (BCC) Ta-Nb-Hf-Zr-Ti high-entropy alloy superconductor appears to display properties of both simple crystalline intermetallics and amorphous materials; e.g., it has a well-defined superconducting transition along with an exceptional robustness against disorder. Here we show that the valence electron count dependence of the superconducting transition temperature in the high-entropy alloy falls between those of analogous simple solid solutions and amorphous materials and test the effect of alloy complexity on the superconductivity. We propose high-entropy alloys as excellentmore » intermediate systems for studying superconductivity as it evolves between crystalline and amorphous materials.« less

  9. Note: a high-sensitivity current sensor based on piezoelectric ceramic Pb(Zr,Ti)O3 and ferromagnetic materials.

    PubMed

    He, Wei; Li, Ping; Wen, Yumei; Zhang, Jitao; Yang, Aichao; Lu, Caijiang

    2014-02-01

    An electric current sensor using piezoelectric ceramic Pb(Zr,Ti)O3 (PZT) sandwiched between two high permeability cuboids and two NdFeB magnets is presented. The magnetic field originating from an electric wire is augmented by the high permeability cuboids. The PZT plate experiences an enhanced magnetic force and generates voltage output. When placed with a distance of d = 5.0 mm from the wire, the sensor shows a flat sensitivity of ∼5.7 mV/A in the frequency range of 30 Hz-80 Hz and an average sensitivity of 5.6 mV/A with highly linear behavior in the current range of 1 A-10 A at 50 Hz.

  10. Zr and Sn substituted (Na0.5Bi0.5)TiO3 -based solid solutions

    NASA Astrophysics Data System (ADS)

    Ishchuk, V. M.; Gusakova, L. G.; Kisel, N. G.; Kuzenko, D. V.; Spiridonov, N. A.; Sobolev, V. L.

    2016-02-01

    The paper attempts to investigate the phase formation of a Zr- and Sn-substituted [(Na0.5Bi0.5)0.80Ba0.20](Ti1-yBy)O3 system during its solid state synthesis. The synthesis was found to be a multi-step process associated with the formation of a number of intermediate phases which however depended on the compositions and sintering temperatures. Single phase solid solutions were obtained when the sintering temperature was increased to 1000 °C-1100 °C. Increase in the concentration of substituting ions, on the one hand, tends to linearly increase the crystal cell size whereas the tolerance factor, on the other hand, gets reduced bolstering the stability of anti-ferroelectric phase as compared to that of ferroelectric phase’.

  11. Positron annihilation studies of vacancy related defects in ceramic and thin film Pb(Zr,Ti)O{sub 3} materials

    SciTech Connect

    Keeble, D.J.; Krishnan, A.; Umlor, M.T.; Lynn, K.G.; Warren, W.L.; Dimos, D.; Tuttle, B.A.; Ramesh, R.; Poindexter, E.H.

    1994-07-01

    Preliminary positron annihilation studies of ceramic and thin film Pb(Zr,Ti)O{sub 3} (PZT) materials have been completed. This paper examines effects of processing conditions on vacancy related defects. Positron lifetime measurements on bulk PLZT plates showed an increase in positron trapping to a defect state with increasing grain size consistent with trapping to lead vacancy related defects formed through lead oxide loss during processing. Variable energy positron beam measurements were completed on bulk PLZT plates, sol-gel PZT thin films and laser ablated PLZT thin films. Films processed in a reduced oxygen atmosphere were found to give a higher S-parameter, due to an increase in concentration of neutral or negatively charged vacancy type defects, compared with material processed in an oxidizing ambient.

  12. Indium and gallium diffusion through zirconia in the TiN/ZrO{sub 2}/InGaAs stack

    SciTech Connect

    Ceballos-Sanchez, O.; Martinez, E.; Guedj, C.; Veillerot, M.; Herrera-Gomez, A.

    2015-06-01

    Angle-resolved X-ray Photoelectron Spectroscopy (ARXPS) was applied to the TiN/ZrO{sub 2}/InGaAs stack to assess its thermal stability. Through a robust ARXPS analysis, it was possible to observe subtle effects such as the thermally induced diffusion of substrate atomic species (In and Ga) through the dielectric layer. The detailed characterization of the film structure allowed for assessing the depth profiles of the diffused atomic species by means of the scenarios-method. Since the quantification for the amount of diffused material was done at different temperatures, it was possible to obtain an approximate value of the activation energy for the diffusion of indium through zirconia. The result is very similar to the previously reported values for indium diffusion through alumina and through hafnia.

  13. Structure and mechanical properties of coatings fabricated by nonvacuum electron beam cladding of Ti-Ta-Zr powder mixtures

    NASA Astrophysics Data System (ADS)

    Samoylenko, Vitaliy V.; Lenivtseva, Olga G.; Polyakov, Igor A.; Laptev, Ilya S.

    2015-10-01

    In this paper structural investigations and mechanical tests of Ti-Ta-Zr coatings obtained on surfaces of cp-titanium workpieces were carried out. It was found that the coatings had a dendrite structure; investigations at high-power magnifications revealed a platelet structure. An increase of tantalum concentration led to refinement of structural components. The microhardness level of all coatings, excepting a specimen with the maximum tantalum content, was 370 HV. The microhardness of this coating reached 400 HV. The ultimate tensile strength of cladded layers varied from 697 to 947 MPa. Adhesion tests showed that bimetallic composites were characterized by high bond strength of cladded layers to the substrate, which exceeded cp-titanium strength characteristics.

  14. Negligible substrate clamping effect on piezoelectric response in (111)-epitaxial tetragonal Pb(Zr, Ti)O{sub 3} films

    SciTech Connect

    Yamada, Tomoaki; Yasumoto, Jun; Ito, Daisuke; Yoshino, Masahito; Nagasaki, Takanori; Sakata, Osami; Imai, Yasuhiko; Kiguchi, Takanori; Shiraishi, Takahisa; Shimizu, Takao; Funakubo, Hiroshi

    2015-08-21

    The converse piezoelectric responses of (111)- and (001)-epitaxial tetragonal Pb(Zr{sub 0.35}Ti{sub 0.65})O{sub 3} [PZT] films were compared to investigate the orientation dependence of the substrate clamping effect. Synchrotron X-ray diffraction (XRD) and piezoelectric force microscopy revealed that the as-grown (111)-PZT film has a polydomain structure with normal twin boundaries that are changed by the poling process to inclined boundaries, as predicted by Romanov et al. [Phys. Status Solidi A 172, 225 (1999)]. Time-resolved synchrotron XRD under bias voltage showed the negligible impact of substrate clamping on the piezoelectric response in the (111)-PZT film, unlike the case for (001)-PZT film. The origin of the negligible clamping effect in the (111)-PZT film is discussed from the viewpoint of the elastic properties and the compensation of lattice distortion between neighboring domains.

  15. Functional fatigue behavior of superelastic beta Ti-22Nb-6Zr(at%) alloy for load-bearing biomedical applications.

    PubMed

    Sheremetyev, V; Brailovski, V; Prokoshkin, S; Inaekyan, K; Dubinskiy, S

    2016-01-01

    Ti-22Nb-6Zr (at.%) alloy with different processing-induced microstructures (highly-dislocated partially recovered substructure, polygonized nanosubgrained (NSS) dislocation substructure, and recrystallized structure) was subjected to strain-controlled tension-tension fatigue testing in the 0.2...1.5% strain range (run-out at 10^6 cycles). The NSS alloy obtained after cold-rolling with 0.3 true strain and post-deformation annealing at 600 °C showed the lowest Young's modulus and globally superior fatigue performance due to the involvement of reversible stress-induced martensitic transformation in the deformation process. This NSS structure appears to be suitable for biomedical applications with an extended variation range of loading conditions (orthopedic implants).

  16. Temperature-dependent dielectric and energy-storage properties of Pb(Zr,Sn,Ti)O3 antiferroelectric bulk ceramics

    NASA Astrophysics Data System (ADS)

    Chen, Xuefeng; Liu, Zhen; Xu, Chenhong; Cao, Fei; Wang, Genshui; Dong, Xianlin

    2016-05-01

    The dielectric and energy-storage properties of Pb0.99Nb0.02[(Zr0.60Sn0.40)0.95Ti0.05]0.98O3 (PNZST) bulk ceramics near the antiferroelectric (AFE)-ferroelectric (FE) phase boundary are investigated as a function of temperature. Three characteristic temperatures T0, TC, T2 are obtained from the dielectric temperature spectrum. At different temperature regions (below T0, between T0 and TC, and above TC), three types of hysteresis loops are observed as square double loop, slim loop and linear loop, respectively. The switching fields and recoverable energy density all first increase and then decrease with increasing temperature, and reach their peak values at ˜T0. These results provide a convenient method to optimize the working temperature of antiferroelectric electronic devices through testing the temperature dependent dielectric properties of antiferroelectric ceramics.

  17. Structure and mechanical properties of coatings fabricated by nonvacuum electron beam cladding of Ti-Ta-Zr powder mixtures

    SciTech Connect

    Samoylenko, Vitaliy V. Lenivtseva, Olga G. Polyakov, Igor A. Laptev, Ilya S.

    2015-10-27

    In this paper structural investigations and mechanical tests of Ti-Ta-Zr coatings obtained on surfaces of cp-titanium workpieces were carried out. It was found that the coatings had a dendrite structure; investigations at high-power magnifications revealed a platelet structure. An increase of tantalum concentration led to refinement of structural components. The microhardness level of all coatings, excepting a specimen with the maximum tantalum content, was 370 HV. The microhardness of this coating reached 400 HV. The ultimate tensile strength of cladded layers varied from 697 to 947 MPa. Adhesion tests showed that bimetallic composites were characterized by high bond strength of cladded layers to the substrate, which exceeded cp-titanium strength characteristics.

  18. Simultaneously Enhancing the Ductility and Strength in a Hierarchical and Multiphase Nanolaminated TiZrAlV

    NASA Astrophysics Data System (ADS)

    Shi, Yindong; Wang, Lina; Wu, Chunxia

    2015-12-01

    High strength and ductility are the prerequisite for structural materials for wide applications. Here, a simultaneous enhancement of both the ductility and strength is reported in a hierarchical and multiphase nanolaminated (HMN) TiZrAlV prepared via thermomechanical processing treatments. An excellent combination of high ultimate tensile strength of σb ~ 1550 MPa and good elongation to failure of ɛf ~ 8.0% is obtained in an appropriate HMN structure that consists of nanoscale α″ martensites, submicroscale α plates, and large microscale primary αp grains, much better than that (σb ~ 1440 MPa, ɛf ~ 3.6%) of its coarse-laminated counterpart without primary αp grains. The present study is significant for the enhancement of strength and ductility of engineering materials via the design of hierarchical-laminated structure.

  19. Bioactive surface modification of Ti-29Nb-13Ta-4.6Zr alloy through alkali solution treatments.

    PubMed

    Takematsu, E; Katsumata, K; Okada, K; Niinomi, M; Matsushita, N

    2016-05-01

    Bioactive surface modification of Ti-29Nb-13Ta-4.6Zr alloy (TNTZ) was performed through three different alkali solution treatments, including the electrochemical (E), hydrothermal (H), and hydrothermal-electrochemical (HE) processes; all of the processes lead to the formation of sodium-contained amorphous titanium oxide layers on TNTZ samples. The TNTZ samples subjected to the E, H, and HE processes exhibit a flat surface, smooth and fine mesh-like structure surface, and rough mesh-like structure surface, respectively. In the bioactive test, namely, simulated body fluid test, apatite inductivity increases as the surface morphology becomes rough. The order of inductivity for the three processes was HE>H>E. The surface chemical composition also affects the apatite induction ability. The surface with fewer niobium species exhibits better apatite inductivity. PMID:26952470

  20. Investigation on preparation and properties of Pb(Zr 0.95Ti 0.05)O 3 thin films

    NASA Astrophysics Data System (ADS)

    Zeng, Hui; Wu, Ping; Dong, Daxing; Zhang, Peng

    2011-01-01

    The preparation process, micro-structure and electrical properties of Pb(Zr xTi 1-x)O 3 (PZT) thin films were investigated in this paper. The Ag/PZT( x = 0.95)/YBCO/Si thin films were prepared by pulsed laser deposition (PLD). Si was the substrate; Ag and YBCO were the top electrode and the bottom electrode respectively. The bottom electrode YBCO was deposited on the Si substrate by PLD, and PZT was epitaxially deposited on YBCO also by PLD. After rapidly annealing, the AFM, XRD and the analysis of their electrical characters showed the films had good ferroelectric and pyroelectric properties. At 50 °C, the pyroelectric coefficient ( p) was 3.5 × 10 -8 C/(cm 2 K), the remanent polarization ( P r) and the coercive field ( E c) were 43.6 μC/cm 2 and 19.3 kV/cm respectively.

  1. Negligible substrate clamping effect on piezoelectric response in (111)-epitaxial tetragonal Pb(Zr, Ti)O3 films

    NASA Astrophysics Data System (ADS)

    Yamada, Tomoaki; Yasumoto, Jun; Ito, Daisuke; Sakata, Osami; Imai, Yasuhiko; Kiguchi, Takanori; Shiraishi, Takahisa; Shimizu, Takao; Funakubo, Hiroshi; Yoshino, Masahito; Nagasaki, Takanori

    2015-08-01

    The converse piezoelectric responses of (111)- and (001)-epitaxial tetragonal Pb(Zr0.35Ti0.65)O3 [PZT] films were compared to investigate the orientation dependence of the substrate clamping effect. Synchrotron X-ray diffraction (XRD) and piezoelectric force microscopy revealed that the as-grown (111)-PZT film has a polydomain structure with normal twin boundaries that are changed by the poling process to inclined boundaries, as predicted by Romanov et al. [Phys. Status Solidi A 172, 225 (1999)]. Time-resolved synchrotron XRD under bias voltage showed the negligible impact of substrate clamping on the piezoelectric response in the (111)-PZT film, unlike the case for (001)-PZT film. The origin of the negligible clamping effect in the (111)-PZT film is discussed from the viewpoint of the elastic properties and the compensation of lattice distortion between neighboring domains.

  2. Bioactive surface modification of Ti-29Nb-13Ta-4.6Zr alloy through alkali solution treatments.

    PubMed

    Takematsu, E; Katsumata, K; Okada, K; Niinomi, M; Matsushita, N

    2016-05-01

    Bioactive surface modification of Ti-29Nb-13Ta-4.6Zr alloy (TNTZ) was performed through three different alkali solution treatments, including the electrochemical (E), hydrothermal (H), and hydrothermal-electrochemical (HE) processes; all of the processes lead to the formation of sodium-contained amorphous titanium oxide layers on TNTZ samples. The TNTZ samples subjected to the E, H, and HE processes exhibit a flat surface, smooth and fine mesh-like structure surface, and rough mesh-like structure surface, respectively. In the bioactive test, namely, simulated body fluid test, apatite inductivity increases as the surface morphology becomes rough. The order of inductivity for the three processes was HE>H>E. The surface chemical composition also affects the apatite induction ability. The surface with fewer niobium species exhibits better apatite inductivity.

  3. Enhanced thermoelectric performance in the p-type half-Heusler (Ti/Zr/Hf)CoSb0.8Sn0.2 system via phase separation.

    PubMed

    Rausch, Elisabeth; Balke, Benjamin; Ouardi, Siham; Felser, Claudia

    2014-12-14

    A novel approach for optimization of the thermoelectric properties of p-type Heusler compounds with a C1b structure was investigated. A successful recipe for achieving intrinsic phase separation in the n-type material based on the TiNiSn system is isoelectronic partial substitution of Ti with its heavier homologues Zr and Hf. We applied this concept to the p-type system MCoSb0.8Sn0.2 by a systematic investigation of samples with different compositions at the Ti position (M = Ti, Zr, Hf, Ti0.5Zr0.5, Zr0.5Hf0.5, and Ti0.5Hf0.5). We thus achieved an approximately 40% reduction of the thermal conductivity and a maximum figure of merit ZT of 0.9 at 700 °C. This is a 80% improvement in peak ZT from 0.5 to 0.9 at 700 °C compared to the best published value of an ingot p-type half-Heusler compound. Thus far, comparable good thermoelectric p-type materials of this structure type have only been realized by a nanostructuring process via ball milling of premelted ingot samples followed by a rapid consolidation method, like hot pressing. The herein-presented simple arc-melting fabrication method reduces the fabrication time as compared to this multi-step nanostructuring process. The high mechanical stability of the Heusler compounds is favorable for the construction of thermoelectric modules. The Vickers hardness values are close to those of the n-type material, leading to good co-processability of both materials.

  4. 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

  5. Processing, structure and tribological property relations of ternary Zn-Ti-O and quaternary Zn-Ti-Zr-O nanocrystalline coatings

    NASA Astrophysics Data System (ADS)

    Ageh, Victor

    Conventional liquid lubricants are faced with limitations under extreme cyclic operating conditions, such as in applications that require lubrication when changing from atmospheric pressure to ultrahigh vacuum and ambient air to dry nitrogen (e.g., satellite components), and room to elevated (>500°C) temperatures (e.g., aerospace bearings). Alternatively, solid lubricant coatings can be used in conditions where synthetic liquid lubricants and greases are not applicable; however, individual solid lubricant phases usually perform best only for a limited range of operating conditions. Therefore, solid lubricants that can adequately perform over a wider range of environmental conditions are needed, especially during thermal cycling with temperatures exceeding 500°C. One potential material class investigated in this dissertation is lubricious oxides, because unlike other solid lubricant coatings they are typically thermodynamically stable in air and at elevated temperatures. While past studies have been focused on binary metal oxide coatings, such as ZnO, there have been very few ternary oxide and no reported quaternary oxide investigations. The premise behind the addition of the third and fourth refractory metals Ti and Zr is to increase the number of hard and wear resistant phases while maintaining solid lubrication with ZnO. Therefore, the major focus of this dissertation is to investigate the processing-structuretribological property relations of composite ZnO, TiO2 and ZrO2 phases that form ternary (ZnTi)xOy and quaternary (ZnTiZr) xOy nanocrystalline coatings. The coatings were processed by atomic layer deposition (ALD) using a selective variation of ALD parameters. The growth structure and chemical composition of as-deposited and ex situ annealed ternary and quaternary oxide coatings were studied by combined x-ray diffraction/focused ion beam microscopy/cross-sectional transmission electron microscopy, and x-ray photoelectron spectroscopy/Auger electron

  6. Ab initio molecular dynamics simulations of ion–solid interactions in Gd2Zr2O7 and Gd2Ti2O7

    SciTech Connect

    Wang, X. J.; Xiao, Haiyan Y.; Zu, Xiaotao; Zhang, Yanwen; Weber, William J.

    2012-12-21

    The development of the ab initio molecular dynamics (AIMD) method has made it a powerful tool in describing ion–solid interactions in materials, with the determination of threshold displacement energies with ab initio accuracy, and prediction of a new mechanism for defect generation and new defective states that are different from classical molecular dynamics (MD) simulations. In the present work, this method is employed to study the low energy recoil events in Gd2Zr2O7 and Gd2Ti2O7. The weighted average threshold displacement energies in Gd2Zr2O7 are determined to be 38.8 eV for Gd, 41.4 eV for Zr, 18.6 eV for O48f, and 15.6 eV for O8b, which are smaller than the respective values of 41.8, >53.8, 22.6 and 16.2 eV in Gd2Ti2O7. It reveals that all the ions in Gd2Zr2O7 are more easily displaced than those in Gd2Ti2O7, and anion order–disorder is more likely to be involved in the displacement events than cation disordering. The average charge transfer from the primary knock-on atom to its neighbors is estimated to be [similar]0.15, [similar]0.11 to 0.27 and [similar]0.1 to 0.13 |e| for Gd, Zr (or Ti), and O, respectively. Neglecting the charge transfer in the interatomic potentials may result in the larger threshold displacement energies in classical MD.

  7. Ab initio molecular dynamics simulations of ion–solid interactions in Gd2Zr2O7 and Gd2Ti2O7

    SciTech Connect

    Wang, X. J.; Xiao, H. Y.; Zu, X. T.; Zhang, Y.; Weber, W. J.

    2013-01-01

    The development of ab initio molecular dynamics (AIMD) method has made it a powerful tool in describing ion-solid interactions in materials, with identification determination of threshold displacement energies with ab initio accuracy, and prediction of new mechanism for defect generation and new defective states that are different from classical molecular dynamics (MD) simulations. In the present work, this method is employed to study the low energy recoil events in Gd2Zr2O7 and Gd2Ti2O7. The weighted average threshold displacement energies in Gd2Zr2O7 are determined to be 38.8 eV for Gd, 41.4 eV for Zr, 18.6 eV for O48f, and 15.6 eV for O8b, which are smaller than the respective values of 41.8, >53.8, 22.6 and 16.2 eV in Gd2Ti2O7. It reveals that all the ions in Gd2Zr2O7 are more easily displaced than those in Gd2Ti2O7, and anion order-disorder are more likely to be involved in the displacement events than cation disordering. The average charge transfer from the primary knock-on atom to its neighbors is estimated to be ~0.15, ~0.11-0.27 and ~0.1-0.13 |e| for Gd, Zr (or Ti), and O, respectively. Negligence of the charge transfer in the interatomic potentials may result in the larger threshold displacement energies in classical MD.

  8. Orthorhombic-tetragonal phase coexistence and enhanced piezo-response at room temperature in Zr, Sn, and Hf modified BaTiO{sub 3}

    SciTech Connect

    Kalyani, Ajay Kumar; Brajesh, Kumar; Ranjan, Rajeev; Senyshyn, Anatoliy

    2014-06-23

    The effect of Zr, Hf, and Sn in BaTiO{sub 3} has been investigated at close composition intervals in the dilute concentration limit. Detailed structural analysis by x-ray and neutron powder diffraction revealed that merely 2 mol. % of Zr, Sn, and Hf stabilizes a coexistence of orthorhombic (Amm2) and tetragonal (P4mm) phases at room temperature. As a consequence, all the three systems show substantial enhancement in the longitudinal piezoelectric coefficient (d{sub 33}), with Sn modification exhibiting the highest value ∼425 pC/N.

  9. Broadband dielectric response of Ba(Zr,Ti)O3 ceramics: From incipient via relaxor and diffuse up to classical ferroelectric behavior

    NASA Astrophysics Data System (ADS)

    Nuzhnyy, D.; Petzelt, J.; Savinov, M.; Ostapchuk, T.; Bovtun, V.; Kempa, M.; Hlinka, J.; Buscaglia, V.; Buscaglia, M. T.; Nanni, P.

    2012-07-01

    Dielectric responses of ceramics from the lead-free isovalent BaZrO3-BaTiO3 (BZT) system were investigated from Hz frequencies up to the infrared in a broad temperature range, 10-700 K. Pure BaZrO3 is a displacive weak-incipient ferroelectric with a simple cubic perovskite structure down to low temperatures, whose dielectric response is fully determined by polar phonons, the lowest-frequency one being of the Last type, unlike BaTiO3, where it is of the Slater type. BaZr0.4Ti0.6O3 is a relaxor ferroelectric whose dielectric anomaly is caused by a strong, overdamped excitation, which softens from the THz down to MHz range according to the Arrhenius law and merges into a constant-loss background at low temperatures. Such a reponse is similar to lead-containing and heterovalent relaxors, but unlike them, the lowest-frequency TO1 polar phonon does not soften appreciably. In the case of BaZr0.2Ti0.8O3 we have investigated the dynamic response connected with a diffuse ferroelectric phase transition. The main dielectric anomaly is again due to similar overdamped THz-microwave excitation, which, however, softens only to the GHz range near the transition temperature and below it merges with a near-constant-loss background. The picture of polar nanoregions in BZT differs from that in heterovalent relaxors, because they are pinned to the regions of the off-centered Ti4+ ions, which are frozen in our temperature range. Therefore we assign the soft relaxations to hopping of the off-centered Ti4+ ions. This is compared with the behavior of pure BaTiO3 ceramics, in which the hopping of the off-centered Ti4+ ions also substantially contributes to the phase transition dynamics. Unlike BaTiO3, the dynamic instability, which is responsible for the diffuse ferroelectric and relaxor behavior in BZT, is fully due to the hopping dynamics of the off-centered Ti4+ ions rather than due to soft phonons, and therefore the diffuse transition is of the order-disorder type.

  10. Local structure of Ba(1-x)Sr(x)TiO3 and BaTi(1-y)Zr(y)O3 nanocrystals probed by X-ray absorption and X-ray total scattering.

    PubMed

    Rabuffetti, Federico A; Brutchey, Richard L

    2013-12-23

    The effect of isovalent chemical substitution on the magnitude and coherence length of local ferroelectric distortions present in sub-20 nm Ba(1-x)Sr(x)TiO3 (x = 0.0, 0.30, 0.50, 1.0) and BaTi(1-y)Zr(y)O3 (y = 0.0, 0.15, 0.50, 1.0) nanocrystals synthesized at room temperature is investigated using X-ray absorption near edge structure (XANES) and pair distribution function analysis of X-ray total scattering data (PDF). Although the average crystal structure of the nanocrystals is adequately described by a centrosymmetric, cubic Pm3m space group, local ferroelectric distortions due to the displacement of the titanium atom from the center of the perovskite lattice are observed for all compositions, except BaZrO3. The symmetry of the ferroelectric distortions is adequately described by a tetragonal P4mm space group. The magnitude of the local displacements of the titanium atom in BaTiO3 nanocrystals is comparable to that observed in single crystals and bulk ceramics, but the coherence length of their ferroelectric coupling is much shorter (≤20 Å). Substitution of Sr(2+) for Ba(2+) and of Zr(4+) for Ti(4+) induces a tetragonal-to-cubic transition of the room temperature local crystal structure, analogous to that observed for single crystals and bulk ceramics at similar compositions. This transition is driven by a reduction of the magnitude of the local displacements of the titanium atom and/or of the coherence length of their ferroelectric coupling. Replacing 50% of Ba(2+) with Sr(2+) slightly reduces the magnitude of the titanium displacement, but the coherence length is not affected. In contrast, replacing 15% of the ferroelectrically active Ti(4+) with Zr(4+) leads to a significant reduction of the coherence length. Deviations from the ideal solid solution behavior are observed in BaTi(1-y)Zr(y)O3 nanocrystals and are attributed to an inhomogeneous distribution of the barium atoms in the nanocrystal. Composition-structure relationships derived for Ba(1-x)Sr(x)TiO3

  11. Ultraviolet-accelerated formation of bone-like apatite on oxidized Ti-24Nb-4Zr-7.9Sn alloy

    NASA Astrophysics Data System (ADS)

    Chen, Min-Fang; Zhang, Jing; You, Chen

    2013-12-01

    A novel method has been developed to rapidly deposit bone-like apatite with the assistance of ultraviolet (UV) light irradiation on the nanostructured titania in the simulated body fluid (SBF). The process has three main steps: Ti-24Nb-4Zr-7.9Sn alloy was heated at 650°C for 3 h, UV-light illumination in air for 4 h and soaking in the SBF for 3 d. A titania coating consisted of main rutile formed on the thermal oxidized Ti-24Nb-4Zr-7.9Sn alloy. The UV not only converted the rutile surface from hydrophilic to hydrophobic but also stimulated high surface activity. After 4 h UV illumination, the contents of Ti3+ and hydroxyl groups on the oxidized sample were increased, while that of lattice O decreased. After 3 d of soaking in the SBF, a compact and uniform layer of carbonated hydroxyapatite (CHA) particles was formed on the UV-illuminated rutile surface whereas there was a few of HA to be viewed on the surface of as-oxidized Ti-24Nb-4Zr-7.9Sn alloy. Our study demonstrates a simple, fast and cost-effective technique for growing bone-like apatite on titanium alloys.

  12. Magnetoelectric properties of Tb0.3Dy0.7Fe1.92/Pb(Zr x Ti1- x )O3 bilayer thin films

    NASA Astrophysics Data System (ADS)

    Hwang, Sung-Ok; Koo, Chang Young; Lee, Jai-Yeoul; Lee, Hee Young; Ryu, Jungho; Kim, Jong-Woo

    2013-12-01

    Magnetoelectric Tb0.3Dy0.7Fe1.92(Terfenol-D)/PbZr x Ti1- x O3(PZT) bilayer thin films were deposited on (111)-oriented Pt/Ti/SiO2/Si< 100 > substrates. The PZT layers with different compositions ( x = 0.3 and 0.52) were grown on the substrates by using the sol-gel method. Terfenol-D layers were deposited on the PZT-film-coated substrate by ion beam sputtering at room temperature with a dot-type patterned metal shadow mask. The structural characteristics and the ferroelectric, ferromagnetic and magnetoelectric(ME) properties of the Terfenol-D/PZT bilayer thin films were investigated. In our results, the maximum remnant polarization, 2 P r were ˜60 µC/cm2 for Terfenol-D/PZT(30/70) (Zr/Ti ratio = 30/70). The magnetization and the ME voltage coefficients were identical regardless of the Zr/Ti composition of PZT. The ME voltage coefficients of the films were over 400 mV/cm·Oe, which were about 4 times higher than the values reported for other bilayer structures.

  13. Effect of pd and dd reactions enhancement in deuterides TiD2, ZrD2 and Ta2D in the astrophysical energy range

    NASA Astrophysics Data System (ADS)

    Bystritskii, V. M.; Dudkin, G. N.; Filipowicz, M.; Huran, J.; Krylov, A. R.; Nechayev, B. A.; Padalko, V. N.; Pen'kov, F. M.; Philippov, A. V.; Tuleushev, Yu. Zh.

    2016-01-01

    Investigation of the pd-and dd-reactions in the ultralow energy (~keV) range is of great interest in the aspect of nuclear physics and astrophysics for developing of correct models of burning and evolution of stars. This report presents compendium of experimental results obtained at the pulsed plasma Hall accelerator (TPU, Tomsk). Most of those results are new, such as • temperature dependence of the neutron yield in the D( d, n)3He reaction in the ZrD2, Ta2D, TiD2 • potentials of electron screening and respective dependence of astrophysical S-factors in the dd-reaction for the deuteron collision energy in the range of 3-6 keV, with ZrD2, Ta2D temperature in the range of 20-200°C [1] • characteristics of the reaction d( p, γ)3He in the ultralow collision proton-deuterons energy range of 4-13 keV [2, 3] in ZrD2, Ta2D and TiD2 • observation of the neutron yield enhancement in the reaction D( d, n)3He at the ultralow deuteron collision energy due to channeling of deuterons in microscopic TiD2 with a face-centered cubic lattice type TiD1.73, oriented in the [100] direction [4]. The report includes discussion and comparison of the collected experimental results with the global data and calculations.

  14. Study on the mechanism of NH3-selective catalytic reduction over CuCexZr1-x/TiO2

    NASA Astrophysics Data System (ADS)

    Chen, Xujuan; Sun, Xiaoliang; Gong, Cairong; Lv, Gang; Song, Chonglin

    2016-06-01

    Copper-cerium-zirconium catalysts loaded on TiO2 prepared by a wet impregnation method were investigated for NH3-selective catalytic reduction (SCR) of NOx. The reaction mechanism was proposed on the basis of results from in situ diffuse reflectance infrared transform spectroscopy (DRIFT). When NH3 is introduced, ammonia bonded to Lewis acid sites is more stable over CuCe0.25Zr0.75/TiO2 at high temperature, while Brønsted acid sites are more important than Lewis acid sites at low temperature. For the NH3+NO+O2 co-adsorption, NH3 species occupy most of activity sites on CuCe0.25Zr0.75/TiO2 catalyst, and mainly exist in the forms of NH4 + (at low temperature) and NH3 coordinated (at high temperature), playing a crucial role in the NH3-SCR process. Two different reaction routes, the L-H mechanism at low temperature (< 200°C) and the E-R mechanism at high temperature (> 200°C), are presented for the SCR reaction over CuCe0.25Zr0.75/TiO2 catalyst.

  15. Piezoelectric Properties of Pb0.98Bi0.02Zr0.51Ti0.48Zn0.01O3 Ceramics

    NASA Astrophysics Data System (ADS)

    He, Wenze; Yu, Jian

    2011-02-01

    On the basis of eutectic behavior of PbTiO3-PbZrO3-Bi(Zn0.5Ti0.5)O3 ternary system, perovskite-structured Pb0.98Bi0.02Zr0.51Ti0.48Zn0.01O3 ceramics were able to be prepared using conventional electronic ceramic processing at low sintering temperature compatible with Ag as inner electrode materials, promising for co-firing technology to fabricate monolithic multilayer piezoelectric transducers. The dependence of its piezoelectric properties on sintering temperature and various dopants were investigated experimentally and a piezoelectric property with dielectric constant of ɛ33T/ɛ0=1190, dielectric loss of tan δ=0.6%, piezoelectric coefficient of d33=270 pC/N, planar coupling coefficient of kp=0.54, thickness coupling coefficient of kt=0.46 and Curie temperature of Tc=346 °C was obtained for the 0.5% Co-doped Pb0.98Bi0.02Zr0.51Ti0.48Zn0.01O3 ceramics sintered at 950 °C.

  16. Adhesion strength and nucleation thermodynamics of four metals (Al, Cu, Ti, Zr) on AlN substrates

    NASA Astrophysics Data System (ADS)

    Tao, Yuan; Ke, Genshui; Xie, Yan; Chen, Yigang; Shi, Siqi; Guo, Haibo

    2015-12-01

    Devices based on AlN generally require adherent and strong interfaces between AlN and other materials, whereas most metals are known to be nonwetting to AlN and form relatively weak interfaces with AlN. In this study, we selected four representative metals (Al, Cu, Ti, and Zr) to study the adhesion strength of the AlN/metal interfaces. Mathematical models were constructed between the adhesion strength and enthalpy of formation of Al-metal solid solutions, the surface energies of the metals, and the lattice mismatch between the metals and AlN, based on thermodynamic parameters calculated using density functional theory. It appears that the adhesion strength is mainly determined by the lattice mismatch, and is in no linear correlation with either the Al-metal solution's formation enthalpies or the metals' surface energies. We also investigated the nucleation thermodynamics of the four metals on AlN substrates. It was found that Ti forms the strongest interface with AlN, and has the largest driving force for nucleation on AlN substrates among the four metals.

  17. Study of low-modulus biomedical β Ti-Nb-Zr alloys based on single-crystal elastic constants modeling.

    PubMed

    Wang, Xing; Zhang, Ligang; Guo, Ziyi; Jiang, Yun; Tao, Xiaoma; Liu, Libin

    2016-09-01

    CALPHAD-type modeling was used to describe the single-crystal elastic constants of the bcc solution phase in the ternary Ti-Nb-Zr system. The parameters in the model were evaluated based on the available experimental data and first-principle calculations. The composition-elastic properties of the full compositions were predicted and the results were in good agreement with the experimental data. It is found that the β phase can be divided into two regions which are separated by a critical dynamical stability composition line. The corresponding valence electron number per atom and the polycrystalline Young׳s modulus of the critical compositions are 4.04-4.17 and 30-40GPa respectively. Orientation dependencies of single-crystal Young׳s modulus show strong elastic anisotropy on the Ti-rich side. Alloys compositions with a Young׳s modulus along the <100> direction matching that of bone were found. The current results present an effective strategy for designing low modulus biomedical alloys using computational modeling. PMID:27235781

  18. Fabrication and Electrical Properties of Ba(Zr,Ti)O3 Textured Ceramics by Templated Grain Growth

    NASA Astrophysics Data System (ADS)

    Bai, Wangfeng; Shen, Bo; Fu, Fang; Zhai, Jiwei

    2012-01-01

    The (h00) textured Ba(Zr0.085Ti0.915)O3 (BZT) ceramics were fabricated by templated grain growth using anisotropically shaped BaTiO3 (BT) templates. A high orientation degree (Lotgering's factor) of 85% calculated from X-ray diffraction (XRD) patterns was obtained. The dielectric, ferroelectric, piezoelectric properties of the random and textured BZT ceramics have been studied. The Curie temperature of the textured BZT ceramics was 94 °C, which was higher than that of the random BZT ceramics. The textured BZT ceramics exhibited excellent piezoelectric performance with the piezoelectric coefficient d33 = 234 pC/N, strain levels of 0.22% at 40 kV/cm, normalized strain (Smax/Emax) level of 550 pm/V calculated from the unipolar strain-electric field (S-E) hysteresis loops and remnant polarization Pr = 11.46 µC/cm2 sintered at 1450 °C for 4 h with 85% of Lotgering's factor.

  19. Soft and hybrid-doped Pb(Zr,Ti)O{sub 3} ceramics under stress, electric field, and temperature loading

    SciTech Connect

    Suchanicz, J.; Kim-Ngan, N.-T.; Konieczny, K.; Jankowska-Sumara, I.; Balogh, A. G.

    2011-05-15

    We investigated the influence of uniaxial pressure (0-1000 bars) applied parallelly or perpendicularly to the ac or dc electric field (in a one-dimensional or two-dimensional manner) on dielectric and ferroelectric properties of selected soft and hybrid-doped PZT ceramics (1 mol. % Gd, 1 mol. % La and 1 mol. % (La+Fe)-doped Pb(Zr{sub 0.54}Ti{sub 0.46}) O{sub 3}). Applying uniaxial pressure leads to a reduction of the peak intensity of the electric permittivity ({epsilon}), of the frequency dispersion, and of the dielectric hysteresis. The peak intensity of {epsilon} becomes diffused and shifts to a higher temperatures with increasing pressure. Simultaneous application of uniaxial pressure and dc electric field (perpendicular to each other) in the poling process implies in improvement of the ferroelectric properties, indicating a new possibility for poling materials with a high coercive field and/or high electric conductivity. It was also found that simultaneous application of uniaxial pressure and dc electric field (perpendicular to each other) allowed observation of the space charge in the depolarization process. The electrostrictive coefficient Q{sub 11} and differential permittivity were evaluated from obtained data. Our results show that applying uniaxial pressure induces similar effects as increasing the Ti-ion concentration in the PZT system. We interpreted our results based on the Cochran soft-mode and domain switching processes under the action of pressure.

  20. Study of low-modulus biomedical β Ti-Nb-Zr alloys based on single-crystal elastic constants modeling.

    PubMed

    Wang, Xing; Zhang, Ligang; Guo, Ziyi; Jiang, Yun; Tao, Xiaoma; Liu, Libin

    2016-09-01

    CALPHAD-type modeling was used to describe the single-crystal elastic constants of the bcc solution phase in the ternary Ti-Nb-Zr system. The parameters in the model were evaluated based on the available experimental data and first-principle calculations. The composition-elastic properties of the full compositions were predicted and the results were in good agreement with the experimental data. It is found that the β phase can be divided into two regions which are separated by a critical dynamical stability composition line. The corresponding valence electron number per atom and the polycrystalline Young׳s modulus of the critical compositions are 4.04-4.17 and 30-40GPa respectively. Orientation dependencies of single-crystal Young׳s modulus show strong elastic anisotropy on the Ti-rich side. Alloys compositions with a Young׳s modulus along the <100> direction matching that of bone were found. The current results present an effective strategy for designing low modulus biomedical alloys using computational modeling.

  1. Corrosion and wear properties of laser surface modified NiTi with Mo and ZrO 2

    NASA Astrophysics Data System (ADS)

    Ng, K. W.; Man, H. C.; Yue, T. M.

    2008-08-01

    Because of its biocompatibility, superelasticity and shape memory characteristics, NiTi alloys have been gaining immense interest in the medical field. However, there is still concern on the corrosion resistance of this alloy if it is going to be implanted in the human body for a long time. Titanium is not toxic but nickel is carcinogenic and is implicated in various reactions including allergic response and degeneration of muscle tissue. Debris from wear and the subsequent release of Ni + ions due to corrosion in the body system are fatal issues for long-term application of this alloy in the human body. This paper reports the corrosion and wear properties of laser surface modified NiTi using Mo and ZrO 2 as surface alloying elements, respectively. The modified layers which are free from microcracks and porosity, act as both physical barrier to nickel release and enhance the bulk properties, such as hardness, wear resistance, and corrosion resistance. The electrochemical performance of the surface modified alloy was studied in Hanks' solution. Electrochemical impedance spectroscopy was measured.

  2. Influence of fluoride content and pH on corrosion and tribocorrosion behaviour of Ti13Nb13Zr alloy in oral environment.

    PubMed

    Golvano, I; Garcia, I; Conde, A; Tato, W; Aginagalde, A

    2015-09-01

    CpTi and Ti6Al4V alloy are the most widely used materials for implant application, but the release of toxic elements (e.g. Al and V) and the so-called stress-shielding effect are still a concern. In recent years, β and near-β titanium alloys have been developed, which overcome these issues with reduced modulus of elasticity and biocompatible alloying elements. However, literature is scarce studying the tribocorrosion behaviour of these alloys for dental implantology. The present work studies the tribocorrosion behaviour of the near-β Ti13Nb13Zr alloy in oral environment, using CpTi4 for comparison purposes. To that end, the influence of the pH and fluoride concentration in artificial saliva was analysed. Reciprocating sliding corrosion tests were carried out under open circuit potential and potentiostatic conditions. Results reveal a negative influence of the increase of fluoride concentration and the acidified artificial saliva on the material degradation. Moreover, some light has been shed on the different tribocorrosion mechanisms of Ti13Nb13Zr and CpTi4 in simulated oral environment.

  3. X-ray diffraction and Raman spectroscopic investigations on CaZrTi2O7sbnd Y2Ti2O7 system: Delineation of phase fields consisting of potential ceramic host materials

    NASA Astrophysics Data System (ADS)

    Jafar, M.; Achary, S. N.; Salke, Niliesh P.; Sahu, A. K.; Rao, Rekha; Tyagi, A. K.

    2016-07-01

    Phase evolution from CaZrTi2O7 (zirconolite) to Y2Ti2O7 (pyrochlore) have been delineated by systematic characterization of a series of sample with composition as Ca1-xZr1-xY2xTi2O7 (0.00 ≤ x ≤ 1.00) by powder XRD, Raman spectroscopy, SEM and EDS analyses. Comparative analyses of XRD and Raman spectra revealed sequential evolution of phases with increasing concentration of Y3+ in the compositions. From the XRD studies, three distinct phase fields, namely two layer (2M) and four layer (4M) zirconolite-types and cubic pyrochlore-type are observed in between zirconolite (CaZrTi2O7) and Y2Ti2O7. 4M-zirconolite phase is observed in a narrow range of composition, viz. 0.35 ≤ x ≤ 0.40 while cubic pyrochlore type phase is observed in the compositions with x ≥ 1.20. The unit cell volume of different phases shows a non-linear increasing trend with Y3+ ion concentration which has been attributed to the distribution of cations in different structure and change in their coordination number.

  4. The atomic structure of lead-free Ba(Zr0.2Ti0.8)O3-(Ba0.7Ca0.3)TiO3 by using neutron total scattering analysis

    NASA Astrophysics Data System (ADS)

    Jeong, I.-K.; Ahn, J. S.

    2012-12-01

    We conducted neutron total scattering measurements on lead-free Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 (BZT-0.5BCT) ceramic at 300 K and 150 K, and studied both long-range and local structures near the morphotropic phase boundary. Despite the long-range phase transition from tetragonal to rhombohedral structures, we found that local atomic structure of BZT-0.5BCT barely changes between 300 K and 150 K. To incorporate both long-range and local structures in a consistent way, we performed reverse Monte Carlo modeling. In BZT-0.5BCT, we found that the Ca substitution on Ba sites causes little impact on the local displacement of Ti ion but enhances octahedral tilting of ZrO6, resulting in nonuniform lattice distortion.

  5. The effect of B{sub 2}O{sub 3} addition on the crystallization of amorphous TiO{sub 2}-ZrO{sub 2} mixed oxide

    SciTech Connect

    Mao Dongsen Lu Guanzhong

    2007-02-15

    The effect of B{sub 2}O{sub 3} addition on the crystallization of amorphous TiO{sub 2}-ZrO{sub 2} mixed oxide was investigated by X-ray diffraction (XRD), thermogravimetric and differential thermal analysis (TG/DTA). TiO{sub 2}-ZrO{sub 2} mixed oxide was prepared by co-precipitation method with aqueous ammonia as the precipitation reagent. Boric acid was used as a source of boria, and boria contents varied from 2 to 20 wt%. The results indicate that the addition of small amount of boria (<8 wt%) hinders the crystallization of amorphous TiO{sub 2}-ZrO{sub 2} into a crystalline ZrTiO{sub 4} compound, while a larger amount of boria ({>=}8 wt%) promotes the crystallization process. FT-IR spectroscopy and {sup 11}B MAS NMR results show that tetrahedral borate species predominate at low boria loading, and trigonal borate species increase with increasing boria loading. Thus it is concluded that highly dispersed tetrahedral BO{sub 4} units delay, while a build-up of trigonal BO{sub 3} promote, the crystallization of amorphous TiO{sub 2}-ZrO{sub 2} to form ZrTiO{sub 4} crystals. - Graphical abstract: The addition of small amount of boria (<8 wt%) hinders the crystallization of amorphous TiO{sub 2}-ZrO{sub 2} into a crystalline ZrTiO{sub 4} compound, while the larger amount of boria ({>=}8 wt%) promotes the crystallization process.

  6. Influence of Zr{sup 4+} doping on structural and electrical properties of SrBi{sub 4}Ti{sub 4}O{sub 15} ceramic

    SciTech Connect

    Nayak, P. Panigrahi, S.; Badapanda, T.

    2015-06-24

    This article reports a systematic study of doping effects on the structural and electrical properties of layer structured strontium bismuth titanate ceramic. In this study monophasic SrBi{sub 4}Ti{sub 4-x}Zr{sub x}O{sub 15} with x=0.00, 0.05, 0.10, 0.15, 0.20, 0.25 ceramics were synthesized from the solid-state reaction route. X-ray diffraction analysis shows that the Zr-modified SBT ceramics have a pure four-layer Aurivillius phase structure. Dielectric properties revealed that the diffuseness of phase transition increases where as corresponding permittivity value decrease with increasing Zr content. Piezoelectric properties of SBTZ ceramics were improved by the modification of Zirconium ion. Moreover, the reason behind for improvement of piezoelectric properties of modified SBTZ ceramics was also discussed.

  7. Chemistry of surface nanostructures in lead precursor-rich PbZr0.52Ti0.48O3 sol-gel films

    NASA Astrophysics Data System (ADS)

    Gueye, I.; Le Rhun, G.; Gergaud, P.; Renault, O.; Defay, E.; Barrett, N.

    2016-02-01

    We present a study of the chemistry of the nanostructured phase at the surface of lead zirconium titanate PbZr0.52Ti0.48O3 (PZT) films synthesized by sol-gel method. In sol-gel synthesis, excess lead precursor is used to maintain the target stoichiometry. Surface nanostructures appear at 10% excess whereas 30% excess inhibits their formation. Using the surface-sensitive, quantitative X-ray photoelectron spectroscopy and glancing angle X-ray diffraction we have shown that the chemical composition of the nanostructures is ZrO1.82-1.89 rather than pyrochlore often described in the literature. The presence of a possibly discontinuous layer of wide band gap ZrO1.82-1.89 could be of importance in determining the electrical properties of PZT-based metal-insulator-metal heterostructures.

  8. Devitrification of Mechanically Alloyed Zr-Ti-Nb-Cu-Ni-Al Glassy Powders Studied by Time-Resolved X-ray Diffraction

    SciTech Connect

    Scudino, S.; Sordelet, D.J.; Eckert, J.

    2009-04-13

    The crystallization of mechanically alloyed Zr{sub 67}Ti{sub 6.14}Nb{sub 1.92}Cu{sub 10.67}Ni{sub 8.52}Al{sub 5.75} glassy powder is investigated by time-resolved X-ray diffraction. The powder displays a multi-step crystallization behavior characterized by the formation of a metastable nanoscale quasicrystalline phase during the first stage of the crystallization process. At higher temperatures, coinciding with the second crystallization event, the amorphous-to-quasicrystalline transformation is followed by the precipitation of the tetragonal Zr{sub 2}Cu phase (space group I4/mmm) and the tetragonal Zr{sub 2}Ni phase (space group I4/mcm). The transformations are gradual and the quasicrystals and the subsequent phases coexist over a temperature interval of about 25K.

  9. A novel preparation of three-dimensionally ordered macroporous M/Ti (M=Zr or Ta) mixed oxide nanoparticles with enhanced photocatalytic activity.

    PubMed

    Wang, Changhua; Geng, Aifang; Guo, Yihang; Jiang, Shujuan; Qu, Xuesong; Li, Li

    2006-09-01

    Three-dimensionally ordered macroporous (3 DOM) M/Ti (M=Zr or Ta) mixed oxides were prepared by cohydrolysis of a mixture of Zr(n-OC(4)H(9))(4)/TTIP or TaCl(5)/TTIP (TTIP=titanium isopropoxide) combined with a polystyrene (PS) latex sphere templating technique. The resulting products exhibited homogeneous wall compositions, namely, Zr or Ta was uniformly dispersed into the TiO(2) framework with the loading levels of 5, 10, and 20 mol% for Zr and 2.5, 5.0, and 7.5 mol% for Ta, respectively. The estimated macropore diameter, wall thickness, and particle size of the products ranged from 280 to 290 nm, from 30 to 50 nm, and from 10 to 12 nm, respectively. The products showed only anatase phase structure although their starting solitary metal oxides exhibited suitable crystalline structures under the same preparation conditions. Raman scattering spectroscopy showed that the crystal structure of titania had a slight interference due to the incorporation of Zr or Ta, and UV-vis diffuse reflectance spectroscopy (DRS) showed the narrower band gap of the products compared with that of pure anatase TiO(2). The products exhibited mesoporous wall structures, and their BET surface areas were higher than those of the corresponding pure 3 DOM metal oxides. The UV-light photocatalytic activity of the products was assessed by monitoring the photodegradation of two organic molecules including 4-nitrophenol (4-NP) and rhodamine B (RB). Both the photocatalytic reactions confirmed that the presence of the second metal oxide in the titania framework resulted in enhanced photocatalytic activity compared with the pure titania framework. PMID:16777130

  10. 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.

  11. Characterisation, phase stability and surface chemical properties of photocatalytic active Zr and Y co-doped anatase TiO2 nanoparticles

    NASA Astrophysics Data System (ADS)

    Mattsson, Andreas; Lejon, Christian; Bakardjieva, Snejana; Štengl, Vaclav; Österlund, Lars

    2013-03-01

    We report on the characterization, phase stability, surface chemical and photocatalytic properties of Zr and Y co-doped anatase TiO2 nanoparticles prepared by homogenous hydrolysis methods using urea as precipitating agent. The materials were analyzed by scanning electron microscopy, X-ray diffraction, Raman spectroscopy, BET isotherm and BJH pore size distribution measurements. It is shown that Y and Zr ions replace Ti ions in the anatase TiO2 structures up to a critical total dopant concentration of approximately 13 wt%. The co-doped particles show increased phase stability compared to pure anatase TiO2 nanoparticles. The anatase to rutile phase transformation is shown to be preceded by cation segregation and dissolution with concomitant precipitation of Y2Ti2-xZrxO7 and ZrTiO4. Co-doping modifies the optical absorption edge with a resulting attenuation of the Urbach tail. The band gap is slightly blue-shifted at high doping concentrations, and red shifted at lower doping concentrations. Formic acid adsorption was used as a probe molecule to investigate surface chemical properties and adsorbate structures. It was found that the relative abundance of monodentate formate compared to bidentate coordinated formate decreases with increasing doping concentration. This is attributed to an increased surface acidity with increasing dopant concentration. Photodegradation of formic acid occurred on all samples. With mode-resolved in situ FTIR spectroscopy it is shown that the rate of photodegradation of monodentate formate species are higher than for bidentate formate species. Thus our results show that the trend of decreasing photo-degradation rate with increasing dopant concentration can be explained by the adsorbate structure, which is controlled by the acidity of the surface.

  12. Effect of nitrogen flow ratios on the structure and mechanical properties of (TiVCrZrY)N coatings prepared by reactive magnetron sputtering

    NASA Astrophysics Data System (ADS)

    Tsai, Du-Cheng; Huang, Yen-Lin; Lin, Sheng-Ru; Liang, Shih-Chang; Shieu, Fuh-Sheng

    2010-12-01

    This study reports the influence of growth conditions on the characteristics of (TiVCrZrY)N coatings prepared by reactive magnetron sputtering at various N 2-to-total (N 2 + Ar) flow ratio, which is R N. The crystal structures, microstructure, and mechanical properties for different R N were characterized by electron spectroscopy for chemical analysis, X-ray diffraction, atomic force microscopy, field-emission-scanning electron microscopy, transmission electron microscopy, and nanoindentation. The results indicate that the TiVCrZrY alloy and nitride coatings have hexagonal close-packed (hcp)-type and sodium chloride (NaCl)-type solid-solution structures, respectively. The voids in the coatings are eliminated and the growth of the columnar crystal structures is inhibited along with an increasing R N. As a consequence, highly packed equiaxed amorphous structures with smooth surfaces are formed. The coatings accordingly achieved a pronounce hardness of 17.5 GPa when R N = 100%.

  13. Piezoelectrically induced mechano-catalytic effect for degradation of dye wastewater through vibrating Pb(Zr0.52Ti0.48)O3 fibers

    NASA Astrophysics Data System (ADS)

    Lin, He; Wu, Zheng; Jia, Yanmin; Li, Weijian; Zheng, Ren-Kui; Luo, Haosu

    2014-04-01

    Hydrothermally synthesized piezoelectric Pb(Zr0.52Ti0.48)O3 fibers were used as a mechano-catalyzer to degrade acid orange 7 dye wastewater via the mechano-catalytic effect, which was achieved as a product of the piezoelectric effect and the electro-catalytic effect. When subjected to mechanical vibration, the Pb(Zr0.52Ti0.48)O3 fibers bend, which in turn induces electric charges on the surfaces of the fibers via the piezoelectric effect. The piezoelectrically induced electric charges induce chemical degradation reactions in the dye wastewater through the electro-catalytic effect. A high mechano-catalytic degradation ratio of ˜80% was achieved for the acid orange 7 solutions (˜30 μmol/l). The piezoelectrically induced mechano-catalytic effect thus provides a highly efficient and reusable technology for dye wastewater degradation applications.

  14. Gas release in the process of thermal treatment of sputtered Pb(Ti0.48Zr0.52)O x films

    NASA Astrophysics Data System (ADS)

    Znamenskii, A. G.; Ionov, A. M.; Marchenko, V. A.

    2016-06-01

    The conditions (regimes of deposition and thermal treatment) for gas bubble formation in ferroelectric Pb(Ti1- y Zr y )O3 films have been determined by thermal desorption and electron and optical micros-copy. A mechanism of bubble formation has been proposed. This mechanism rests upon the notion that lead can form oxides of the PbO2 type with a high oxygen content at relatively low temperatures and that these oxides break down with the release of oxygen to lower oxides of the PbO type upon subsequent heating. These ideas have been taken as the basis of a technique for the fabrication of Pb(Ti1- y Zr y )O3 films with a reduced (by an order of magnitude) density of through defects.

  15. Effect of thermal cycling on the mechanical properties of Zr41Ti14Cu12.5Ni10Be22.5 alloy

    NASA Astrophysics Data System (ADS)

    Wang, Xin; Shao, Yang; Gong, Pan; Yao, KeFu

    2012-12-01

    The effect of thermal cycling treatment on mechanical properties and thermal stability of a Zr41Ti14Cu12.5Ni10Be22.5 bulk metallic glass is investigated. The metallic glassy samples are sealed into quartz tubes under high vacuum condition, and liquid nitrogen together with electric furnace are used to control a periodical temperature variation between -196°C and 150°C. The structure and properties of the tested samples for different thermal cycles have been examined by X-ray diffraction analysis, mechanical properties measurement and thermal analysis. It has been found that the structure and properties of the samples do not show a significant change even after 200 cycles, which suggests Zr41Ti14Cu12.5Ni10Be22.5 alloy as having potential in aerospace environment.

  16. Evaluation of micro-abrasion-corrosion on SiO2-TiO2-ZrO2 coatings synthesized by the sol-gel method

    NASA Astrophysics Data System (ADS)

    Bautista Ruiz, J.; Aperador, W.; Caballero Gómez, J.

    2016-02-01

    The medical science and the engineering, work to improve the materials used in the manufacture of joint implants, since they have a direct impact on the quality of people life. The surgical interventions are increasing worldwide with a high probability of a second or even a third intervention. Around these circumstances, it was evaluated the behaviour against microabrasion-corrosion phenomena on SiO2 TiO2 ZrO2 coatings, synthesized by the sol-gel method with concentration of the Si/Ti/Zr precursors: 10/70/20 and 10/20/70. The coatings were deposited on AISI 316 LVM stainless steel substrates. The morphological characterization of the wear was made by AFM techniques. It was observed that the coatings with higher levels of titanium have a good response to the phenomena of microabrasion-corrosion.

  17. Dielectric and ferroelectric properties of (111) preferred oriented PbZr0.53Ti0.47O3/Pb(Mg1/3Nb2/3)0.62Ti0.38O3/PbZr0.53Ti0.47O3 trilayered films

    NASA Astrophysics Data System (ADS)

    Tang, Yanxue; Zhu, Bing; Wang, Feifei; Sun, Dazhi; Hu, Zhijuan; Qin, Xiaomei; Shi, Wangzhou

    2016-05-01

    Highly (111) preferred oriented PbZr0.53Ti0.47O3/Pb(Mg1/3Nb2/3)0.62Ti0.38O3/PbZr0.53Ti0.47O3 (PZT/PMNT/PZT) trilayered ferroelectric thin films were prepared on (111)Pt/Ti/SiO2/Si substrates. At room temperature, the films have a dielectric constant of 2175 that decreases to 1870 and a dielectric loss of 0.05 that increases to 0.06 with increasing frequency between 102 and 105 Hz. Also, they exhibit well saturated polarization-versus-electric field hysteresis loops with a large remnant polarization of 13.4 μC/cm2 and a low coercive field of 30 kV/cm. The leakage current density in the trilayered films is 4.1 × 10-10 A/cm2, which increases to 4.0 × 10-7 A/cm2 with increasing electric field between 1 and 140 kV/cm. Such properties of (111) preferred oriented PZT/PMNT/PZT trilayered films lead naturally to possibilities for ferroelectric capacitors and memories.

  18. 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.

  19. Comparative Study of the Optical and Textural Properties of Tetrapyrrole Macrocycles Trapped Within ZrO₂, TiO₂, and SiO₂ Translucent Xerogels.

    PubMed

    Salas-Bañales, Eduardo; Quiroz-Segoviano, R Iris Y; Díaz-Alejo, Luis Antonio; Rojas-González, Fernando; Estrella-González, Alberto; Campero, Antonio; García-Sánchez, Miguel A

    2015-10-23

    The entrapping of physicochemical active molecules inside mesoporous networks is an appealing field of research due to the myriad of potential applications in optics, photocatalysis, chemical sensing, and medicine. One of the most important reasons for this success is the possibility of optimizing the properties that a free active species displays in solution but now trapped inside a solid substrate. Additionally it is possible to modulate the textural characteristics of substrates, such as pore size, specific surface area, polarity and chemical affinity of the surface, toward the physical or chemical adhesion of a variety of adsorbates. In the present document, two kinds of non-silicon metal alkoxides, Zr and Ti, are employed to prepare xerogels containing entrapped tetrapyrrolic species that could be inserted beforehand in analogue silica systems. The main goal is to develop efficient methods for trapping or binding tetrapyrrole macrocycles inside TiO₂ and ZrO₂ xerogels, while comparing the properties of these systems against those of the SiO₂ analogues. Once the optimal synthesis conditions for obtaining translucent monolithic xerogels of ZrO₂ and TiO₂ networks were determined, it was confirmed that these substrates allowed the entrapment, in monomeric form, of macrocycles that commonly appear as aggregates within the SiO₂ network. From these experiments, it could be determined that the average pore diameters, specific surface areas, and water sorption capacities depicted by each one of these substrates, are a consequence of their own nature combined with the particular structure of the entrapped tetrapyrrole macrocycle. Furthermore, the establishment of covalent bonds between the intruding species and the pore walls leads to the obtainment of very similar pore sizes in the three different metal oxide (Ti, Zr, and Si) substrates as a consequence of the templating effect of the encapsulated species.

  20. Impact of cyclic plasma treatment on oxygen vacancy defects in TiN/HfZrO/SiON/Si gate stacks

    SciTech Connect

    Bhuyian, Md Nasir Uddin Misra, D.; Poddar, S.; Tapily, K.; Clark, R. D.; Consiglio, S.; Wajda, C. S.; Nakamura, G.; Leusink, G. J.

    2015-05-11

    This work evaluates the defects in HfZrO as a function of Zr addition into HfO{sub 2} and when the dielectric was subjected to a slot-plane-antenna (SPA) plasma treatment in a cyclic process to form TiN/HfZrO/SiON/Si gate stacks. The defect energy levels, estimated by temperature-dependent current-voltage measurements, suggest that Zr addition in HfO{sub 2} modifies the charge state of the oxygen vacancy formation, V{sup +}. The influence of electron affinity variation of Hf and Zr ions on the charged oxygen vacancy levels seems to have contributed to the increase in defect activation energy, E{sub a}, from 0.32 eV to 0.4 eV. The cyclic SPA plasma exposure further reduces the oxygen vacancy formation because of the film densification. When the dielectric was subjected to a constant voltage stress, the charge state oxygen vacancy formation changes to V{sup 2+} and improvement was eliminated. The trap assisted tunneling behavior, as observed by the stress induced leakage current characteristics, further supports the oxygen vacancy formation model.

  1. Effect of Surface Modifications of Ti40Zr10Cu38Pd12 Bulk Metallic Glass and Ti-6Al-4V Alloy on Human Osteoblasts In Vitro Biocompatibility

    PubMed Central

    Blanquer, Andreu; Hynowska, Anna; Nogués, Carme; Ibáñez, Elena; Sort, Jordi; Baró, Maria Dolors; Özkale, Berna; Pané, Salvador; Pellicer, Eva

    2016-01-01

    The use of biocompatible materials, including bulk metallic glasses (BMGs), for tissue regeneration and transplantation is increasing. The good mechanical and corrosion properties of Ti40Zr10Cu38Pd12 BMG and its previously described biocompatibility makes it a potential candidate for medical applications. However, it is known that surface properties like topography might play an important role in regulating cell adhesion, proliferation and differentiation. Thus, in the present study, Ti40Zr10Cu38Pd12 BMG and Ti6-Al-4V alloy were surface-modified electrochemically (nanomesh) or physically (microscratched) to investigate the effect of material topography on human osteoblasts cells (Saos-2) adhesion, proliferation and differentiation. For comparative purposes, the effect of mirror-like polished surfaces was also studied. Electrochemical treatments led to a highly interconnected hierarchical porous structure rich in oxides, which have been described to improve corrosion resistance, whereas microscratched surfaces showed a groove pattern with parallel trenches. Cell viability was higher than 96% for the three topographies tested and for both alloy compositions. In all cases, cells were able to adhere, proliferate and differentiate on the alloys, hence indicating that surface topography plays a minor role on these processes, although a clear cell orientation was observed on microscratched surfaces. Overall, our results provide further evidence that Ti40Zr10Cu38Pd12 BMG is an excellent candidate, in the present two topographies, for bone repair purposes. PMID:27243628

  2. Non-isothermal crystallization kinetics and glass-forming ability of Ti41Zr25Be28Fe6 bulk metallic glass investigated by differential scanning calorimetry

    NASA Astrophysics Data System (ADS)

    Gong, Pan; Zhao, Shaofan; Wang, Xin; Yao, Kefu

    2015-07-01

    The non-isothermal crystallization kinetics and glass-forming ability of Ti41Zr25Be28Fe6 glassy alloy were investigated by differential scanning calorimetry. The activation energies corresponding to the characteristic temperatures have been calculated by Kissinger and Ozawa equations. Based on Kissinger-Akahira-Sunose and Ozawa-Flynn-Wall models, it has been found that the local activation energy is higher at the beginning of the crystallization process for the first exothermic peak. The local Avrami exponent indicates that the first-step crystallization is mainly a high-dimensional nucleation and growth with an increasing nucleation rate. According to the calculated fragility index, Ti41Zr25Be28Fe6 alloy can be classified as "strong glass former." The studied alloy also possesses a critical size up to centimeter order, and the high glass-forming ability is probably related to the relatively low Gibbs energy difference between the liquid and crystalline states. The critical cooling rate of Ti41Zr25Be28Fe6 glassy alloy has also been determined using Barandiaran-Colmenero's method.

  3. Electrical and structural properties of group-4 transition-metal nitride (TiN, ZrN, and HfN) contacts on Ge

    NASA Astrophysics Data System (ADS)

    Yamamoto, Keisuke; Noguchi, Ryutaro; Mitsuhara, Masatoshi; Nishida, Minoru; Hara, Toru; Wang, Dong; Nakashima, Hiroshi

    2015-09-01

    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 (ΦBP) 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 ΦBP 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.

  4. 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.

  5. A systematic study of ideal and double layer reconstructions of ABO3(001) surfaces (A = Sr, Ba; B = Ti, Zr) from first principles.

    PubMed

    Iles, N; Finocchi, F; Khodja, K Driss

    2010-08-01

    We conducted a comparative study of various reconstructions for the (001) surfaces of SrTiO(3), BaTiO(3), SrZrO(3) and BaZrO(3) perovskites through calculations within the density functional theory. The atomic structure, the thermodynamic stability and the charge distribution of ideal AO or BO(2) terminations, as well as the so-called AO or BO(2) double layer reconstructions were analysed, and it was found that of all the BO(2) double layer reconstructions the most stable are the (2 × 2) and the (√2 × √2) ones. This is mainly due to stress release through the formation of long B-chains. On Ti-based perovskites, these double layer reconstructions were found to be thermodynamically stable, which was not the case for Zr-based perovskites, for which AO terminations dominated most of the stability domain. We also found that the BO(2) double layer reconstructions are accompanied by a substantial charge redistribution, with an almost neutral surface plane. This charge redistribution has important consequences for the reactivity and the behaviour of the electric field close to the surface.

  6. Microstructures and mechanical properties of metastable Ti-30Zr-(Cr, Mo) alloys with changeable Young's modulus for spinal fixation applications.

    PubMed

    Zhao, Xiaoli; Niinomi, Mitsuo; Nakai, Masaaki; Miyamoto, Goro; Furuhara, Tadashi

    2011-08-01

    In order to develop a novel alloy with a changeable Young's modulus for spinal fixation applications, we investigated the microstructures, Young's moduli, and tensile properties of metastable Ti-30Zr-(Cr, Mo) alloys subjected to solution treatment (ST) and cold rolling (CR). All the alloys comprise a β phase and small athermal ω phase, and they exhibit low Young's moduli after ST. During CR, deformation-induced phase transformation occurs in all the alloys. The change in Young's modulus after CR is highly dependent on the type of deformation-induced phase. The increase in Young's modulus after CR is attributed to the deformation-induced ω phase on {3 3 2} mechanical twinning. Ti-30Zr-3Cr-3Mo (3Cr3Mo), which exhibits excellent tensile properties and a changeable Young's modulus, shows a smaller springback than Ti-29Nb-13Ta-4.6Zr, a β-type titanium alloy expected to be useful in spinal fixation applications. Thus, 3Cr3Mo is a potential candidate for spinal fixation applications. PMID:21569873

  7. Micro-abrasion-corrosion behaviour of a biomedical Ti-25Nb-3Mo-3Zr-2Sn alloy in simulated physiological fluid.

    PubMed

    Wang, Zhenguo; Li, Yan; Huang, Weijiu; Chen, Xiaoli; He, Haoran

    2016-10-01

    The micro-abrasion-corrosion behaviour of the biomedical Ti-25Nb-3Mo-3Zr-2Sn alloy in Hank׳s solution with protein has been investigated using electrochemical measurements, tribological tests and scanning electron microscope (SEM) observations. The potentiodynamic polarization tests showed that the corrosion potential (Ecorr) exhibits the maximum value at the abrasive concentration of 0.05gcm(-3) despite of the load level. The tribological results indicated that the total material loss of the Ti-25Nb-3Mo-3Zr-2Sn alloy during micro-abrasion increased with the increasing abrasive concentration at a certain applied load. When the abrasive concentration is no more than 0.15gcm(-3), the total material loss increases with increasing load, while the total material loss exhibits the maximum value at a moderate load in case of higher abrasive concentration levels. This was ascribed to the three-body or two-body micro-abrasion-corrosion at different abrasive concentration levels. The wastage map, abrasion mode map and synergy map associated with the applied load and the abrasive concentration were constructed to evaluate the micro-abrasion-corrosion behaviour of the Ti-25Nb-3Mo-3Zr-2Sn alloy in potential biomedical applications.

  8. Microstructure, mechanical properties and machining performance of hot-pressed Al2O3 - ZrO2 - TiC composites

    NASA Astrophysics Data System (ADS)

    Grigoriev, M.; Kotelnikov, N.; Buyakova, S.; Kulkov, S.

    2016-02-01

    The effect of adding nanocrystalline ZrO2 and submicron TiC to ultrafine Al2O3 on mechanical properties and the microstructure of the composites developed by hot pressing was investigated. It was shown that by means of hot pressing in an argon atmosphere at a sintering temperature of 1500 °C one can obtain the composites Al2O3 - ZrO2 - TiC with a fine structure and minimal porosity. It has been shown that in material a multi-scale hierarchical structure is formed, which possesses high physical and mechanical properties: the hardness and fracture toughness was 21.5 GPa and 5.2 MPa*m1/2 respectively, the modulus of elasticity was 500 GPa and bending strength was 390 MPa. Tests on composites’ cutting properties were carried out on interrupted cutting of hardened steel. All samples had wear of the cutting edge in the form of chips of the grain rear working surface of the tool, but the cutting tool which was made by Al2O3 - 10% ZrO2 - 10% TiC had a minimum width of wear.

  9. Speculation of equilibrium pressure of Ti{sub 36}Zr{sub 40}Ni{sub 20}Pd{sub 4} icosahedral quasicrystal

    SciTech Connect

    Huang, Huogen; Chen, Liang

    2015-08-17

    Ti-Zr-Ni quasicrystals have been demonstrated to store a large number of hydrogen atoms, which implies strong potential application in hydrogen energy field for them. However, the desorption of hydrogen atoms in the quasicrystals is quite difficult, with the indication of high desorption temperature and slow desorption rate. The shortage limits their use in the field to a large extent. But this kind of quasicrystals might be used in nuclear fusion energy field, because tritium as a coral fuel for nuclear fusion needs tight storage. However, equilibrium pressure at room temperature of Ti-Zr-Ni quasicrystals, important for their application in fusion energy field, has not been clear yet. In this work, we designed a gas-solid reaction system with the pressure resolution of 10{sup −8}Pa and carried out hydrogen desorption investigation at different temperatures on Ti{sub 36}Zr{sub 40}Ni{sub 20}Pd{sub 4} icosahedral quasicrystal. Based on three Pressure-Composition-Temperature desorption curves, we speculate according to Van’t Hoff theory about hydrogen storage that its equilibrium pressure at room temperature could be at the magnitude of 10{sup −6}Pa, displaying good stability of hydrogen in the quasicrystal and also implying application prospects in fusion energy field for quasicrystals of this type.

  10. Selective aerobic oxidation of 5-HMF into 2,5-furandicarboxylic acid with Pt catalysts supported on TiO2 - and ZrO2 -based supports.

    PubMed

    Ait Rass, Hicham; Essayem, Nadine; Besson, Michèle

    2015-04-13

    Pt catalysts prepared over different metallic oxide supports were investigated in the oxidation of 5-hydroxymethylfurfural (HMF) to 2,5-furandicarboxylic acid (FDCA) in alkaline aqueous solutions with air, to examine the combined effect of the support and base addition. The base (nature and amount) played a significant role in the degradation or oxidation of HMF. Increasing amounts of the weak NaHCO3 base improved significantly the overall catalytic activity of Pt/TiO2 and Pt/ZrO2 by accelerating the oxidation steps, especially for the aldehyde group. This was highlighted by a proposed kinetic model that gave very good concentration-time fittings. Moreover, the promotion of the catalyst with bismuth yielded a PtBi/TiO2 catalytic system with improved activity and stability. Y2 O3  and La2 O3 ZrO2 -supported catalysts exhibited lower activity than Pt/ZrO2 , which suggests no cooperative effect of the weakly basic properties introduced and the homogeneous base. Quantitative oxidation of HMF (0.1 M) and high yields of FDCA (>99 %) were obtained in less than 5 h by using an HMF/Pt molar ratio of 100 and Na2 CO3 as a weak base over PtBi/TiO2 (Bi/Pt=0.22). PMID:25736596

  11. Photoluminescence: A probe for short, medium and long-range self-organization order in ZrTiO{sub 4} oxide

    SciTech Connect

    Lucena, Poty R. de . E-mail: poty@liec.ufscar.br; Roberto Leite, Edson; Pontes, Fenelon M.; Longo, Elson; Pizani, Paulo S.; Arana Varela, Jose

    2006-12-15

    Photoluminescent disordered ZrTiO{sub 4} powders were obtained by the polymeric precursor soft-chemical method. This oxide system (ordered and disordered) was characterized by photoluminescence, Raman spectroscopy, X-ray diffraction, differential scanning calorimetry and UV-vis absorption experiments. The UV absorption tail formation in the disordered oxides was related to the diminution of optical band gap. In the disordered phase, this oxide displayed broad band photoluminescence caused by change in coordination number of titanium and zirconium with oxygen atoms. The gap decreased from 3.09eV in crystalline oxide to 2.16 eV in disordered oxide. The crystalline oxide presented an orthorhombic {alpha}-PbO{sub 2}-type structure in which Zr{sup 4+} and Ti{sup 4+} were randomly distributed in octahedral coordination polyhedra with oxygen atoms. The amorphous-crystalline transition occurred at almost 700 deg. C, at which point the photoluminescence vanished. The Raman peak at close to 80-200cm{sup -1} indicated the presence of locally ordered Ti-O{sub n} and Zr-O{sub n} polyhedra in disordered photoluminescent oxides.

  12. Heteroepitaxial growth of GaN on various powder compounds (AlN, LaN, TiN, NbN, ZrN, ZrB 2 , VN, BeO) by hydride vapor phase epitaxy

    NASA Astrophysics Data System (ADS)

    Park, Jinsub; Ha, Jun-Seok; Hong, Soon-Ku; Lee, Seog Woo; Cho, Meoung Whan; Yao, Takafumi; Lee, Hae Woo; Lee, Sang Hwa; Lee, Sung-Keun; Lee, Hyo-Jong

    2012-04-01

    We investigated the nucleation and growth behavior of GaN on various powders by hydride vapor phase epitaxy. In relative comparison, the nucleation tendency of GaN on each powder can be summarized as AlN > LaN, TiN, NbN > ZrN > ZrB2 > VN, BeO, indicating that the number of nucleation sites increased from right to left. LaN and NbN have not yet been reported as buffer materials for GaN growth. Of these, NbN is expected to be a good buffer material because the interatomic distance on the NbN (111) plane has only 2% difference from that on the GaN (0001) plane.

  13. Effects of TiO2, ZrO2 and Al2O3 dopants on the compressive strength of tricalcium phosphate.

    PubMed

    Zawahreh, Y I; Popova, N; Smith, R W; Hendry, J; Smith, T J N; Ziolo, T L

    2005-12-01

    Tricalcium phosphate (TCP) powders synthesised using the Ca(NO3)2 and Ca(OH)2 routes were doped with TiO2, ZrO2 and Al2O3 in order to increase their compressive strength. An ultimate compressive strength (UCS) of 255 +/- 6 MPa was achieved for approximately 10 vol% TiO2 doping compared to 30 +/- 3 MPa for an un-doped control processed and tested in the same manner. Higher levels of TiO2 doping resulted in smaller increases in UCS with 30 and 50 vol% achieving 213 +/- 9 and 178 +/- 15 MPa, respectively. Very small amounts of Al2O3 doping (< 0.5 vol%) also resulted in a stronger materials. However, under the processing conditions employed, higher levels of Al2O3 and ZrO2 doping resulted in no beneficial effect on the UCS. Polyvinyl alcohol (PVA) was used as binding agent to facilitate processing. As expected, higher levels of PVA were associated with smaller increases in UCS. Powders synthesised using the Ca(OH)2 route had smaller particle size and resulted in larger increases in UCS compared to the Ca(NO3)2-synthesised powders. Although some powders contained alpha and beta-TCP phases, no other calcium phosphate, CaO, CaTiO3 or CaZrO3 phases were detected. In conclusion, a significant increase in the UCS of TCP was achieved by doping with approximately 10 vol% TiO2 which is expected to have little or no effect on the bioactivity or bioresorbability of the material.

  14. Adaptive neuro-fuzzy approach for predicting hardness of deposited TiN/ZrN multilayer coatings.

    PubMed

    Yang, Yu-Sen; Huang, Wesley; Huang, Guo-Ping; Chou, Jyh-Horng

    2010-07-01

    This paper presents an adaptive neuro-fuzzy approach based on first order function of fuzzy model for establishing the relationship between control factors and thin films properties of TiN/ZrN coatings on Si(100) wafer substrates. A statistical model was designed to explore the space of the processes by an orthogonal array scheme. Eight control factors of closed unbalance magnetron sputtering system were selected for modeling the process, such as interlayer material, argon and nitrogen flow rate, titanium and zirconium target current, rotation speed, work distance, and bias voltage. Analysis of variance (ANOVA) was carried out for determining the influence of control factors. In this study, with the application of ANOVA, the smallest effect of control factors was eliminated. The adaptive neuro-fuzzy inference system (ANFIS) was applied as a tool to model the deposited process with five significant control factors. The experimental results show that ANFIS demonstrates better accuracy than additive model for the film hardness. The root mean square error between prediction values and experimental values were archived to 0.04. PMID:21128476

  15. A highly sensitive Pb(Zr,Ti)O3 thin film ultrasonic micro-sensor with a grooved diaphragm.

    PubMed

    Matsushima, Tomoaki; Xiong, Sibei; Kawada, Hiroshi; Yamanaka, Hiroshi; Muralt, Paul

    2007-12-01

    A highly sensitive piezoelectric ultrasonic micro-sensor with a grooved multilayer membrane was developed by a Si-based MEMS technique. The groove was located at one-quarter of the distance away from the edge of the membrane and opened into piezoelectric layer. The piezoelectric layer Pb(Zr,Ti)O(3) (PZT) was 2.2 microm thick and was prepared by a sol-gel method. The prepared PZT film was pure perovskite and showed a highly (100) textured structure. The sensitivity of the fabricated piezoelectric ultrasonic sensor without the groove structure was 100 microV/Pa. In comparison, the sensitivity of the ultrasonic sensor with the groove structure was about 500 microV/Pa, which is 5 times that without the groove structure. The diaphragm having grooves showed a corrugate-like structure that was formed by residual stress. The high sensitivity of the membrane with the grooved diaphragm is considered to relate to the corrugate-like structure.

  16. Giant electrocaloric effect in BaZr0.2Ti0.8O3 thick film

    NASA Astrophysics Data System (ADS)

    Ye, Hui-Jian; Qian, Xiao-Shi; Jeong, Dae-Yong; Zhang, Shujun; Zhou, Yue; Shao, Wen-Zhu; Zhen, Liang; Zhang, Q. M.

    2014-10-01

    We report the giant electrocaloric effect (ECE) of BaZr0.2Ti0.8O3 (BZT) thick film near room temperature. The BZT thick film was fabricated by the tape casting method with the thickness of 12.0 μm. Due to the near invariant critical point composition, relaxor behavior, and the stress generated between the film and the substrate, the thick film exhibits a large adiabatic temperature drop ΔT = -7 °C under 19.5 MV/m electric field, large EC coefficient ΔT/ΔE = 0.50 × 10-6 K . m . V-1, ΔS/ΔE = 0.88 × 10-6 J . m . kg-1 . K-1 . V-1 over a wide temperature range near room temperature, where ΔS is the isothermal entropy change and ΔE is the applied field. These high EC properties and possibility of fabrication of the EC ceramics into multilayer ceramic capacitor configuration provide solution for the application of the EC material for practical cooling device applications.

  17. Oxygen vacancy kinetics in ferroelectric PbZr0.4Ti0.6O3

    NASA Astrophysics Data System (ADS)

    Gottschalk, S.; Hahn, H.; Flege, S.; Balogh, A. G.

    2008-12-01

    Oxygen vacancy kinetics in ferroelectric PbZr0.4Ti0.6O3 were studied by oxygen18 (O18) tracer self-diffusion in epitaxial thin films as well as bulk polycrystalline samples. O18 exchange annealing was carried out at an oxygen partial pressure of 250mbar and temperatures between 250 and 400°C. Isotope depth profiling was performed by secondary ion mass spectrometry as well as neutral secondary mass spectrometry. The observed concentration depth profiles of the polycrystalline samples show two distinct diffusion paths, namely, bulk diffusion and grain boundary (GB) diffusion. It appears to be of type B-kinetics in the investigated temperature range, with DGB/Dbulk≫100. Donor doped samples with different levels of Nb5+ (1-4mol.%) were also investigated. The effect on the diffusion depth profiles, however, were negligible and can solely be attributed due to the change in the samples microstructure as induced by the dopants. A diffusion coefficient for the bulk diffusion of the O18 isotope, Dbulk=10±5×10-8cm2/sexp(-0.87±0.1eV /kT) was found. The faster GB diffusion process shows an activation enthalpy of only EA=0.66±0.2eV.

  18. Characterizing Sintered Nano-Hydroxyapatite Sol-Gel Coating Deposited on a Biomedical Ti-Zr-Nb Alloy

    NASA Astrophysics Data System (ADS)

    Jafari, Hassan; Hessam, Hamid; Shahri, Seyed Morteza Ghaffari; Assadian, Mahtab; Shairazifard, Shahin Hamtaie Pour; Idris, Mohd Hasbullah

    2016-03-01

    In this study, sol-gel dip-coating method was used to coat nano-hydroxyapatite on specimens of Ti-14Zr-13Nb alloy for orthopedic applications. The coated specimens were sintered at three different temperatures and time spans to evaluate the impact of sintering process on microstructure, mechanical, bio-corrosion, and bioactivity properties of the coating. Field-emission scanning electron microscopy and x-ray diffraction were used to analyze the coating microstructure. Coating adhesion and mechanical performance were also investigated by scratch testing. Besides, electrochemical corrosion and immersion tests were performed in simulated body fluid to examine the sintering effect on corrosion performance and bioactivity of the coatings, respectively. The evaluations of coated specimens displayed that sintering at elevated temperatures leads to higher surface integrity and improves crystallinity of the nano-hydroxyapatite to approximately 89% which brings about distinctively enhanced mechanical properties. Similarly, it improved the corrosion rate for about 17 times through sintering at 700 °C. Immersion test proved that the coating increased the bioactivity resulted from the dissolution of calcium phosphates into the corresponding environment. It is noticeable that sintering the dip-coated specimens in the nano-hydroxyapatite improves corrosion performance and maintains bioactive behaviors as well.

  19. Optimization of the Ti-16.2Hf-24.8Nb-1Zr Alloy by Cold Working

    NASA Astrophysics Data System (ADS)

    González, M.; Peña, J.; Manero, J. M.; Arciniegas, M.; Gil, F. J.

    2009-08-01

    The objective of the present work is to characterize the influence of cold work on the thermoelastic martensitic transformation and on the apparent elastic modulus of the Ni-free Ti-21.6Hf-23.7Nb-1Zr alloy in order to determine the key factor that promotes the desired shape memory properties and/or low apparent elastic modulus. A vacuum arc melted button of each alloy was heat treated at 1100 °C during 1.5 h and quenched with a mixture of ethanol/water at 0 °C. Samples of the alloy were cold rolled from 5% up to 95% and, finally, microstructurally and mechanically characterized. The apparent elastic modulus for each condition as well as the reversibility percentages were evaluated by instrumented nanoindentation using a Berkovich tip and a spherical tip, respectively. A higher proportion of martensite was found in the low cold work percentages compared to the untreated material as it was observed by optical and TEM microscopy. A decrease in the apparent elastic modulus was observed when increasing the cold work percentage. The lowest value was found in the 99% cold work condition with 44 GPa, value closer to that of cortical bone. Cyclic nanoindentation tests show an increase in the reversibility percentages in the cold worked condition compared to the untreated material.

  20. Coexistence of multiple positive and negative electrocaloric responses in (Pb, La)(Zr, Sn, Ti)O3 single crystal

    NASA Astrophysics Data System (ADS)

    Zhuo, Fangping; Li, Qiang; Gao, Jinghan; Wang, Yujie; Yan, Qingfeng; Zhang, Yiling; Xi, Xiaoqing; Chu, Xiangcheng; Cao, Wenwu

    2016-02-01

    The electrocaloric effect has been investigated in antiferroelectric (Pb, La)(Zr, Sn, Ti)O3 (PLZST) single crystals grown by the flux method. The measurements of polarization versus electric field loops on unpoled crystals revealed that at room temperature, a critical electric field of 1.8 kV/mm is needed to induce a ferroelectric phase from an antiferroelectric phase. The dielectric properties demonstrated that the induced ferroelectric phase recovers to antiferroelectric phase when temperature is above the depolarization temperature (70 °C-100 °C). Coexistence of the negative and positive electrocaloric effect has been achieved in ⟨001⟩-oriented PLZST single crystals. Multiple electrocaloric response values of -0.054 °C at room temperature, 0.17 °C near the depolarization temperature, -0.14 °C at 125 °C, and 0.75 °C around Curie temperature have been observed under an electric field of 3 kV/mm. The coexistence of multiple negative and positive electrocaloric effects in one material provides a possibility to design solid-state refrigerator technologies to enhance the electrocaloric efficiency.

  1. Evaluation of Osseointegration around Tibial Implants in Rats by Ibandronate-Treated Nanotubular Ti-32Nb-5Zr Alloy

    PubMed Central

    Nepal, Manoj; Li, Liang; Bae, Tae Sung; Kim, Byung Il; Soh, Yunjo

    2014-01-01

    Materials with differing surfaces have been developed for clinical implant therapy in dentistry and orthopedics. This study was designed to evaluate bone response to titanium alloy containing Ti-32Nb-5Zr with nanostructure, anodic oxidation, heat treatment, and ibandronate coating. Rats were randomly assigned to two groups for implantation of titanium alloy (untreated) as the control group and titanium alloy group coated with ibandronate as the experimental group. Then, the implants were inserted in both tibiae of the rats for four weeks. After implantation, bone implant interface, trabecular microstructure, mechanical fixation was evaluated by histology, micro-computed tomography (μCT) and the push-out test, respectively. We found that the anodized, heat-treated and ibandronate-coated titanium alloy triggered pronounced bone implant integration and early bone formation. Ibandronate-coated implants showed elevated values for removal torque and a higher level of BV/TV, trabecular thickness and separation upon analysis with μCT and mechanical testing. Similarly, higher bone contact and a larger percentage bone area were observed via histology compared to untreated alloy. Furthermore, well coating of ibandronate with alloy was observed by vitro releasing experiment. Our study provided evidences that the coating of bisphosphonate onto the anodized and heat-treated nanostructure of titanium alloy had a positive effect on implant fixation. PMID:25489426

  2. High-Temperature Deformation Characteristics of a β-Type Ti-29Nb-13Ta-4.6Zr Alloy

    NASA Astrophysics Data System (ADS)

    Ghanbari, E.; Zarei-Hanzaki, A.; Farghadany, E.; Abedi, H. R.; Khoddam, Sh.

    2016-04-01

    The hot deformation behavior of a biomedical β-type Ti-Nb-Ta-Zr alloy has been studied through applying hot compression tests over a wide range of temperatures and strain rates (600-900 °C and 0.003-0.3 s-1). The main microstructural feature of the specimens, which were deformed at 900 °C, is the pancaked primary grains decorated by the serrated boundaries. The latter may well imply to the occurrence of dynamic recovery. The dynamic recrystallization however is considered as the main restoration mechanism in the specimens, which were deformed at 800 °C under all strain rates. The sizes of the new recrystallized grains well follow the serration amplitude of the primary grain boundaries. At lower deformation temperatures (600 and 700 °C), the strain rate sensitivity is suddenly decreased and ended to the strain localization in the form of macro shear band. The higher accumulated energy within the shear band zones appears to stimulate the occurrence of dynamic recrystallization. To further clarify the high-temperature flow behavior of the experimental alloy, a quantitative approach has been also employed. The observed flow hardening and softening has been justified considering the evolved microstructural features.

  3. Effect of molybdenum on structure, microstructure and mechanical properties of biomedical Ti-20Zr-Mo alloys.

    PubMed

    Kuroda, Pedro Akira Bazaglia; Buzalaf, Marília Afonso Rabelo; Grandini, Carlos Roberto

    2016-10-01

    Titanium has an allotropic transformation around 883°C. Below this temperature, the crystalline structure is hexagonal close-packed (α phase), changing to body-centered cubic (β phase). Zirconium has the same allotropic transformation around 862°C. Molybdenum has body-centered cubic structure, being a strong β-stabilizer for the formation of titanium alloys. In this paper, the effect of substitutional molybdenum was analyzed on the structure, microstructure and selected mechanical properties of Ti-20Zr-Mo (wt%) alloys to be used in biomedical applications. The samples were prepared by arc-melting and characterized by x-ray diffraction with subsequent refinement by the Rietveld method, optical and scanning electron microscopy. The mechanical properties were analyzed by Vickers microhardness and dynamic elasticity modulus. X-ray measurements and Rietveld analysis revealed the presence of α' phase without molybdenum, α'+α″ phases with 2.5wt% of molybdenum, α″+β phases with 5 and 7.5wt% of molybdenum, and only β phase with 10wt% of molybdenum. These results were corroborated by microscopy results, with a microstructure composed of grains of β phase and lamellae and needles of α' and α″ phase in intra-grain the region. The hardness of the alloy was higher than the commercially pure titanium, due to the action of zirconium and molybdenum as hardening agents. The samples have a smaller elasticity modulus than the commercially pure titanium.

  4. BaZr0.5Ti0.5O3 : Lead-free relaxor ferroelectric or dipolar glass

    NASA Astrophysics Data System (ADS)

    Filipič, C.; Kutnjak, Z.; Pirc, R.; Canu, G.; Petzelt, J.

    2016-06-01

    Glassy freezing dynamics was investigated in BaZr0.5Ti0.5O3 (BZT50) ceramic samples by means of dielectric spectroscopy in the frequency range 0.001 Hz-1 MHz at temperatures 10

  5. Effect of molybdenum on structure, microstructure and mechanical properties of biomedical Ti-20Zr-Mo alloys.

    PubMed

    Kuroda, Pedro Akira Bazaglia; Buzalaf, Marília Afonso Rabelo; Grandini, Carlos Roberto

    2016-10-01

    Titanium has an allotropic transformation around 883°C. Below this temperature, the crystalline structure is hexagonal close-packed (α phase), changing to body-centered cubic (β phase). Zirconium has the same allotropic transformation around 862°C. Molybdenum has body-centered cubic structure, being a strong β-stabilizer for the formation of titanium alloys. In this paper, the effect of substitutional molybdenum was analyzed on the structure, microstructure and selected mechanical properties of Ti-20Zr-Mo (wt%) alloys to be used in biomedical applications. The samples were prepared by arc-melting and characterized by x-ray diffraction with subsequent refinement by the Rietveld method, optical and scanning electron microscopy. The mechanical properties were analyzed by Vickers microhardness and dynamic elasticity modulus. X-ray measurements and Rietveld analysis revealed the presence of α' phase without molybdenum, α'+α″ phases with 2.5wt% of molybdenum, α″+β phases with 5 and 7.5wt% of molybdenum, and only β phase with 10wt% of molybdenum. These results were corroborated by microscopy results, with a microstructure composed of grains of β phase and lamellae and needles of α' and α″ phase in intra-grain the region. The hardness of the alloy was higher than the commercially pure titanium, due to the action of zirconium and molybdenum as hardening agents. The samples have a smaller elasticity modulus than the commercially pure titanium. PMID:27287149

  6. Effects of pH on heat transfer nanofluids containing ZrO2 and TiO2 nanoparticles

    NASA Astrophysics Data System (ADS)

    Wamkam, Carine Tchamakam; Opoku, Michael Kwabena; Hong, Haiping; Smith, Pauline

    2011-01-01

    In this paper, pH influences of zeta potential, particle size distribution, rheology, viscosity, and stability on heat transfer nanofluids are studied. Significant enhancement of thermal conductivity (TC) (>20%) containing 3 wt % zirconium dioxide (ZrO2) and titanium dioxide (TiO2) are observed near the isoelectric point (IEP). Meanwhile, at this IEP (pH), particle sizes, and viscosities of these nanofluids demonstrate a significant increase to maximum values. Experimental results also indicate that the stabilities of these nanofluids are influenced by pH values. The reasonable explanation for these interesting phenomena is that at this IEP, the repulsive forces among metal oxides are zero and nanoparticles coagulate together at this pH value. According to the Derjaguin-Landau-Verwey-Overbeek theory, when the pH is equal to or close to the IEP, nanoparticles tend to be unstable, form clusters, and precipitate. The resulting big clusters will trap water and the structures of trapped water are varied due to the strong atomic force among nanoparticles. Water is packed well inside and volume fraction of the nanoparticles will be larger. In addition, shapes of clusters containing trapped water will not be spherical but rather has irregular structure (like chains). Such structure favors thermal transport because they provide a long link. Therefore, overall TC of nanofluids is enhanced. Some literature results and conclusions related to pH effects of nanofluids are discussed and analyzed. Understanding pH effects may enable exploration of fundamental nature of nanofluids.

  7. First-principles study on magnetism and half-metallicity in bulk and various (001) surfaces of Heusler alloy Zr2VSn with Hg2CuTi-type structure

    NASA Astrophysics Data System (ADS)

    Deng, Zun-Yi; Zhang, Jian-Min

    2016-07-01

    Structural, electronic and magnetic properties in the bulk and five different (001) surfaces (ZrV-, ZrSn-, VV-, ZrZr- and SnSn-terminations) of Zr2 VSn Heusler alloy with Hg2 CuTi -type structure are studied by using first-principles calculations based on density-functional theory. The bulk Zr2 VSn Heusler alloy is ferrimagnetic half-metallicity with equilibrium lattice constant 6.815 Å and total magnetic moment -1.000 μB / f.u . , following the Slater-Pauling rule μt =Zt - 18 . The atoms on different surface layers exhibit different displacements, electronic and magnetic properties. All five (001) surfaces lose the half-metallicity and are not usable in spintronics devices.

  8. Unusual Changes in Electronic Band-Edge Energies of the Nanostructured Transparent n-Type Semiconductor Zr-Doped Anatase TiO2 (Ti1-xZrxO2; x < 0.3).

    PubMed

    Mieritz, Daniel G; Renaud, Adèle; Seo, Dong-Kyun

    2016-07-01

    By the establishment of highly controllable synthetic routes, electronic band-edge energies of the n-type transparent semiconductor Zr-doped anatase TiO2 have been studied holistically for the first time up to 30 atom % Zr, employing powder X-ray diffraction, scanning electron microscopy, transmission electron microscopy, nitrogen gas sorption measurements, UV/vis spectroscopies, and Mott-Schottky measurements. The materials were produced through a sol-gel synthetic procedure that ensures good compositional homogeneity of the materials, while introducing nanoporosity in the structure, by achieving a mild calcination condition. Vegard's law was discovered among the homogeneous samples, and correlations were established between the chemical compositions and optical and electronic properties of the materials. Up to 20% Zr doping, the optical energy gap increases to 3.29 eV (vs 3.19 eV for TiO2), and the absolute conduction band-edge energy increases to -3.90 eV (vs -4.14 eV). The energy changes of the conduction band edge are more drastic than what is expected from the average electronegativities of the compounds, which may be due to the unnatural coordination environment around Zr in the anatase phase.

  9. Structural and Dielectric Studies of Pb(Zr0.65Ti0.35)O3 Electroceramic Modified by Manganese

    NASA Astrophysics Data System (ADS)

    Tiwari, Balgovind; Choudhary, R. N. P.

    A high-temperature solid-state reaction technique was used to prepare polycrystalline samples of electrocerimic, lead zirconate titanate (PZT) modified by manganese (Mn) with Zr/Ti ratio of 65/35 (i.e., Pb(Zr0.65-xMnxTi0.35)O3 (x = 0, 0.02, 0.06, 0.10)). Preliminary structural analysis by an X-ray diffraction (XRD) technique has confirmed the formation of compounds with no pyrochlore phase. The XRD patterns clearly show that there is no major structural change of Pb(Zr0.65-xMnxTi0.35)O3 on substitution of Mn at the Zr-site. Although at higher (x=0.10) modification some small satellite peaks do appear. The micro-structural analysis of the surface of the compounds by scanning electron microscopy (SEM) suggests that the grains are uniformly and densely distributed over the entire surface of all the samples and are spherical in all the cases. Room temperature variation of ɛr and tanδ as a function of frequency shows that ɛr and tanδ decreases with rise in frequency, which is a general feature of normal ferroelectric material’s dielectric properties, irrespective of composition of the specimens. The higher value of ɛr at lower frequencies is due to simultaneous presence of all types of polarizations (i.e., interfacial, ionic, dipolar, electronic, space charge, etc.) in the compounds. Detailed studies of the dielectric properties reveal that the compounds showed (i) shift in Tc, and (ii) improvement in dielectric constant and loss.

  10. Systematic theoretical study of ethylene adsorption on δ-MoC(001), TiC(001), and ZrC(001) surfaces

    DOE PAGESBeta

    Jimenez-Orozco, Carlos; Florez, Elizabeth; Moreno, Andres; Liu, Ping; Rodriguez, José A.

    2016-05-31

    A systematic study of ethylene adsorption over δ-MoC(001), TiC(001), and ZrC(001) surfaces was conducted by means of calculations based on periodic density functional theory. The structure and electronic properties of each carbide pristine surface had a strong influence in the bonding of ethylene. It was found that the metal and carbon sites of the carbide could participate in the adsorption process. As a consequence of this, very different bonding mechanisms were seen on δ-MoC(001) and TiC(001). The bonding of the molecule on the TMC(001) systems showed only minor similarities to the type of bonding found on a typical metal likemore » Pt(111). In general, the ethylene binding energy follow the trend in stability: ZrC(001) < TiC(001) < δ-MoC(001) < Pt(111). The van der Waals correction to the energy produces large binding energy values, modifies the stability orders and drives the ethylene closer to the surface but the adsorbate geometry parameters remain unchanged. Ethylene was activated on clearly defined binding geometries, changing its hybridization from sp2 to sp3 with an elongation (0.16–0.31 Å) of the C=C bond. As a result, on the basis of this theoretical study, δ-MoC(001) is proposed as a potential catalyst for the hydrogenation of olefins, whereas TiC(001) could be useful for their hydrogenolysis.« less

  11. Biological Behaviour and Enhanced Anticorrosive Performance of the Nitrided Superelastic Ti-23Nb-0.7Ta-2Zr-0.5N Alloy

    PubMed Central

    Mitran, Valentina; Vasilescu, Cora; Drob, Silviu Iulian; Osiceanu, Petre; Calderon-Moreno, Jose Maria; Tabirca, Mariana-Cristina; Gordin, Doina-Margareta; Gloriant, Thierry; Cimpean, Anisoara

    2015-01-01

    The influence of gas nitriding surface treatment on the superelastic Ti-23Nb-0.7Ta-2Zr-0.5N alloy was evaluated. A thorough characterization of bare and nitrided Ti-based alloy and pure Ti was performed in terms of surface film composition and morphology, electrochemical behaviour, and short term osteoblast response. XPS analysis showed that the nitriding treatment strongly influenced the composition (nitrides and oxynitrides) and surface properties both of the substrate and of the bulk alloy. SEM images revealed that the nitrided surface appears as a similar dotted pattern caused by the formation of N-rich domains coexisting with less nitrided domains, while before treatment only topographical features could be observed. All the electrochemical results confirmed the high chemical stability of the nitride and oxynitride coating and the superiority of the applied treatment. The values of the corrosion parameters ascertained the excellent corrosion resistance of the coated alloy in the real functional conditions from the human body. Cell culture experiments with MG63 osteoblasts demonstrated that the studied biomaterials do not elicit any toxic effects and support cell adhesion and enhanced cell proliferation. Altogether, these data indicate that the nitrided Ti-23Nb-0.7Ta-2Zr-0.5N alloy is the most suitable substrate for application in bone implantology. PMID:26583096

  12. Giant pyroelectric coefficient determined from the frequency dependence of the pyroelectric signal generated by epitaxial Pb(Zr0.2Ti0.8)O3 layers grown on single crystal SrTiO3 substrates

    NASA Astrophysics Data System (ADS)

    Botea, M.; Iuga, A.; Pintilie, L.

    2013-12-01

    Epitaxial Pb(Zr0.2Ti0.8)O3 layers of good structural quality were grown on single crystal SrTiO3 substrates. The pyroelectric coefficient was estimated from the signal generated by the ferroelectric film working as a pyroelectric detector in the voltage mode, without pre-poling procedure. The obtained value is as high as 1.9 × 10-3 C/m2 K. The large value is attributed to the presence of 90° ferroelectric domains and to the compressive misfit strain, leading to an enhanced ferroelectric polarization.

  13. Microhardness and lattice parameter calibrations of the oxygen solid solutions of unalloyed alpha-titanium and Ti-6Al-2Sn-4Zr-2Mo

    NASA Technical Reports Server (NTRS)

    Wiedemann, K. E.; Shenoy, R. N.; Unnam, J.

    1987-01-01

    Standards were prepared for calibrating microanalyses of dissolved oxygen in unalloyed alpha-Ti and Ti-6Al-2Sn-4Zr-2Mo. Foils of both of these materials were homogenized for 120 hours in vacuum at 871 C following short exposures to the ambient atmosphere at 854 C that had partially oxidized the foils. The variation of Knoop microhardness with oxygen content was calibrated for both materials using 15-g and 5-g indentor loads. The unit-cell lattice parameters were calibrated for the unalloyed alpha-Ti. Example analyses demonstrate the usefulness of these calibrations and support an explanation of an anomaly in the lattice parameter variation. The results of the calibrations have been tabulated and summarized using predictive equations.

  14. Nanocomposite hydroxyapatite formation on a Ti-13Nb-13Zr alloy exposed in a MEM cell culture medium and the effect of H2O2 addition.

    PubMed

    Baker, M A; Assis, S L; Higa, O Z; Costa, I

    2009-01-01

    Titanium alloys are known to nucleate an apatite layer when in contact with simulated body fluid. This improves the bioactivity of titanium implants and accelerates osseointegration. Promoting the formation of hydroxyapatite on biocompatible metals is, therefore, a very important topic of biomaterials research. In this paper, the formation of hydroxyapatite (HA) on the near-beta Ti-13Nb-13Zr alloy by immersion in minimal essential medium (MEM), with and without H(2)O(2) addition, has been studied using electrochemicals methods, scanning electron microscopy and X-ray photoelectron spectroscopy. The in vitro biocompatibility of this alloy was evaluated by cytotoxicity tests. The Ti-13Nb-13Zr alloy exhibits passive behaviour over a wide potential range in MEM and the passive film is composed of an inner barrier layer and an outer porous layer. The addition of H(2)O(2) leads to a thickening of the outer porous layer and strongly reduced current density. With regard to the surface composition, immersion in MEM solution results in the formation of an island-like distribution of HA+amino acids. Addition of H(2)O(2) to the MEM solution strongly promotes the formation of a thicker, continuous but porous nanocomposite layer of HA+amino acids. The Ti-13Nb-13Zr alloy is non-toxic and the nanocomposite HA+amino acid layer formed in the MEM solution favours the growth of osteoblast cells. For Ti alloys, the release of H(2)O(2) in the anti-inflammatory response appears to be an important beneficial process as it accelerates osseointegration. PMID:18815081

  15. Chromium-free conversion coatings based on inorganic salts (Zr/Ti/Mn/Mo) for aluminum alloys used in aircraft applications

    NASA Astrophysics Data System (ADS)

    Santa Coloma, P.; Izagirre, U.; Belaustegi, Y.; Jorcin, J. B.; Cano, F. J.; Lapeña, N.

    2015-08-01

    Novel chromium-free conversion coatings based on Zr/Ti/Mn/Mo compounds were developed at a pilot scale to improve the corrosion resistance of the AA2024-T3 and AA7075-T6 aluminum alloys for aircraft applications. The influence of the presence of Zr and Ti in the Zr/Ti/Mn/Mo conversion bath's formulation on the corrosion resistance of the coated alloys was investigated. The corrosion resistance provided by the conversion coatings was evaluated by salt spray exposure and potentiodynamic sweeps. Optical and scanning electron microscopy coupled with energy dispersive spectroscopy (SEM/EDS) and atomic force microscopy (AFM) operating in the Kelvin Probe mode (SKPFM) were used to provide microstructural information of the coated samples that achieved the best results in the corrosion tests. The salt spray test evidenced the higher corrosion resistance of the coated samples compared to the bare surfaces for both alloys. The potentiodynamic tests showed that the corrosion current density decreased for coated AA7075-T6 and AA2024-T3 alloys, which indicated an obvious improvement of the corrosion resistance with all the processes for both alloys. Although the corrosion resistance of the coated samples appeared to be higher for the alloy AA7075-T6 than for the alloy AA2024-T3, both alloys achieved the best corrosion protection with the coatings deposited from conversion bath formulations containing no titanium salts. The microscopy analysis on the coated AA7075-T6 samples revealed that a local deposition of Zr compounds and, possibly, an oxidation process occurred in the vicinity of the alloy's intermetallic particles. The amount of the Zr deposits at these locations increased with coating's formulations without Ti, which provided the best corrosion resistance. The Cr-free conversion coatings developed in this study for the AA7075-T6 and AA2024-T3 alloys do not meet yet the strict requirements of the aircraft industry. However, they significantly improved the corrosion

  16. Wear studies on ZrO2-filled PEEK as coating bearing materials for artificial cervical discs of Ti6Al4V.

    PubMed

    Song, Jian; Liu, Yuhong; Liao, Zhenhua; Wang, Song; Tyagi, Rajnesh; Liu, Weiqiang

    2016-12-01

    Polyetheretherketone (PEEK) and its composite coatings are believed to be the potential candidates' bio-implant materials. However, these coatings have not yet been used on the surface of titanium-based orthopedics and joint products and very few investigations on the tribological characteristics could be found in the published literature till date. In this study, the wettabilities, composition and micro-hardness were characterized using contact angle measurement, scanning electron microscopy (SEM) and hardness tester. The tribological tests were conducted using a ball-on-disc contact pair under 25% newborn calf serum (NCS) lubricated condition. For comparison, bare Ti6Al4V was studied. The obtained results revealed that those PEEK/ZrO2 composite coatings could improve the tribological properties of Ti6Al4V significantly. Adhesive wear and mild abrasive wear might be the dominant wear and failure mechanisms for PEEK/ZrO2 composite coatings in NCS lubricated condition. After comprehensive evaluation in the present study, 5wt.% ZrO2 nanoparticles filled PEEK coating displayed the optimum tribological characteristics and could be taken as a potential candidate for the bearing material of artificial cervical disc.

  17. HRTEM and TEM studies of amorphous structures in ZrNiTiCu base alloys obtained by rapid solidification or ball milling.

    PubMed

    Dutkiewicz, J; Lityńska, L; Maziarz, W; Kocisko, R; Molnarová, M; Kovácová, A

    2009-01-01

    Amorphous structure of Ti(25)Zr(17)Ni(29)Cu(29) composition was studied. Alloys were prepared either by rapid solidification using melt spinning or by high-energy ball milling. The composition of multi-component eutectic in slowly cooled samples of ZrNiTiCu alloy was determined using EDS measurements in scanning microscope of slowly cooled cast samples. The alloys of eutectic composition were melt-spun or ball-milled. Transmission electron microscopy (TEM) studies of melt-spun ribbons from alloys near eutectic composition did not show presence of nanocrystals within the amorphous structure. TEM studies of ball-milled powders showed presence of nanocrystallites of size 2-5 nm. The electron diffraction pattern showed intense diffused ring due to the presence of the amorphous phase and a weak spot due to crystalline phases which were difficult to identify. The high temperature high-pressure compaction in vacuum of amorphous ball-milled powders resulted in a similar structure like in the powders showing nanocrystals embedded in the amorphous matrix. The crystallites were imaged using HREM. Interplanar distances were measured in pictures obtained by inverse fast Fourier transform (IFFT) of atomic planes to obtain better contrast. Analysis of the IFFT from high-resolution micrographs allowed to identify Cu(10)Zr(7) phase. Point analysis and elemental mapping performed using nondispersive X-ray energy spectroscopy showed uniform elements distribution indicating that chemical segregation to nanocrystals is within measurement error. PMID:18614372

  18. Wear studies on ZrO2-filled PEEK as coating bearing materials for artificial cervical discs of Ti6Al4V.

    PubMed

    Song, Jian; Liu, Yuhong; Liao, Zhenhua; Wang, Song; Tyagi, Rajnesh; Liu, Weiqiang

    2016-12-01

    Polyetheretherketone (PEEK) and its composite coatings are believed to be the potential candidates' bio-implant materials. However, these coatings have not yet been used on the surface of titanium-based orthopedics and joint products and very few investigations on the tribological characteristics could be found in the published literature till date. In this study, the wettabilities, composition and micro-hardness were characterized using contact angle measurement, scanning electron microscopy (SEM) and hardness tester. The tribological tests were conducted using a ball-on-disc contact pair under 25% newborn calf serum (NCS) lubricated condition. For comparison, bare Ti6Al4V was studied. The obtained results revealed that those PEEK/ZrO2 composite coatings could improve the tribological properties of Ti6Al4V significantly. Adhesive wear and mild abrasive wear might be the dominant wear and failure mechanisms for PEEK/ZrO2 composite coatings in NCS lubricated condition. After comprehensive evaluation in the present study, 5wt.% ZrO2 nanoparticles filled PEEK coating displayed the optimum tribological characteristics and could be taken as a potential candidate for the bearing material of artificial cervical disc. PMID:27612794

  19. Designing new biocompatible glass-forming Ti75-x Zr10 Nbx Si15 (x = 0, 15) alloys: corrosion, passivity, and apatite formation.

    PubMed

    Abdi, Somayeh; Oswald, Steffen; Gostin, Petre Flaviu; Helth, Arne; Sort, Jordi; Baró, Maria Dolors; Calin, Mariana; Schultz, Ludwig; Eckert, Jürgen; Gebert, Annett

    2016-01-01

    Glass-forming Ti-based alloys are considered as potential new materials for implant applications. Ti75 Zr10 Si15 and Ti60 Zr10 Nb15 Si15 alloys (free of cytotoxic elements) can be produced as melt-spun ribbons with glassy matrix and embedded single β-type nanocrystals. The corrosion and passivation behavior of these alloys in their homogenized melt-spun states have been investigated in Ringer solution at 37°C in comparison to their cast multiphase crystalline counterparts and to cp-Ti and β-type Ti-40Nb. All tested materials showed very low corrosion rates as expressed in corrosion current densities icorr  < 50 nA/cm(2). Electrochemical and surface analytical studies revealed a high stability of the new alloys passive states in a wide potential range. This corresponds to low passive current densities ipass  = 2 ± 1 µA/cm(2) based on the growth of oxide films with thickness d <10 nm. A homogeneous constituent distribution in the melt-spun alloys is beneficial for stable surface passivity. The addition of Nb does not only improve the glass-forming ability and the mechanical properties but also supports a high pitting resistance even at extreme anodic polarization up to 4V versus SCE were oxide thickness values of d ∼35 nm are reached. With regard to the corrosion properties, the Nb-containing nearly single-phase glassy alloy can compete with the β-type Ti-40Nb alloy. SBF tests confirmed the ability for formation of hydroxyapatite on the melt-spun alloy surfaces. All these properties recommend the new glass-forming alloys for application as wear- and corrosion-resistant coating materials for implants. PMID:25611821

  20. Designing new biocompatible glass-forming Ti75-x Zr10 Nbx Si15 (x = 0, 15) alloys: corrosion, passivity, and apatite formation.

    PubMed

    Abdi, Somayeh; Oswald, Steffen; Gostin, Petre Flaviu; Helth, Arne; Sort, Jordi; Baró, Maria Dolors; Calin, Mariana; Schultz, Ludwig; Eckert, Jürgen; Gebert, Annett

    2016-01-01

    Glass-forming Ti-based alloys are considered as potential new materials for implant applications. Ti75 Zr10 Si15 and Ti60 Zr10 Nb15 Si15 alloys (free of cytotoxic elements) can be produced as melt-spun ribbons with glassy matrix and embedded single β-type nanocrystals. The corrosion and passivation behavior of these alloys in their homogenized melt-spun states have been investigated in Ringer solution at 37°C in comparison to their cast multiphase crystalline counterparts and to cp-Ti and β-type Ti-40Nb. All tested materials showed very low corrosion rates as expressed in corrosion current densities icorr  < 50 nA/cm(2). Electrochemical and surface analytical studies revealed a high stability of the new alloys passive states in a wide potential range. This corresponds to low passive current densities ipass  = 2 ± 1 µA/cm(2) based on the growth of oxide films with thickness d <10 nm. A homogeneous constituent distribution in the melt-spun alloys is beneficial for stable surface passivity. The addition of Nb does not only improve the glass-forming ability and the mechanical properties but also supports a high pitting resistance even at extreme anodic polarization up to 4V versus SCE were oxide thickness values of d ∼35 nm are reached. With regard to the corrosion properties, the Nb-containing nearly single-phase glassy alloy can compete with the β-type Ti-40Nb alloy. SBF tests confirmed the ability for formation of hydroxyapatite on the melt-spun alloy surfaces. All these properties recommend the new glass-forming alloys for application as wear- and corrosion-resistant coating materials for implants.

  1. Excellent stability of plasma-sprayed bioactive Ca 3ZrSi 2O 9 ceramic coating on Ti-6Al-4V

    NASA Astrophysics Data System (ADS)

    Liang, Ying; Xie, Youtao; Ji, Heng; Huang, Liping; Zheng, Xuebin

    2010-05-01

    In this work, novel zirconium incorporated Ca-Si based ceramic powder Ca 3ZrSi 2O 9 was synthesized. The aim of this study was to fabricate Ca 3ZrSi 2O 9 coating onto Ti-6Al-4V substrate using atmospheric plasma-spraying technology and to evaluate its potential applications in the fields of orthopedics and dentistry. The phase composition, surface morphologies of the coating were examined by XRD and SEM, which revealed that the Ca 3ZrSi 2O 9 coating was composed of grains around 100 nm and amorphous phases. The bonding strength between the coating and the substrate was 28 ± 4 MPa, which is higher than that of traditional HA coating. The dissolution rate of the coating was assessed by monitoring the ions release and mass loss after immersion in the Tris-HCl buffer solution. The in vitro bioactivity of the coating was determined by observing the formation of apatite on its surface in simulated body fluids. It was found that the Ca 3ZrSi 2O 9 coating possessed both excellent chemical stability and good apatite-formation ability, suggesting its potential use as bone implants.

  2. Microstructure of second-phase particles in Ti-5Al-4Sn-2Zr-1Mo-0.25Si-1Nd alloy

    SciTech Connect

    Li, G.P.; Li, D.; Liu, Y.Y.; Guan, S.X.; Wang, Q.J.; Ping, D.H.; Hu, Z.Q.

    1997-08-01

    The microstructure of second-phase particles in the Ti-55 alloy (Ti-5Al-4Sn-2Zr-1Mo-025Si-1Nd) was studied by scanning electron microscopy, transmission electron microscopy (TEM), and high-resolution electron microscopy (HREM) observations. The second-phase particles in the conventional ingot-cast Ti-55 alloy of 1 to 15 {micro}m in diameter and uniform distribution in matrix were observed, where the majority of these particles are elliptical. The microstructure of the second-phase particles in the quenched Ti-55 alloy was also studied. Fine and uniform dispersoids (6 to 15 nm in diameter) were observed in the as-quenched state. Some lenslike particles occur at the grain boundaries, other elliptical particles appear within the grains, and some particles within the grains form rows which are parallel to the advancing liquid-solid interface. After annealing at 980 C (1 to 10 hours), of the as-quenched Ti-55 alloy, coarse particles are 17 to 42 nm in average diameter, and the growth of the particles is very slow. The dispersoids in the as-annealed Ti-55 alloy are identified as nanocrystalline Nd{sub 5}Sn (orthorhombic, Pnmn, a = 0.814 nm, b = 1.732 nm, and c = 0.814 nm) intermetallic compound, and the interface between the Nd{sub 5}Sn{sub 4} phase and the matrix is a typical high-angle grain boundary.

  3. Effect of Ce/Zr molar ratio on the performance of Cu–Ce{sub x}–Zr{sub 1−x}/TiO{sub 2} catalyst for selective catalytic reduction of NO{sub x} with NH{sub 3} in diesel exhaust

    SciTech Connect

    Sun, Xiaoliang; Gong, Cairong; Lv, Gang; Bin, Feng; Song, Chonglin

    2014-12-15

    Graphical abstract: The Cu–Ce{sub 0.25}–Zr{sub 0.75}/TiO{sub 2} catalyst exhibited excellent SCR activity at 165–450 °C within the range of exhaust temperatures of diesel engines. - Highlights: • Cu–Ce{sub x}–Zr{sub 1−x}/TiO{sub 2} catalysts were prepared by a wet impregnation method. • The property for NH{sub 3}-selective catalytic reduction of NO{sub x} were investigated. • The Ce/Zr molar ratio had effects on the performance of Cu–Ce–Zr/TiO{sub 2} catalysts. • The Cu–Ce{sub 0.25}–Zr{sub 0.75}/TiO{sub 2} sample exhibited 100% NO{sub x} conversion between 165 °C and 450 °C. • The factors that govern the activity enhancement were extensively investigated. - Abstract: Copper–cerium–zirconium catalysts loaded on TiO{sub 2} prepared by a wet impregnation method were investigated for NH{sub 3}-selective catalytic reduction of NO{sub x}, aiming to study the effects of the Ce/Zr molar ratio on the performance of Cu–Ce–Zr/TiO{sub 2} catalysts. The Cu–Ce{sub 0.25}–Zr{sub 0.75}/TiO{sub 2} sample exhibited nearly 100% NO{sub x} conversion over a wide temperature range (165–450 °C), which is strikingly superior to that of Cu/TiO{sub 2} (210–389 °C) within the range of exhaust temperatures of diesel engines. The factors that govern the activity enhancement were extensively investigated by using a series of characterization techniques, namely X-ray diffraction (XRD), transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS) and temperature-programmed reduction by hydrogen (H{sub 2}-TPR). The results showed that the addition of zirconium and/or cerium refined the copper dispersion, prevented copper crystallization and partially incorporated the copper ions into the zirconia (ceira) lattice, which led to enhance the redox abilities of Cu–Ce–Zr/TiO{sub 2} catalysts.

  4. Effects of Zr-Substitution on Microwave Dielectric Properties of Na0.5Nd0.2Sm0.3Ti1- x Zr x O3 Ceramics ( x = 0.00 ˜ 0.30)

    NASA Astrophysics Data System (ADS)

    Fang, Zixuan; Tang, Bin; Si, Feng; Gong, Yuting; Zhang, Shuren

    2016-10-01

    In this paper, the compound Na0.5Nd0.2Sm0.3Ti1- x Zr x O3 (NNSTZ x, x = 0.00, 0.01, 0.02, 0.05, 0.09, 0.14, 0.20, 0.30) ceramics were prepared by the conventional solid-state route. The main phase of all NNSTZ x samples were indexed as an orthorhombic perovskite structure. The permittivity ( ɛ r) and quality factor ( Q × f) were improved because of improvement of relative density and homogeneous microstructure with minor Zr substitution ( x ≤ 0.02). When x ≤ 0.14, the temperature coefficient of the resonant frequency ( τ f) could be effectively tuned to a relatively low value of 110.3 ppm/°C due to a continuous decrease of tolerance factors. A remarkable decrease of τf from 110.3 ppm/°C to -2.38 ppm/°C was obtained since a certain amount of Nd2Ti2O7 phase was observed with x ≥ 0.20. Typically, the NNSTZ x ( x = 0.20) ceramic sintered in air at 1450°C for 2 h exhibited good microwave dielectric properties of ɛ r = 75.4, Q × f=6813 GHz, and τ f = 67.8 ppm/°C.

  5. Characterization of solid-phase welds between Ti-6Al-2Sn-4Zr-2Mo-0. 01Si and Ti-13. 5A1-21. 5Nb titanium aluminide

    SciTech Connect

    Baeslack, W.A. III; Juhas, M.; Fraser, H.L. ); Broderick, T.F. . Materials Directorate)

    1994-12-01

    Dissimilar-alloy welds have been produced between Ti-6Al-2Sn-4Zr-2Mo-0.1Si (wt.%) and Ti-13.5Al-21.5Nb (wt.%) titanium aluminide using three different solid-phase welding processes that create significantly different thermo-mechanical conditions at the weld interface. Exposure to supertransus temperatures, appreciable deformation and rapid cooling of the weld interface region during linear-friction welding promote dynamic recrystallization of beta grains and beta decomposition to fine martensitic products. In contrast, diffusion welding at temperatures below the base metal beta transus temperatures and at relatively low pressures minimizes deformation and microstructural variations in the weld interface region relative to the unaffected base metal. During capacitor-discharge resistance spot welding, extremely rapid heating of the weld interface region to near-solidus temperatures, and subsequent rapid cooling, result in the formation of a metastable, ordered-beta microstructure in the Ti-13.5ASl-21.5Nb and fine alpha-prime martensite in the Ti-6Al-2Sn-4Zr-2Mo-0.1Si.

  6. X-ray microstructural analysis of nanocrystalline TiZrN thin films by diffraction pattern modeling

    SciTech Connect

    Escobar, D.; Ospina, R.; Gómez, A.G.; Restrepo-Parra, E.; Arango, P.J.

    2014-02-15

    A detailed microstructural characterization of nanocrystalline TiZrN thin films grown at different substrate temperatures (T{sub S}) was carried out by X-ray diffraction (XRD). Total diffraction pattern modeling based on more meaningful microstructural parameters, such as crystallite size distribution and dislocation density, was performed to describe the microstructure of the thin films more precisely. This diffraction modeling has been implemented and used mostly to characterize powders, but the technique can be very useful to study hard thin films by taking certain considerations into account. Nanocrystalline films were grown by using the cathodic pulsed vacuum arc technique on stainless steel 316L substrates, varying the temperature from room temperature to 200 °C. Further surface morphology analysis was performed to study the dependence of grain size on substrate temperature using atomic force microscopy (AFM). The crystallite and surface grain sizes obtained and the high density of dislocations observed indicate that the films underwent nanostructured growth. Variations in these microstructural parameters as a function of T{sub S} during deposition revealed a competition between adatom mobility and desorption processes, resulting in a specific microstructure. These films also showed slight anisotropy in their microstructure, and this was incorporated into the diffraction pattern modeling. The resulting model allowed for the films' microstructure during synthesis to be better understood according to the experimental results obtained. - Highlights: • Mobility and desorption competition generates a critical temperature. • A microstructure anisotropy related to the local strain was observed in thin films. • Adatom mobility and desorption influence grain size and microstrain.

  7. Microstructure and properties of rapidly solidified beryllium-transition metal alloys. [With small amounts of Ti, Zr and Y (1-3 wt %)

    SciTech Connect

    Jacobson, L.A.; Richardson, S.

    1988-01-01

    Alloys of beryllium with small amounts of Ti, Zr and Y (1-3 wt %) were rapidly solidified using an arc hammer splat technique. Each of these elements forms a dilute eutectic with beryllium, and has very low solid solubility in the alpha phase. In the case of Ti, the Be-rich compound is TiBe/sub 12/, and for Zr and Y, the compound is MBe. The objective of the work was to achieve a fine, uniform dispersion of particles of the intermetallic compound. Since these compounds have very high melting points, it was expected that rapidly solidified microstructures would be relatively stable at elevated temperatures. This microstructural stability should result in improved high temperature properties for the alloys. Microstructures have been characterized using optical, scanning and transmission electron microscopy. Microhardness measurements have been made in order to determine the effects of rapid solidification and to evaluate the effects of high temperature exposure on microstructural stability and property retention. The results will be presented in light of the potential of these alloys for intermediate temperature application. 12 refs., 8 figs.

  8. Microstructural evaluation of boron free and boron containing heat-treated Ti-35Nb-7.2Zr-5.7Ta alloy.

    PubMed

    Majumdar, Pallab

    2012-04-01

    The microstructure of Ti-35Nb-7.2Zr-5.7Ta (TNZT) and Ti-35Nb-7.2Zr-5.7Ta-0.5B (TNZTB) alloys under different heat treatment conditions has been analyzed. The solution-treated and water-quenched TNZT sample consists mainly of β phase with a very small amount of fine athermal ω precipitate. Precipitation of α can be observed when solution-treated samples are directly aged at 580°C for 8 h. The microstructure of the samples subjected to single-stage aging at 300°C or 400°C consists of ω precipitates in equiaxed β grains. Second stage aging at 580°C for 8 h after first stage of aging at 300°C or 400°C results in the replacement of ω precipitates by secondary α. In all of these samples, the amount of ω or α phase was very small, and therefore they could not be detected by X-ray diffraction studies. However, analysis of selected area diffraction patterns obtained from transmission electron microscopy studies confirms their presence. The addition of boron leads to the formation of dispersed precipitates of TiB in the β matrix of the TNZT alloy and also refines the β grains in the microstructure. However, other microstructural features of the TNZTB alloy are similar to those of the TNZT alloy.

  9. Influence of ZrO2, SiO2, Al2O3 and TiO2 nanoparticles on maize seed germination under different growth conditions.

    PubMed

    Karunakaran, Gopalu; Suriyaprabha, Rangaraj; Rajendran, Venkatachalam; Kannan, Narayanasamy

    2016-08-01

    The focus of this investigation is to evaluate the phytotoxicity of selected metal oxide nanoparticles and microparticles as a function of maize seed germination and root elongation under different growth conditions (Petri plate, cotton and soil). The results of seed germination and root elongation experiments reveal that all the growth conditions show almost similar results. Alumina (Al2O3) and titania (TiO2) nanoparticles significantly reduce the germination percentage, whereas silica (SiO2) nanoparticles and microparticles enhance the same. The results of nanoparticles and microparticles of zirconia (ZrO2) are found to be same as those of controls. Root elongation is enhanced by SiO2 nanoparticles and microparticles treatment, whereas inhibition is observed with Al2O3 and TiO2 nanoparticles and microparticles. The X-ray fluorescence spectrometry data of the treated and control seed samples show that seeds uptake SiO2 particles to a greater extent followed by TiO2, Al2O3 and ZrO2. In addition, the uptake of nanoparticles is found to be greater than that of microparticles. Thus, the tested metal oxides penetrated seeds at the nanoscale as compared with the microscale. This study clarifies phytotoxicity of nanoparticles treated in different growth substrates and highlights the impact of nanoparticles on environment and agricultural systems. PMID:27463785

  10. Optical and dielectric relaxor behaviour of Ba(Zr0.25Ti0.75)O3 ceramic explained by means of distorted clusters

    NASA Astrophysics Data System (ADS)

    Badapanda, T.; Rout, S. K.; Cavalcante, L. S.; Sczancoski, J. C.; Panigrahi, S.; Longo, E.; Li, M. Siu

    2009-09-01

    In this work, Ba(Zr0.25Ti0.75)O3 ceramic was prepared by solid-state reaction. This material was characterized by x-ray diffraction and Fourier transform Raman spectroscopy. The temperature dependent dielectric properties were investigated in the frequency range from 1 kHz to 1 MHz. The dielectric measurements indicated a diffuse phase transition. The broadening of the dielectric permittivity in the frequency range as well as its shifting at higher temperatures indicated a relaxor-like behaviour for this material. The diffusivity and the relaxation strength were estimated using the modified Curie-Weiss law. The optical properties were analysed by ultraviolet-visible (UV-vis) absorption spectroscopy and photoluminescence (PL) measurements at room temperature. The UV-vis spectrum indicated that the Ba(Zr0.25Ti0.75)O3 ceramic has an optical band gap of 2.98 eV. A blue PL emission was observed for this compound when excited with 350 nm wavelength. The polarity as well as the PL property of this material was attributed to the presence of polar [TiO6] distorted clusters into a globally cubic matrix.

  11. Ag-TiO2 nanoparticle codoped SiO2 films on ZrO2 barrier-coated glass substrates with antibacterial activity in ambient condition.

    PubMed

    Mukhopadhyay, Anindita; Basak, Sujit; Das, Jugal Kishore; Medda, Samar Kumar; Chattopadhyay, Krishnananda; De, Goutam

    2010-09-01

    Anatase TiO2 and Ag nanoparticles (NPs) codoped SiO2 films were prepared by the sol-gel method. Proportionate amounts of 3-(glycidoxypropyl)trimethoxysilane (GLYMO), tetraethylorthosilicate (TEOS) and 3-(methacryloxypropyl)trimethoxysilane (MEMO) derived inorganic-organic silica sol, commercially available dispersed anatase TiO2 NPs, and AgNO3 were used to prepare the sols. The films were prepared on ZrO2 (cubic) precoated soda-lime glass substrates by a single-dipping technique and heat-treated at 450 °C in air and H2/Ar atmosphere to obtain hard, relatively porous, and transparent coatings of thickness>600 nm. The ZrO2 barrier layer was previously applied on soda-lime glass to restrict the diffusion of Ag into the substrate. The Ag-TiO2 NPs incorporated SiO2 films were intense yellow in color and found to be fairly stable at ambient condition for several days under fluorescent light. These films show a considerable growth inhibition on contact with the gram negative bacteria E. coli.

  12. Effects of heat treatment on evolution of microstructure of boron free and boron containing biomedical Ti-13Zr-13Nb alloys.

    PubMed

    Majumdar, Pallab

    2012-08-01

    In the present study, the effects of heat treatment on the microstructure of Ti-13Zr-13Nb (TZN) and Ti-13Zr-13Nb-0.5B (TZNB) alloys have been investigated. Depending on the heat treatment conditions, the microstructure of the heat treated TZN alloy consisted mainly of elongated and/or equiaxed α, β or martensite. Slow cooling (furnace or air cooling) from the solution treatment temperature produced α and β phases in the microstructure. Rapid cooling (water quenching) resulted in martensite and retained β when the solution treatment temperature was above or close to β transus. However, martensite was not formed after water quenching from a solution treatment temperature which was below β transus due to partitioning effect of the alloying elements. Increasing the cooling rate from the furnace cooling to the air cooling led to finer microstructure. Aging of water quenched samples transformed the martensite, if present, into α and β, and the morphology of α phase changed from elongated to equiaxed and enhanced the growth of α. The microstructure of all the TZNB samples consisted of dispersed precipitated particles of TiB in the matrix. The majority of the boride particles showed an acicular (needle like) morphology. The other phases present in the TZNB alloy were similar to those in the similarly heat treated TZN alloy. Moreover, a growth of α phase was observed in the microstructure of TZNB alloy when compared with that of TZN alloy.

  13. Influence of ZrO2, SiO2, Al2O3 and TiO2 nanoparticles on maize seed germination under different growth conditions.

    PubMed

    Karunakaran, Gopalu; Suriyaprabha, Rangaraj; Rajendran, Venkatachalam; Kannan, Narayanasamy

    2016-08-01

    The focus of this investigation is to evaluate the phytotoxicity of selected metal oxide nanoparticles and microparticles as a function of maize seed germination and root elongation under different growth conditions (Petri plate, cotton and soil). The results of seed germination and root elongation experiments reveal that all the growth conditions show almost similar results. Alumina (Al2O3) and titania (TiO2) nanoparticles significantly reduce the germination percentage, whereas silica (SiO2) nanoparticles and microparticles enhance the same. The results of nanoparticles and microparticles of zirconia (ZrO2) are found to be same as those of controls. Root elongation is enhanced by SiO2 nanoparticles and microparticles treatment, whereas inhibition is observed with Al2O3 and TiO2 nanoparticles and microparticles. The X-ray fluorescence spectrometry data of the treated and control seed samples show that seeds uptake SiO2 particles to a greater extent followed by TiO2, Al2O3 and ZrO2. In addition, the uptake of nanoparticles is found to be greater than that of microparticles. Thus, the tested metal oxides penetrated seeds at the nanoscale as compared with the microscale. This study clarifies phytotoxicity of nanoparticles treated in different growth substrates and highlights the impact of nanoparticles on environment and agricultural systems.

  14. 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.

  15. 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.

  16. Wear transition of solid-solution-strengthened Ti-29Nb-13Ta-4.6Zr alloys by interstitial oxygen for biomedical applications.

    PubMed

    Lee, Yoon-Seok; Niinomi, Mitsuo; Nakai, Masaaki; Narita, Kengo; Cho, Ken; Liu, Huihong

    2015-11-01

    In previous studies, it has been concluded that volume losses (V loss) of the Ti-29Nb-13Ta-4.6Zr (TNTZ) discs and balls are larger than those of the respective Ti-6Al-4V extra-low interstitial (Ti64) discs and balls, both in air and Ringer's solution. These results are related to severe subsurface deformation of TNTZ, which is caused by the lower resistance to plastic shearing of TNTZ than that of Ti64. Therefore, it is necessary to further increase the wear resistance of TNTZ to satisfy the requirements as a biomedical implant. From this viewpoint, interstitial oxygen was added to TNTZ to improve the plastic shear resistance via solid-solution strengthening. Thus, the wear behaviors of combinations comprised of a new titanium alloy, TNTZ with high oxygen content of 0.89 mass% (89O) and a conventional titanium alloy, Ti64 were investigated in air and Ringer's solution for biomedical implant applications. The worn surfaces, wear debris, and subsurface damage were analyzed using a scanning electron microscopy and an electron probe microanalysis. V loss of the 89O discs and balls are smaller than those of the respective TNTZ discs and balls in both air and Ringer's solution. It can be concluded that the solid-solution strengthening by oxygen effectively improves the wear resistance for TNTZ materials. However, the 89O disc/ball combination still exhibits higher V loss than the Ti64 disc/ball combination in both air and Ringer's solution. Moreover, V loss of the disc for the 89O disc/Ti64 ball combination significantly decreases in Ringer's solution compared to that in air. This decrease for the 89O disc/Ti64 ball combination in Ringer's solution can be explained by the transition in the wear mechanism from severe delamination wear to abrasive wear.

  17. Revised structural phase diagram of (Ba{sub 0.7}Ca{sub 0.3}TiO{sub 3})-(BaZr{sub 0.2}Ti{sub 0.8}O{sub 3})

    SciTech Connect

    Keeble, Dean S.; Thomas, Pam A.; Benabdallah, Feres; Maglione, Mario; Kreisel, Jens

    2013-03-04

    The temperature-composition phase diagram of barium calcium titanate zirconate (x(Ba{sub 0.7}Ca{sub 0.3}TiO{sub 3})-(1 - x)(BaZr{sub 0.2}Ti{sub 0.8}O{sub 3}); BCTZ) has been reinvestigated using high-resolution synchrotron x-ray powder diffraction. Contrary to previous reports of an unusual rhombohedral-tetragonal phase transition in this system, we have observed an intermediate orthorhombic phase, isostructural to that present in the parent phase, BaTiO{sub 3}, and we identify the previously assigned T-R transition as a T-O transition. We also observe the O-R transition coalescing with the previously observed triple point, forming a phase convergence region. The implication of the orthorhombic phase in reconciling the exceptional piezoelectric properties with the surrounding phase diagram is discussed.

  18. High electrostrictive coefficient Q33 in lead-free Ba(Zr0.2Ti0.8)O3-x(Ba0.7Ca0.3)TiO3 piezoelectric ceramics

    NASA Astrophysics Data System (ADS)

    Li, Fei; Jin, Li; Guo, Runping

    2014-12-01

    In this study, the electrostrictive effect in Ba(Zr0.2Ti0.8)O3-x(Ba0.7Ca0.3)TiO3 (BZT-xBCT, x = 0.4, 0.5, and 0.6) ceramics was investigated to gain understanding of their high piezoelectric activity. The electrostrictive coefficient Q33 of the BZT-xBCT ceramics was observed to be around 0.04 m4/C2, twice that reported for Pb(Zr,Ti)O3-based ceramics. The Q33 was found to be quite stable with respect to temperature and composition for the BZT-xBCT ceramics. The addition of Fe3+ dopant to the ceramics greatly decreased their Curie temperature without affecting their Q33, which remained 0.04 m4/C2. Moreover, a high and hysteresis-free electric-field-induced strain was obtained for 2 at. % Fe-doped BZT-0.5BCT ceramics at room temperature, caused by their high Q33 coefficient and lower-than-room-temperature Curie temperature. The small-signal M33 coefficient of 2 at. % Fe-doped BZT-0.5BCT ceramics was found to be 1.5 × 10-16 m2/V2 (0.32 × 10-16 m2/V2 for undoped counterpart). These results indicate that 2 at. % Fe-doped BZT-0.5BCT ceramics have great potential as alternatives for hard Pb(Zr,Ti)O3 ceramics in actuator applications, where reproducible and non-hysteretic deformation responses are required.

  19. Effect of samarium and iron substitution on the structural and magnetic properties of BaZr0.05Ti0.95O3 ceramics

    NASA Astrophysics Data System (ADS)

    Kaur, Randeep; Kaur, Anumeet; Singh, Anupinder; Singh, Mandeep; Singh, Lakhwant

    2016-05-01

    Samarium and Iron doped barium zirconate titanate (SF-BZT) ceramics with general formula (SmFeO3)x - (BaZr0.05Ti0.95O3)1-x (x = 0, 0.21, 0.22, 0.23) were prepared by solid state reaction route. X-Ray Diffraction revealed the proper phase formation and the profile matching with constant scale factor confirmed phase change from tetragonal to pseudo cubic with increase in samarium and iron content. The SEM micrographs show proper grain growth in samples. The magnetic data confirmed the presence of ferromagnetic character in the SF-BZT solid solutions.

  20. Deformation Mechanisms and Biocompatibility of the Superelastic Ti-23Nb-0.7Ta-2Zr-0.5N Alloy

    NASA Astrophysics Data System (ADS)

    Castany, P.; Gordin, D. M.; Drob, S. I.; Vasilescu, C.; Mitran, V.; Cimpean, A.; Gloriant, T.

    2016-03-01

    In this study, we have synthesized a new Ti-23Nb-0.7Ta-2Zr-0.5N alloy composition with the aim to obtain useful mechanical properties to be used in medicine such as high strength, good superelastic property, low modulus, and large ductility. Thus, mechanical properties including superelasticity and plasticity were investigated in relation with the different deformation mechanisms observed (stress-induced martensitic transformation, twinning and dislocation slip). On the other hand, the corrosion resistance in simulated body fluid (Ringer solution) and the in vitro cell behavior (MG63 human osteoblasts) of such biomedical alloy were also evaluated in order to assess its biocompatibility.

  1. 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.

  2. Nano-embossing technology on ferroelectric thin film Pb(Zr0.3,Ti0.7)O3 for multi-bit storage application

    PubMed Central

    2011-01-01

    In this work, we apply nano-embossing technique to form a stagger structure in ferroelectric lead zirconate titanate [Pb(Zr0.3, Ti0.7)O3 (PZT)] films and investigate the ferroelectric and electrical characterizations of the embossed and un-embossed regions, respectively, of the same films by using piezoresponse force microscopy (PFM) and Radiant Technologies Precision Material Analyzer. Attributed to the different layer thickness of the patterned ferroelectric thin film, two distinctive coercive voltages have been obtained, thereby, allowing for a single ferroelectric memory cell to contain more than one bit of data. PMID:21794156

  3. Review of crystal and domain structures in the PbZr{sub x}Ti{sub 1-x}O{sub 3} solid solution

    SciTech Connect

    Woodward, David I.; Reaney, Ian M.; Knudsen, Jesper

    2005-09-01

    Several intermediate phases have recently been identified in the PbZr{sub x}Ti{sub 1-x}O{sub 3} (PZT) phase diagram, located close to the antiferroelectric-ferroelectric and morphotropic phase boundaries. Superlattice reflections from some of these phases are clearly visible in the appropriate electron diffraction patterns and have therefore been used to provide further information concerning their symmetry. Here, the structural distortions giving rise to the new phases are discussed and their domain structures compared with those of tetragonal and rhombohedral PZT. Coherent structural arguments are presented to explain the observed phase transition sequences.

  4. Nano-embossing technology on ferroelectric thin film Pb(Zr0.3,Ti0.7)O3 for multi-bit storage application

    NASA Astrophysics Data System (ADS)

    Shen, Zhenkui; Chen, Zhihui; Lu, Qian; Qiu, Zhijun; Jiang, Anquan; Qu, Xinping; Chen, Yifang; Liu, Ran

    2011-07-01

    In this work, we apply nano-embossing technique to form a stagger structure in ferroelectric lead zirconate titanate [Pb(Zr0.3, Ti0.7)O3 (PZT)] films and investigate the ferroelectric and electrical characterizations of the embossed and un-embossed regions, respectively, of the same films by using piezoresponse force microscopy (PFM) and Radiant Technologies Precision Material Analyzer. Attributed to the different layer thickness of the patterned ferroelectric thin film, two distinctive coercive voltages have been obtained, thereby, allowing for a single ferroelectric memory cell to contain more than one bit of data.

  5. Collective dipole behavior and unusual morphotropic phase boundary in ferroelectric Pb(Zr(0.5)Ti(0.5))O3 nanowires.

    PubMed

    Fu, Xiujun; Naumov, Ivan I; Fu, Huaxiang

    2013-02-13

    Dipole collective behavior and phase transition in ferroelectric (FE) Pb(Zr(0.5)Ti(0.5))O(3) nanowires, caused by modulated electric fields, are reported. Our result also leads to the finding of a rather outstanding electromechanical d(31) response in a 8.4 nm diameter PZT wire, which may potentially outperform bulk PMN-PT and PZN-PT. Moreover, we further demonstrate the existence of a new type of morphotropic phase boundary (MPB) that bridges two dissimilar structure phases of different order parameters. Microscopic insights for understanding the collective behavior and the structural phase within the new MPB are provided. PMID:23256599

  6. Coarsening Behavior and Plastic Flow of Ti-6Al-2Sn-4Zr-2Mo-0.1Si with an Ultrafine Microstructure

    NASA Astrophysics Data System (ADS)

    Semiatin, S. L.; Sun, F.; Crist, E. M.; Yu, K. O.; Sargent, G. A.; Sanders, D. G.

    2016-09-01

    Coarsening behavior and superplastic-flow response of Ti-6Al-2Sn-4Zr-2Mo-0.1Si with an ultrafine, equiaxed-alpha microstructure were interpreted in the context of classical models. Static coarsening was shown to follow modified Lifshitz-Slyosov-Wagner (LSW) kinetics. The rate of dynamic coarsening was six times more rapid than the corresponding static rate due to enhanced diffusion of solutes in the beta matrix. Last, a generalized constitutive equation was used to interpret the dependence of flow stress on strain/dynamic coarsening, strain rate, and temperature.

  7. Thickness dependence of magnetoelectric response for composites of Pb(Zr{sub 0.52}Ti{sub 0.48})O{sub 3} films on CoFe{sub 2}O{sub 4} ceramic substrates

    SciTech Connect

    Wang, Jing Zhu, Kongjun; Wu, Xia; Deng, Chaoyong; Peng, Renci; Wang, Jianjun

    2014-08-15

    Using chemical solution spin-coating we grew Pb(Zr{sub 0.52}Ti{sub 0.48})O{sub 3} films of different thicknesses on highly dense CoFe{sub 2}O{sub 4} ceramics. X-ray diffraction revealed no other phases except Pb(Zr{sub 0.52}Ti{sub 0.48})O{sub 3} and CoFe{sub 2}O{sub 4}. In many of these samples we observed typical ferroelectric hysteresis loops, butterfly-shaped piezoelectric strains, and the magnetic-field-dependent magnetostriction. These behaviors caused appreciable magnetoelectric responses based on magnetic-mechanical-electric coupling. Our results indicated that the thickness of the Pb(Zr{sub 0.52}Ti{sub 0.48})O{sub 3} film was important in obtaining strong magnetoelectric coupling.

  8. The structural, electronic, magnetic and mechanical properties of quaternary Heusler alloys ZrTiCrZ (Z  =  Al, Ga, In, Si, Ge, Sn): a first-principles study

    NASA Astrophysics Data System (ADS)

    Yan, Peng-Li; Zhang, Jian-Min; Zhou, Bo; Xu, Ke-Wei

    2016-06-01

    The structural, electronic, magnetic and mechanical properties of the quaternary Heusler alloys ZrTiCrZ (Z  =  Al, Ga, In, Si, Ge, Sn) have been investigated firstly by using the first-principles calculations. The preferred configurations of the ZrTiCrZ alloys are all Y-type (I). At their equilibrium lattice constants, the ZrTiCrZ alloys are half-metallic (HM) ferrimagnets for Z  =  Al, Ga and In, while spin-gapless semiconductor (SGS) antiferromagnets (AFM) for Z  =  Si, Ge and Sn. The total magnetic moments {μt} of the ZrTiCrZ alloys are  -1 {μ\\text{B}}/\\text{f}\\text{.u}\\text{.} for Z  =  Al, Ga and In, while 0 {μ\\text{B}}/\\text{f}\\text{.u}\\text{.} for Z  =  Si, Ge and Sn, both linearly scaled with the total number of valence electrons {{Z}\\text{t}} by Slater-Pauling rule {μ\\text{t}}={{Z}\\text{t}}-18 . The elastic constants {{C}11} , {{C}12} and {{C}44} of the single crystal and the related elastic moduli G , B , E , \\upsilon and A of the polycrystalline aggregates are also calculated and used to study the mechanical stability of these alloys. Although the Curie temperatures {{T}\\text{C}} of the ZrTiCrZ alloys are overestimated by using the mean field approximation (MFA), they can be better estimated by including the exchange interactions. Finally, the HM stabilities as well as the total and atomic magnetic moments of the ZrTiCrZ alloys (Z  =  Al, Ga, In) under either hydrostatic strain or tetragonal strain are also discussed.

  9. The structural, electronic, magnetic and mechanical properties of quaternary Heusler alloys ZrTiCrZ (Z  =  Al, Ga, In, Si, Ge, Sn): a first-principles study

    NASA Astrophysics Data System (ADS)

    Yan, Peng-Li; Zhang, Jian-Min; Zhou, Bo; Xu, Ke-Wei

    2016-06-01

    The structural, electronic, magnetic and mechanical properties of the quaternary Heusler alloys ZrTiCrZ (Z  =  Al, Ga, In, Si, Ge, Sn) have been investigated firstly by using the first-principles calculations. The preferred configurations of the ZrTiCrZ alloys are all Y-type (I). At their equilibrium lattice constants, the ZrTiCrZ alloys are half-metallic (HM) ferrimagnets for Z  =  Al, Ga and In, while spin-gapless semiconductor (SGS) antiferromagnets (AFM) for Z  =  Si, Ge and Sn. The total magnetic moments {μt} of the ZrTiCrZ alloys are  ‑1 {μ\\text{B}}/\\text{f}\\text{.u}\\text{.} for Z  =  Al, Ga and In, while 0 {μ\\text{B}}/\\text{f}\\text{.u}\\text{.} for Z  =  Si, Ge and Sn, both linearly scaled with the total number of valence electrons {{Z}\\text{t}} by Slater–Pauling rule {μ\\text{t}}={{Z}\\text{t}}-18 . The elastic constants {{C}11} , {{C}12} and {{C}44} of the single crystal and the related elastic moduli G , B , E , \\upsilon and A of the polycrystalline aggregates are also calculated and used to study the mechanical stability of these alloys. Although the Curie temperatures {{T}\\text{C}} of the ZrTiCrZ alloys are overestimated by using the mean field approximation (MFA), they can be better estimated by including the exchange interactions. Finally, the HM stabilities as well as the total and atomic magnetic moments of the ZrTiCrZ alloys (Z  =  Al, Ga, In) under either hydrostatic strain or tetragonal strain are also discussed.

  10. Evidence of Eu{sup 2+} 4f electrons in the valence band spectra of EuTiO{sub 3} and EuZrO{sub 3}

    SciTech Connect

    Kolodiazhnyi, T.; Valant, M.; Williams, J. R.; Bugnet, M.; Botton, G. A.; Ohashi, N.; Sakka, Y.

    2012-10-15

    We report on optical band gap and valence electronic structure of two Eu{sup 2+}-based perovskites, EuTiO{sub 3} and EuZrO{sub 3} as revealed by diffuse optical scattering, electron energy loss spectroscopy, and valence-band x-ray photoelectron spectroscopy. The data show good agreement with the first-principles studies in which the top of the valence band structure is formed by the narrow Eu 4f{sup 7} electron band. The O 2p band shows the features similar to those of the Ba(Sr)TiO{sub 3} perovskites except that it is shifted to higher binding energies. Appearance of the Eu{sup 2+} 4f{sup 7} band is a reason for narrowing of the optical band gap in the title compounds as compared to their Sr-based analogues.

  11. Observation of high permittivity in Ho substituted BaZr{sub 0.1}Ti{sub 0.9}O{sub 3} ceramics

    SciTech Connect

    Bhaskar Reddy, S.; Ramachandra Rao, M. S.; Prasad Rao, K.

    2007-07-09

    The authors observed an extremely high permittivity ({approx}35 000 at T{sub C}) in barium zirconate titanate (BaZr{sub 0.1}Ti{sub 0.9}O{sub 3}) ceramics with holmium substitution (1-5 mol %) in Ba site. Careful microstructural investigation and energy dispersive spectroscopy analysis of the 1-2 mol % of Ho substituted ceramics showed the enrichment of a Ho-phase along the grain boundaries with a composition close to the Ho{sub 2}Ti{sub 2}O{sub 7} pyrochlore. The formation of Ho rich phase resulted in the Maxwell-Wagner polarization mechanism, which leads to this unusually high permittivity. Ceramics with 3 mol % or higher Ho content showed lesser permittivity values compared to 1-2 mol %, probably due to the increase in pyrochlore phase. These high dielectric constant ceramics are useful in nanoscale devices.

  12. Synthesis, composition, and ion-exchange behavior of thermally stable Zr(IV) and Ti(IV) arsenophosphates: separation of metal ions

    SciTech Connect

    Varshney, K.G.; Premadas, A.

    1981-01-01

    Two new inorganic ion-exchange materials, Zr(IV) and Ti(IV) arsenophosphates, have been synthesized. They are reproducible in behavior and possess excellent thermal stability. Their tentative structures have been proposed based on pH titrations, thermogravimetry, chemical analysis, ir studies, and other ion-exchange properties. Distribution studies of some metal ions have also been made on the basis of which several useful binary separations have been achieved such as Fe(III) from VO(II), Cu(II), and Zn(II); Pb(II) from Cu(II), Hg(II), and Zn(II); Ti(IV) from UO/sub 2/(II) and Ce(IV); and Mg(II) from Sr(II) and Ba(II).

  13. Optical evidence for the effect of gamma-ray irradiation on ferroelectric Pb(Zr0.52Ti0.48)O3 thin films

    NASA Astrophysics Data System (ADS)

    Lim, Junhwi; Lee, Y. S.; Yang, Sun A.; Bu, Sang Don

    2016-06-01

    We investigated the visible emission property of Pb(Zr,Ti)O3 (PZT) thin films irradiated with gammy-ray (γ-ray) irradiated at various total doses up to 1000 kGy. The PZT thin films were prepared on Pt/Ti/SiO2/Si substrates by using a sol-gel method with a spin-coating process. The visible emission was found to emerge near 550 nm upon γ-ray irradiation, and the intensity of the emission increased with increasing dose. The spectrum of the γ-ray-induced emission was quite narrow, which was quite different from that due to normal defects such as oxygen vacancies. We suggest that the γ-ray irradiation generates inside the PZT films a specific type of defect state that can be detected by using low-temperature photoluminescence spectroscopy.

  14. Origin of 90° domain wall pinning in Pb(Zr0.2Ti0.8)O3 heteroepitaxial thin films

    NASA Astrophysics Data System (ADS)

    Su, Dong; Meng, Qingping; Vaz, C. A. F.; Han, Myung-Geun; Segal, Yaron; Walker, Fred J.; Sawicki, Monica; Broadbridge, Christine; Ahn, Charles H.

    2011-09-01

    We describe a transmission-electron-microscopy study of the ferroelectric domains in an epitaxial Pb(Zr0.2Ti0.8)O3 (PZT) film grown on La0.7Sr0.3MnO3/SrTiO3(001). We directly observe the pinning of 90° domain walls by pairs of misfit dislocations, respectively, with Burgers vectors a [100] and a [001]. Model calculations based on the elastic theory confirm our finding that, in addition to the depolarization field surrounding the dislocation, the strain field of misfit dislocation-pairs plays the primary role in the formation and pinning of a domains.

  15. Enhanced photocatalytic activity of nanocomposites of TiO2 doped with Zr, Y or Ce polyoxometalates for degradation of methyl orange dye.

    PubMed

    Khoshnavazi, Roushan; Fereydouni, Shler; Bahrami, Leila

    2016-01-01

    The synergistic effect of polyoxometalate (POM) and metal-doped TiO2 (metal = Zr, Y and Ce) was examined, to fabricate nanocomposites with enhanced photocatalytic activities toward the degradation of methyl orange (MO), as a model textile dye. A series of new nanocomposites, containing different loading amounts of H9Na3[WZn3(H2O)2(ZnW9O34)2].24H2O (HZnW) (10-30%) on each of the metal-doped TiO2 nanoparticles, were synthesized using impregnation method. The morphology and crystal phase of the as-prepared nanocomposites were investigated by various characterization techniques: Fourier transform infrared spectroscopy, scanning electron microscopy, transmission electron microscopy, X-ray diffraction, energy-dispersive X-ray analysis and diffuse reflectance spectroscopy, indicating that the HZnW and metal-doped TiO2 had been successfully incorporated into the nanocomposite structure. The effects of parameters such as loading amount of HZnW, catalyst dose, pH and initial concentration of dye solution were investigated on the degradation kinetics and it was interestingly found that the prepared nanocomposites could efficiently degrade the MO dye in 5-7 min under UV light irradiation. The best results were obtained for the HZnW-Zr-TiO2 among the different nanocomposites. Also, control studies showed the superior photocatalytic properties of composites compared to that of the individual components. The facile preparation and their improved photocatalytic activities suggest that these materials can have a promising future for water and wastewater purifications.

  16. Enhanced photocatalytic activity of nanocomposites of TiO2 doped with Zr, Y or Ce polyoxometalates for degradation of methyl orange dye.

    PubMed

    Khoshnavazi, Roushan; Fereydouni, Shler; Bahrami, Leila

    2016-01-01

    The synergistic effect of polyoxometalate (POM) and metal-doped TiO2 (metal = Zr, Y and Ce) was examined, to fabricate nanocomposites with enhanced photocatalytic activities toward the degradation of methyl orange (MO), as a model textile dye. A series of new nanocomposites, containing different loading amounts of H9Na3[WZn3(H2O)2(ZnW9O34)2].24H2O (HZnW) (10-30%) on each of the metal-doped TiO2 nanoparticles, were synthesized using impregnation method. The morphology and crystal phase of the as-prepared nanocomposites were investigated by various characterization techniques: Fourier transform infrared spectroscopy, scanning electron microscopy, transmission electron microscopy, X-ray diffraction, energy-dispersive X-ray analysis and diffuse reflectance spectroscopy, indicating that the HZnW and metal-doped TiO2 had been successfully incorporated into the nanocomposite structure. The effects of parameters such as loading amount of HZnW, catalyst dose, pH and initial concentration of dye solution were investigated on the degradation kinetics and it was interestingly found that the prepared nanocomposites could efficiently degrade the MO dye in 5-7 min under UV light irradiation. The best results were obtained for the HZnW-Zr-TiO2 among the different nanocomposites. Also, control studies showed the superior photocatalytic properties of composites compared to that of the individual components. The facile preparation and their improved photocatalytic activities suggest that these materials can have a promising future for water and wastewater purifications. PMID:27054748

  17. Crystal Structure, Electronic Structure, and Photocatalytic Activity of Oxysulfides: La2Ta2ZrS2O8, La2Ta2TiS2O8, and La2Nb2TiS2O8.

    PubMed

    Goto, Yosuke; Seo, Jeongsuk; Kumamoto, Kazunori; Hisatomi, Takashi; Mizuguchi, Yoshikazu; Kamihara, Yoichi; Katayama, Masao; Minegishi, Tsutomu; Domen, Kazunari

    2016-04-01

    The novel oxysulfides La2Ta2ZrS2O8 (LTZSO), La2Ta2TiS2O8 (LTTSO), and La2Nb2TiS2O8 (LNTSO) were synthesized, and their crystal structures, electronic structures, and photocatalytic activities for water splitting under visible light were investigated. Density functional theory calculations showed that these compounds are direct-band-gap semiconductors. Close to the conduction band minimum, the main contribution to the band structure comes from the d orbitals of Zr or Ti ions, while the region near the valence band maximum is associated with the 3p orbitals of S ions. The absorption-edge wavelength was determined to be 540 nm for LTZSO and 700 nm for LTTSO and LNTSO. An analysis of the crystal structure using synchrotron X-ray diffraction revealed that these compounds contained antisite defects at transition metal ion sites, and these were considered to be the origin of the broad absorption at wavelengths longer than that corresponding to band-gap excitation. LTZSO was revealed to be active in the oxygen evolution reaction from aqueous solution containing a sacrificial electron acceptor under visible-light illumination. This result was supported by the band alignment and flat-band potential determined by photoelectron spectroscopy and Mott-Schottky plots.

  18. Enhanced photocathodic behaviors of Pb(Zr{sub 0.20}Ti{sub 0.80})O{sub 3} films on Si substrates for hydrogen production

    SciTech Connect

    Cheng, Xiaorong; Dong, Wen; Zheng, Fengang; Fang, Liang; Shen, Mingrong

    2015-06-15

    Wide bandgap ferroelectric Pb(Zr{sub 0.20}Ti{sub 0.80})O{sub 3} films were deposited on indium tin oxide (ITO) coated Si-pn{sup +} substrates with an intention to form efficient Si-pn{sup +}/ITO/Pb(Zr,Ti)O{sub 3} (PZT) photocathode for hydrogen production. Depolarization electric field generated in PZT film due to poling can drive the photogenerated electrons from Si-pn{sup +} junction to PZT film, resulting in enhanced photoelectrochemical activity of the photocathode. Comparing the electrode with as-prepared PZT film, the photocurrent increased from −100 μA cm{sup −2} to −1.2 mA cm{sup −2} at 0 V vs. reversible hydrogen electrode (RHE) and the onset potential from 0.36 V to 0.7 V vs. RHE under 100 mW cm{sup −2} illumination, manifesting the great advantage of depolarization electric field in driving the photogenerated carriers not only in the ferroelectric film but also on the interface of different semiconductors.

  19. The effect of deposition atmosphere on the chemical composition of TiN and ZrN thin films grown by pulsed laser deposition

    NASA Astrophysics Data System (ADS)

    Craciun, D.; Socol, G.; Stefan, N.; Dorcioman, G.; Hanna, M.; Taylor, C. R.; Lambers, E.; Craciun, V.

    2014-05-01

    Very thin TiN and ZrN films (<500 nm) were grown on (1 0 0) Si substrates at temperatures up to 500 °C by the pulsed laser deposition (PLD) technique using a KrF excimer laser under residual vacuum or various mixtures of CH4 or N2. Auger electron spectroscopy investigations found that films contained a relatively low oxygen concentration, usually below 3.0 at%. Films deposited under residual vacuum or very low N2 pressures (<3 × 10-3 Pa) contained 3-6 at% C atoms in the bulk. This fraction grew to 8-10 at% when the deposition was performed under an atmosphere of 2 × 10-3 Pa CH4. To avoid C atoms incorporation into the bulk a deposition pressure of 10 Pa N2 was required. X-ray photoelectron spectroscopy investigations found that oxygen was mostly bonded in an oxynitride type of compound, while carbon was bonded into a metallic carbide. The presence of C atoms in the chemical composition of the TiN or ZrN improved the measured hardness of the films.

  20. Direct measurements of irradiation-induced creep in micropillars of amorphous Cu56Ti38Ag6, Zr52Ni48, Si, and SiO2

    NASA Astrophysics Data System (ADS)

    Özerinç, Sezer; Kim, Hoe Joon; Averback, Robert S.; King, William P.

    2015-01-01

    We report in situ measurements of irradiation-induced creep on amorphous (a-) Cu56Ti38Ag6, Zr52Ni48, Si, and SiO2. Micropillars 1 μm in diameter and 2 μm in height were irradiated with ˜2 MeV heavy ions during uniaxial compression at room temperature. The creep measurements were performed using a custom mechanical testing apparatus utilizing a nanopositioner, a silicon beam transducer, and an interferometric laser displacement sensor. We observed Newtonian flow in all tested materials. For a-Cu56Ti38Ag6, a-Zr52Ni48, a-Si, and Kr+ irradiated a-SiO2 irradiation-induced fluidities were found to be nearly the same, ≈3 GPa-1 dpa-1, whereas for Ne+ irradiated a-SiO2 the fluidity was much higher, 83 GPa-1 dpa-1. A fluidity of 3 GPa-1 dpa-1 can be explained by point-defect mediated plastic flow induced by nuclear collisions. The fluidity of a-SiO2 can also be explained by this model when nuclear stopping dominates the energy loss, but when the electronic stopping exceeds 1 keV/nm, stress relaxation in thermal spikes also contributes to the fluidity.

  1. Simplified ZrTiO x -based RRAM cell structure with rectifying characteristics by integrating Ni/n + -Si diode

    PubMed Central

    2014-01-01

    A simplified one-diode one-resistor (1D1R) resistive switching memory cell that uses only four layers of TaN/ZrTiO x /Ni/n+-Si was proposed to suppress sneak current where TaN/ZrTiO x /Ni can be regarded as a resistive-switching random access memory (RRAM) device while Ni/n+-Si acts as an Schottky diode. This is the first RRAM cell structure that employs metal/semiconductor Schottky diode for current rectifying. The 1D1R cell exhibits bipolar switching behavior with SET/RESET voltage close to 1 V without requiring a forming process. More importantly, the cell shows tight resistance distribution for different states, significantly rectifying characteristics with forward/reverse current ratio higher than 103 and a resistance ratio larger than 103 between two states. Furthermore, the cell also displays desirable reliability performance in terms of long data retention time of up to 104 s and robust endurance of 105 cycles. Based on the promising characteristics, the four-layer 1D1R structure holds the great potential for next-generation nonvolatile memory technology. PMID:24936165

  2. Polarization induced self-doping in epitaxial Pb(Zr0.20Ti0.80)O3 thin films

    PubMed Central

    Pintilie, Lucian; Ghica, Corneliu; Teodorescu, Cristian Mihail; Pintilie, Ioana; Chirila, Cristina; Pasuk, Iuliana; Trupina, Lucian; Hrib, Luminita; Boni, Andra Georgia; Georgiana Apostol, Nicoleta; Abramiuc, Laura Elena; Negrea, Raluca; Stefan, Mariana; Ghica, Daniela

    2015-01-01

    The compensation of the depolarization field in ferroelectric layers requires the presence of a suitable amount of charges able to follow any variation of the ferroelectric polarization. These can be free carriers or charged defects located in the ferroelectric material or free carriers coming from the electrodes. Here we show that a self-doping phenomenon occurs in epitaxial, tetragonal ferroelectric films of Pb(Zr0.2Ti0.8)O3, consisting in generation of point defects (vacancies) acting as donors/acceptors. These are introducing free carriers that partly compensate the depolarization field occurring in the film. It is found that the concentration of the free carriers introduced by self-doping increases with decreasing the thickness of the ferroelectric layer, reaching values of the order of 1026 m−3 for 10 nm thick films. One the other hand, microscopic investigations show that, for thicknesses higher than 50 nm, the 2O/(Ti+Zr+Pb) atomic ratio increases with the thickness of the layers. These results suggest that the ratio between the oxygen and cation vacancies varies with the thickness of the layer in such a way that the net free carrier density is sufficient to efficiently compensate the depolarization field and to preserve the outward direction of the polarization. PMID:26446442

  3. The structural and in-plane dielectric/ferroelectric properties of the epitaxial (Ba, Sr)(Zr, Ti)O{sub 3} thin films

    SciTech Connect

    Chan, N. Y. Wang, Y.; Chan, H. L. W.; Wang, D. Y.; Dai, J. Y.

    2014-06-21

    Epitaxial (Ba{sub 1-x}Sr{sub x})(Zr{sub 0.1}Ti{sub 0.9})O{sub 3} (BSZT, x = 0 – 0.45) thin films were deposited on (LaAlO{sub 3}){sub 0.3}(Sr{sub 2}AlTaO{sub 6}){sub 0.35} (LSAT) substrates by pulsed laser deposition. The experimental results demonstrate that the structural, dielectric, and ferroelectric properties of the BSZT thin films were greatly dependent on the strontium content. The BSZT thin films transformed from tetragonal to cubic phase when x ≥ 0.35 at room temperature. The Curie temperature and room-temperature remnant polarization decrease with increasing strontium concentration. The optimal dielectric properties were found in (Ba{sub 0.55}Sr{sub 0.45})(Zr{sub 0.1}Ti{sub 0.9})O{sub 3} thin films which is in paraelectric state, having tunability of 47% and loss tangent of 0.0338 under an electric field of 20 MV/m at 1 MHz. This suggests that BSZT thin film is a promising candidate for tunable microwave device applications.

  4. Enhanced high-temperature piezoelectric properties of traditional Pb(Zr,Ti)O3 ceramics by a small amount substitution of KNbO3

    NASA Astrophysics Data System (ADS)

    Pan, Zhao; Chen, Jun; Fan, Longlong; Rong, Yangchun; Zheng, Shaoying; Liu, Laijun; Fang, Liang; Xing, Xianran

    2014-12-01

    Crystal structure, piezoelectric, and dielectric properties were investigated on the (1-x)Pb(Zr0.54Ti0.46)O3-xKNbO3 system. The piezoelectric properties have been significantly improved by substituting a small amount of KNbO3. In the morphotropic phase boundary (x = 0.015), the compound not only shows enhanced piezoelectric coefficient d33 = 450 pC/N, which is two times larger than that of unmodified Pb(Zr,Ti)O3 (d33 = 223 pC/N), but also the Curie temperature (TC = ˜380 °C) is still well maintained at a high level. This phenomenon challenges our general knowledge that in piezoelectric materials the Curie temperature and piezoelectric properties are mutually contradictory. It should be noted that a giant total strain as high as 0.73% is also observed. The high thermal depoling temperature more than 300 °C combined with the excellent piezoelectric properties suggest it as a potential candidate for high temperature actuators and sensors applications.

  5. Disordered structures of the TM-Mg-Zn 1/1 quasicrystal approximants (TM = Hf, Zr, or Ti) and chemical intergrowth.

    PubMed

    Gómez, Cesar Pay; Ohhashi, Satoshi; Yamamoto, Akiji; Tsai, An Pang

    2008-09-15

    The structures of three quasicrystal approximant phases in the TM-Mg-Zn (TM = Hf, Zr, Ti) systems with the analyzed compositions Hf5Mg18Zn77, Zr5Mg18Zn77, and Ti5.5Mg17.5Zn77 have been synthesized, and their structures have been analyzed by single-crystal X-ray diffraction. The structure analyses revealed that these cubic phases with the space group Pm3 contain two different rhombic-triacontahedral clusters. These clusters are so-called Bergman-type atomic clusters and previously known approximants of face-centered icosahedral (F-type) quasicrystals are composed only of Mackay-type clusters, thus these compounds are seen as new prototype structures. Electron density maps calculated by the maximum entropy method (MEM) show that one of the atomic clusters displays characteristic structural disorder. The disorder in these phases is related to the chemical intergrowth of different Friauf polyhedra, and the prospects of new guide lines for finding quasicrystals composed of such polyhedra are discussed.

  6. Impact of an ultra-thin ZrTiO4 buffer layer for long retention characteristics of metal–ferroelectric–insulator–semiconductor capacitor

    NASA Astrophysics Data System (ADS)

    Hyo Park, Jae; Joo, Seung Ki

    2016-05-01

    In most ferroelectric field-effect transistors (FeFETs), a thin interfacial layer is inserted between the ferroelectric and semiconductor in order to avoid the interdiffusion of metallic impurities. In this work, we have used ZrTiO4 (ZTO) as an interfacial layer to improve the interface of Pb(Zr,Ti)O3 (PZT)/Si and prevent the diffusion of metallic impurities of PZT. It was found that optimizing the thickness of ZTO strongly influences the FeFET retention characteristics. Gate leakage current and Pb metallic interdiffusion were effectively suppressed when the ZTO thickness was thicker than 5 nm. However, a self-depolarization field was generated by the charge compensation loss in PZT, caused by the thick ZTO. On the other hand, our sample showed a large gate leakage current and Pb metallic interdiffusion when ZTO was thinner than 2 nm. It was found that 2 nm thick ZTO is the optimum thickness for long retention characteristics in FeFETs.

  7. Novel Neo-Pentoxide Precursors for MOCVD Thin Films of TiO(2) and ZrO(2).[1

    SciTech Connect

    Boyle, Timothy J.; Francisco, Laila P.; Gallegos, Jesus J.; Rodriguez, Mark A.; Ward, Timothy L.

    1999-07-14

    Two novel Group IV precursors, titanium (IV) neo-pentoxide, [Ti({mu}-ONep)(ONep){sub 3}]{sub 2} (l), and zirconium (IV) neo-pentoxide, [Zr({mu}-ONep)(ONep){sub 3}]{sub 2} (2), were reported to possess relatively high volatility at low temperatures. These compounds were therefore investigated as MOCVD precursors using a lamp-heated cold-wall CVD reactor and direct sublimation without carrier gas. The ONep derivatives proved to be competitive precursors for the production of thin films of the appropriate MO{sub 2} (M = Ti or Zr) materials in comparison to other metallo-organic precursors. Compound 1 was found to sublime at 120 C with a deposition rate of {approximately}0.350 {mu}m/min onto a substrate at 330 C forming the anatase phase with < 1% residual C found in the final film. Compound 2 was found to sublime at 160 C and deposited as crystalline material at 300 C with < 1% residual C found in the final film. A comparison to standard alkoxide and {beta}-diketonates is presented where appropriate.

  8. Synthesis and Characterization of Ba(Zr{sub x}Ti{sub 1-x})O{sub 3} Solid Solutions Using Impedance Spectroscopic Techniques

    SciTech Connect

    Bajpai, P. K.; Mohan, C. R. K.

    2011-11-22

    Technologically important solid solutions of Ba(Zr{sub x}Ti{sub 1-x})O{sub 3} are synthesized using conventional solid state route. Relatively dense and single phase ceramics are confirmed using X-ray diffraction. Homogeneous and micron size grain growth is characterized using SEM. Impedance spectroscopy is used to study the electrical properties of ceramics. Broad and diffuse impedance loss peak is observed above 250 deg. C, which shifts towards higher frequency with increase in temperature. The distribution of relaxation frequency may be associated with the B-site cationic disorder due to the random distribution of (Zr{sup 4+}/Ti{sup +4}) having different ionic radii. Impedance relaxation obeys the Arrhenius relation with activation energy, E{tau} is 0.31 eV and 0.48 eV for BZT compositions with x = 0.10 and 0.15 respectively. Equivalent circuit representation using two RC element coupled in parallel is used to analyse the impedance response.

  9. The formation mechanisms of surface nanocrystallites in β-type biomedical TiNbZrFe alloy by surface mechanical attrition treatment

    NASA Astrophysics Data System (ADS)

    Jin, Lei; Cui, Wenfang; Song, Xiu; Zhou, Lian

    2015-08-01

    A nanostructured surface layer was successfully performed on a biomedical β-type TiNbZrFe alloy by surface mechanical attrition treatment (SMAT). The results reveal that the surface layer along the depth from treated surface to strain-free matrix could be divided into an outer nanocrystalline layer (0-30 μm), a high-density dislocation region (30-200 μm) and an inner region with low-density dislocations and twins (200-700 μm) when the surface was treated for 60 min. The microhardness of the surface layer is enhanced and increases with increasing treatment time. Although the {1 1 2} <1 1 1> twin coordinates the deformations with dislocations, this coordination only occurs in the low strain area and cannot affect the nanocrystalline formation. The self-nanocrystallization of TiNbZrFe alloy is mainly attributed to dislocation movements. First, the dislocations start to move and easily form dislocation bands along certain crystal directions; then, multiple slips of dislocations gradually form dislocation tangles; after that, high-density dislocation tangles increases, which divides primary grains into many small domain areas. As high strain energies accumulate on the interfaces among these areas, the lattice rotation can be driven between the adjacent small domain areas, finally resulting in a large number of nanocrystalline regions with low or large angle grain boundaries.

  10. Effect of Thermal Treatments on Ni-Mn-Ga and Ni-Rich Ni-Ti-Hf/Zr High-Temperature Shape Memory Alloys

    NASA Astrophysics Data System (ADS)

    Santamarta, Ruben; Evirgen, Alper; Perez-Sierra, Aquilina M.; Pons, Jaume; Cesari, Eduard; Karaman, Ibrahim; Noebe, Ron D.

    2015-11-01

    Among all the promising high-temperature shape memory alloys (HTSMAs), the Ni-Mn-Ga and the Ni-Ti-Hf/Zr systems exhibit interesting shape memory and superelastic properties that may place them in a good position for potential applications. The present work shows that thermal treatments play a crucial role in controlling the martensitic phase transformation characteristics of both systems, but in different ways. On one hand, the equilibrium phase diagram of the Ni-Mn-Ga family allows selecting compositions with high transformation temperatures and outstanding thermal stability at relatively high temperatures in air, showing no significant changes in the transformation behavior for continuous aging up to ˜5 years at 500 °C. Moreover, the excellent thermal stability correlates with a good thermal cyclic stability and an exceptional oxidation resistance of the parent phase. On the other hand, precipitation processes controlled by thermal treatments are needed to manipulate the transformation temperatures, mechanical properties, and thermal stability of Ni-rich Ni-Ti-Hf/Zr alloys to become HTSMAs. These changes in the functional properties are a consequence of the competition between the mechanical and compositional effects of the precipitates on the martensitic transformation.

  11. Direct observation of intrinsic piezoelectricity of Pb(Zr,Ti)O{sub 3} by time-resolved x-ray diffraction measurement using single-crystalline films

    SciTech Connect

    Fujisawa, Takashi; Ehara, Yoshitaka; Yasui, Shintaro; Kamo, Takafumi; Funakubo, Hiroshi; Yamada, Tomoaki; Sakata, Osami

    2014-07-07

    Lead zirconate titanate, Pb(Zr,Ti)O{sub 3} or PZT, is one of the most widely investigated ferroelectric and piezoelectric materials due to its superior properties. However, the intrinsic properties of PZT have not been directly measured due to the lack of fabrication of single crystals even though a basic understanding of intrinsic properties has been of interest developing lead-free piezoelectric materials. We demonstrated the direct observation of the intrinsic piezoelectric property by means of the detection of electric-field induced crystal lattice distortion of thick Pb(Zr{sub 0.35}Ti{sub 0.65})O{sub 3} single-crystalline films with single polar-axis orientation and negligible residual strain using the time-resolved X-ray diffraction (XRD) together with the polarization response. Consequently, the effective converse piezoelectric response was experimentally revealed; hence, the electrostrictive coefficient, which is the conversion coefficient between the electrical and mechanical response, was determined. The obtained effective electrostrictive coefficient was 5.2–6.3 × 10{sup −2} m{sup 4}/C{sup 2}, which agrees with theoretical prediction.

  12. 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. PMID:26275484

  13. Direct observation of intrinsic piezoelectricity of Pb(Zr,Ti)O3 by time-resolved x-ray diffraction measurement using single-crystalline films

    NASA Astrophysics Data System (ADS)

    Fujisawa, Takashi; Ehara, Yoshitaka; Yasui, Shintaro; Kamo, Takafumi; Yamada, Tomoaki; Sakata, Osami; Funakubo, Hiroshi

    2014-07-01

    Lead zirconate titanate, Pb(Zr,Ti)O3 or PZT, is one of the most widely investigated ferroelectric and piezoelectric materials due to its superior properties. However, the intrinsic properties of PZT have not been directly measured due to the lack of fabrication of single crystals even though a basic understanding of intrinsic properties has been of interest developing lead-free piezoelectric materials. We demonstrated the direct observation of the intrinsic piezoelectric property by means of the detection of electric-field induced crystal lattice distortion of thick Pb(Zr0.35Ti0.65)O3 single-crystalline films with single polar-axis orientation and negligible residual strain using the time-resolved X-ray diffraction (XRD) together with the polarization response. Consequently, the effective converse piezoelectric response was experimentally revealed; hence, the electrostrictive coefficient, which is the conversion coefficient between the electrical and mechanical response, was determined. The obtained effective electrostrictive coefficient was 5.2-6.3 × 10-2 m4/C2, which agrees with theoretical prediction.

  14. Structural, Dielectric, and Electrical Properties of Bi1- x Pb x Fe1- x (Zr0.5Ti0.5) x O3

    NASA Astrophysics Data System (ADS)

    Panda, Niranjan; Pattanayak, Samita; Choudhary, R. N. P.

    2015-12-01

    Polycrystalline samples of Bi1- x Pb x Fe1- x (Zr0.5Ti0.5) x O3 (BPFZTO) with x = 0.0, 0.2, 0.3, and 0.4 were prepared by high-temperature solid-state reaction. Preliminary structural analysis of calcined powders of the materials by use of x-ray powder diffraction confirmed formation of single-phase systems with the tetragonal structure. Room-temperature scanning electron micrographs of the samples revealed uniform distribution of grains of low porosity and different dimensions on the surface of the samples. The frequency-temperature dependence of dielectric and electric properties was studied by use of dielectric and complex impedance spectroscopy over a wide range of frequency (1 kHz to 1 MHz) at different temperatures (25-500°C). The dielectric constant of BiFeO3 (BFO) was enhanced by substitution with Pb(Zr0.5Ti0.5)O3 (PZT) whereas the dielectric loss of the BPFZTO compounds decreased with increasing PZT content. A significant contribution of both grains and grain boundaries to the electrical response of the materials was observed. The frequency-dependence of the ac conductivity of BPFZTO followed Jonscher's power law. Negative temperature coefficient of resistance behavior was observed for all the BPFZTO samples. Conductivity by thermally excited charge carriers and oxygen vacancies in the materials was believed to be of the Arrhenius-type.

  15. Highly c-axis-oriented monocrystalline Pb(Zr, Ti)O₃ thin films on si wafer prepared by fast cooling immediately after sputter deposition.

    PubMed

    Yoshida, Shinya; Hanzawa, Hiroaki; Wasa, Kiyotaka; Esashi, Masayoshi; Tanaka, Shuji

    2014-09-01

    We successfully developed sputter deposition technology to obtain a highly c-axis-oriented monocrystalline Pb(Zr, Ti)O3 (PZT) thin film on a Si wafer by fast cooling (~-180°C/min) of the substrate after deposition. The c-axis orientation ratio of a fast-cooled film was about 90%, whereas that of a slow-cooled (~-40°C/min) film was only 10%. The c-axis-oriented monocrystalline Pb(Zr0.5, Ti0.5)O3 films showed reasonably large piezoelectric coefficients, e(31,f) = ~-11 C/m(2), with remarkably small dielectric constants, ϵ(r) = ~220. As a result, an excellent figure of merit (FOM) was obtained for piezoelectric microelectromechanical systems (MEMS) such as a piezoelectric gyroscope. This c-axis orientation technology on Si will extend industrial applications of PZT-based thin films and contribute further to the development of piezoelectric MEMS. PMID:25167155

  16. Bending springback behavior related to deformation-induced phase transformations in Ti-12Cr and Ti-29Nb-13Ta-4.6Zr alloys for spinal fixation applications.

    PubMed

    Liu, Huihong; Niinomi, Mitsuo; Nakai, Masaaki; Hieda, Junko; Cho, Ken

    2014-06-01

    The springback behavior of Ti-12Cr and Ti-29Nb-13Ta-4.6Zr (TNTZ) during deformation by bending was investigated; and the microstructures of the non-deformed and deformed parts of both alloys were systematically examined to clarify the relationship between microstructure and springback behavior. For the deformed Ti-12Cr alloy, deformation-induced ω-phase transformation occurs in both the areas of compression and tension within the deformed part, which increases the Young׳s modulus. With the deformed TNTZ alloy, deformation-induced ω-phase transformation is observed in the area of compression within the deformed part; while a deformation-induced α″ martensite transformation occurs in the area under tension, which is likely to be associated with the pseudoelasticity of TNTZ. Among these two alloys, Ti-12Cr exhibits a smaller springback and a much greater bending strength when compared with TNTZ; making Ti-12Cr the more advantageous for spinal fixation applications. PMID:24561725

  17. Bending springback behavior related to deformation-induced phase transformations in Ti-12Cr and Ti-29Nb-13Ta-4.6Zr alloys for spinal fixation applications.

    PubMed

    Liu, Huihong; Niinomi, Mitsuo; Nakai, Masaaki; Hieda, Junko; Cho, Ken

    2014-06-01

    The springback behavior of Ti-12Cr and Ti-29Nb-13Ta-4.6Zr (TNTZ) during deformation by bending was investigated; and the microstructures of the non-deformed and deformed parts of both alloys were systematically examined to clarify the relationship between microstructure and springback behavior. For the deformed Ti-12Cr alloy, deformation-induced ω-phase transformation occurs in both the areas of compression and tension within the deformed part, which increases the Young׳s modulus. With the deformed TNTZ alloy, deformation-induced ω-phase transformation is observed in the area of compression within the deformed part; while a deformation-induced α″ martensite transformation occurs in the area under tension, which is likely to be associated with the pseudoelasticity of TNTZ. Among these two alloys, Ti-12Cr exhibits a smaller springback and a much greater bending strength when compared with TNTZ; making Ti-12Cr the more advantageous for spinal fixation applications.

  18. Effect of Zr4+ Content on the Grain Growth, Dielectric Relaxation Behavior, and Ferroelectric Properties of Ba0.4Sr0.6Ti1- x Zr x O3 Nano-Ceramics Prepared by Different Methods Assisted by Fast Microwave Sintering

    NASA Astrophysics Data System (ADS)

    Zixiong, Sun; Yongping, Pu; Yuwen, Liu

    2014-05-01

    The effect of Zr4+ content on the grain growth, dielectric relaxation, and piezoelectric properties of Ba0.4Sr0.6Ti1- x Zr x O3 (BSTZ; x = 0, 0.02, 0.04, 0.06) ceramics prepared by solid-state (SS) and sol-gel modified hydrothermal (SH) methods assisted by fast microwave sintering was investigated in this study. A combination of x-ray diffraction (XRD), scanning electron microscopy (SEM), impedance analysis, and ferroelectric analysis was used. All the ceramics had pure perovskite structures at room temperature, as seen from XRD patterns, indicating that Zr4+ was incorporated into Ba0.4Sr0.6TiO3 lattices to form a solid solution. In the SEM micrographs, SH samples had higher densities and smaller and more homogeneous grain size than SS samples, which was in agreement with density measurements. Nano-ceramics were obtained by this method. When the temperature dependence of dielectric constant and dielectric loss was studied, SH samples had higher permittivity, better thermally activated relaxation, and lower dielectric loss at high temperature. Ferroelectric characteristics can still be detected in Ba0.4Sr0.6Ti1- x Zr x O3 ceramics and residual polarization ( P r) decreased with increasing Zr4+ content.

  19. Diffusion-barrier contacts based on the TiN and Ti(Zr)B{sub x} interstitial phases in the microwave diodes for the range of 75-350 GHz

    SciTech Connect

    Boltovets, N. S. Ivanov, V. N.; Belyaev, A. E.; Konakova, R. V. Kudrik, Ya. Ya.; Milenin, V. V.; Arsent'ev, I. N.; Bobyl, A. V. Brunkov, P. N.; Tarasov, I. S.; Tonkikh, A. A.; Ulin, V. P.; Ustinov, V. V.; Cirlin, G. E.

    2006-06-15

    A new technology for thermally stable ohmic contacts with diffusion barriers based on the amorphous TiN and Ti(Zr)B{sub x} interstitial phases is used in the development of microwave diodes for the millimeter region (with the frequency higher than 100 GHz) based on GaAs, InP, and Si. It became possible to increase the reliability of the GaAs-and InP-based Gunn diodes that operate at the frequency of 200 GHz by using the epitaxial layers formed on porous III-V substrates by gas-phase, molecular-beam, and liquid-phase epitaxy as the initial device structures. The range of emission from the avalanche transit-time diodes based on Si is extended to 350 GHz. To this end, the technology of forming the active element on the silicon metallized diaphragm is used for the first time.

  20. Major contributor to the large piezoelectric response in (1 - x)Ba(Zr0.2Ti0.8)O3 - x(Ba0.7Ca0.3)TiO3 ceramics: Domain wall motion

    NASA Astrophysics Data System (ADS)

    Gao, Jinghui; Hu, Xinghao; Zhang, Le; Li, Fei; Zhang, Lixue; Wang, Yu; Hao, Yanshuang; Zhong, Lisheng; Ren, Xiaobing

    2014-06-01

    The piezoelectric activity of lead-free Ba(Zr0.2Ti0.8)O3-x(Ba0.7Ca0.3)TiO3 (BZT-xBCT) ceramics has been investigated as a function of composition by using Rayleigh analysis under subswitching-electric-field in combination with large-electric-field strain measurement. The result shows that the intrinsic piezoelectric response exhibits peak values in the vicinity of composition-induced R (rhombohedral)-MPB (morphotropic phase boundary) and MPB-T (tetragonal) phase transitions, but being much less than total d33 value. On the other hand, the extrinsic piezoelectric response, especially the one associated with reversible domain wall motion, has been greatly enhanced in the phase instability regime. Our results indicate that the extrinsic piezoelectric activity is the major contributor to the high piezoelectricity in BZT-xBCT ceramics.

  1. Phase transitions and phase diagram of Ba(Zr0.2Ti0.8)O3-x(Ba0.7Ca0.3)TiO3 Pb-free system by anelastic measurement

    NASA Astrophysics Data System (ADS)

    Xue, Dezhen; Gao, Jinghui; Zhou, Yumei; Ding, Xiangdong; Sun, Jun; Lookman, Turab; Ren, Xiaobing

    2015-03-01

    The internal friction and storage modulus of Ba(Zr0.2Ti0.8)O3-x(Ba0.7Ca0.3)TiO3 (BZT-xBCT) Pb-free ceramics have been measured by dynamic mechanical analysis. The anelastic properties show clear anomalies with regard to the transformations between cubic (C), tetragonal (T), orthorhombic (O), and rhombohedral (R) phases, which are all of ferroelastic in nature. The previous reported T-R transition region in the BZT-xBCT system can be divided into the T-O and O-R transitions, consistent with recent studies on the appearance of an intermediate O phase. Based on the internal friction and storage modulus results, a revisited version of BZT-xBCT phase diagram is proposed.

  2. Effect of 90° domain movement on the piezoelectric response of patterned PbZr0.2Ti0.8O3/SrTiO3/Si heterostructures

    NASA Astrophysics Data System (ADS)

    Ma, Zhengkun; Zavaliche, F.; Chen, L.; Ouyang, J.; Melngailis, J.; Roytburd, A. L.; Vaithyanathan, V.; Schlom, D. G.; Zhao, T.; Ramesh, R.

    2005-08-01

    The converse longitudinal piezoelectric responses of PbZr0.2Ti0.8O3/SrTiO3/Si heterostructures have been studied for continuous films and for islands patterned by focused ion beam milling (typical dimension is 1×1×1μm). The intrinsic piezoelectric response of the island with an immobile polydomain structure is modeled using finite element analysis. The difference between the results of experimental measurement and modeling is explained by an extrinsic contribution to the piezoresponse from 90° domain movement. The contribution of 90° domain movement to the total piezoresponse is shown to be greatly enhanced in the patterned islands, and leads to an effective piezoelectric coefficient (˜400pm/V) which is five times larger than the theoretical bulk single domain value.

  3. Ferroelectricity-induced resistive switching in Pb(Zr0.52Ti0.48)O3/Pr0.7Ca0.3MnO3/Nb-doped SrTiO3 epitaxial heterostructure

    NASA Astrophysics Data System (ADS)

    Md. Sadaf, Sharif; Mostafa Bourim, El; Liu, Xinjun; Hasan Choudhury, Sakeb; Kim, Dong-Wook; Hwang, Hyunsang

    2012-03-01

    We investigated the effect of a ferroelectric Pb(Zr0.52Ti0.48)O3 (PZT) thin film on the generation of resistive switching in a stacked Pr0.7Ca0.3MnO3 (PCMO)/Nb-doped SrTiO3 (Nb:STO) heterostructure forming a p-n junction. To promote the ferroelectric effect, the thin PZT active layer was deposited on an epitaxially grown p-type PCMO film on a lattice-matched n-type Nb:STO single crystal. It was concluded that the observed resistive switching behavior in the all-perovskite Pt/PZT/PCMO/Nb:STO heterostructure was related to the modulation of PCMO/Nb:STO p-n junction's depletion width, which was caused either by the PZT ferroelectric polarization field effect, the electrochemical drift of oxygen ions under an electric field, or both simultaneously.

  4. Effect of shock-wave loading on mechanical and thermomechanical characteristics of shape-memory alloys 45Ti-45Ni-10Nb and 43Ti-46Ni-8Nb-3Zr

    NASA Astrophysics Data System (ADS)

    Popov, N. N.; Lar'kin, V. F.; Ogorodnikov, V. A.; Presnyakov, D. V.; Lar'kina, Yu. A.; Aushev, A. A.; Sysoyeva, T. I.; Suvorova, E. B.; Kostyleva, A. A.

    2016-09-01

    This work was performed to study the behavior of 45Ti-45Ni-10Nb and 43Ti-46Ni-8Nb-3Zr (at %) shape-memory alloys (SMAs) under the effect of severe dynamic deformation to use the obtained results to develop technologies based on SMAs. Cast alloys were used for the tests. The elemental and phase compositions of the alloys in the initial state, as well as the phase composition, kinetics, and temperatures of phase transformations after heat treatment (annealing in a vacuum at 850°C for 4 h, furnace cooling) have been determined. The mechanical and thermomechanical characteristics of these alloys before and after shock-wave loading have been determined.

  5. Nanoscale polarisation switching and leakage currents in (Ba0.955Ca0.045)(Zr0.17Ti0.83)O3 epitaxial thin films

    NASA Astrophysics Data System (ADS)

    Sreenivas Puli, Venkata; Pradhan, Dhiren K.; Adireddy, Shiva; Martínez, R.; Silwal, Punam; Scott, J. F.; Ramana, C. V.; Chrisey, Douglas B.; Katiyar, Ram S.

    2015-09-01

    This paper investigates the crystal structure, ferroelectric, temperature-dependent leakage current conduction mechanism and the piezoresponse force microscopy (PFM) behaviours of (Ba0.955Ca0.045) (Zr0.17Ti0.83)O3-BZT-BCT (x=0.15 ) films at the vicinity of the morphotropic phase boundary (MPB) of the [(1  -  x) BaZr0.20Ti0.80O3-xBa0.70Ca0.30TiO3] (x=0.50 ) composition. Epitaxial BZT-BCT thin films were grown on conductive La0.5Sr0.5CoO3 (LSCO) layers coated onto MgO (1 0 0) single-crystal substrates by pulsed laser deposition (PLD). High resolution x-ray diffraction (HR-XRD) reciprocal space maps (RSMs) confirmed the epitaxy with in-plane tetragonal symmetry (c  <  a), and Raman spectra also revealed a tetragonal perovskite crystalline lattice structure. Polarisation studies demonstrate that BZT-BCT films exhibit a high saturation polarisation of 148 µC cm-2 and a high recoverable (discharged) energy-storage density of 39.11 J cm-3 at 2.08 MV cm-1. Temperature-dependent P-E hysteresis loops resulted in a decrease in polarisation. Temperature-dependent leakage current behaviour was obtained and possible conduction mechanism is discussed. PPFM images revealed switchable ferroelectric piezoelectric contrasts after the application of a  ±9 V dc voltage on the conductive tip of the piezoresponse force microscope.

  6. Flexible, Hybrid Piezoelectric Film (BaTi(1-x)Zr(x)O3)/PVDF Nanogenerator as a Self-Powered Fluid Velocity Sensor.

    PubMed

    Alluri, Nagamalleswara Rao; Saravanakumar, Balasubramaniam; Kim, Sang-Jae

    2015-05-13

    We demonstrate a flexible piezoelectric nanogenerator (PNG) constructed using a hybrid (or composite) film composed of highly crystalline BaTi(1-x)Zr(x)O3 (x = 0, 0.05, 0.1, 0.15, and 0.2) nanocubes (abbreviated as BTZO) synthesized using a molten-salt process embedded into a poly(vinylidene fluoride) (PVDF) matrix solution via ultrasonication. The potential of a BTZO/PVDF hybrid film is realized in fabricating eco-friendly devices, active sensors, and flexible nanogenerators to interpret its functionality. Our strategy is based on the incorporation of various Zr(4+) doping ratios into the Ti(4+) site of BaTiO3 nanocubes to enhance the performance of the PNG. The flexible nanogenerator (BTZO/PVDF) exhibits a high electrical output up to ∼11.9 V and ∼1.35 μA compared to the nanogenerator (BTO/PVDF) output of 7.99 V and 1.01 μA upon the application of cyclic pushing-releasing frequencies with a constant load (11 N). We also demonstrate another exciting application of the PNG as a self-powered sensor to measure different water velocities at an outlet pipe. The average maximum peak power of the PNG varies from 0.2 to 15.8 nW for water velocities ranging from 31.43 to 125.7 m/s during the water ON condition. This study shows the compositional dependence approach, fabrication of nanostructures for energy harvesting, and self-powered devices in the field of monitoring for remote area applications. PMID:25901640

  7. Piezoelectric Properties of Fine-Grained Pb(Mg1/3Nb2/3)O3-Pb(Zr,Ti)O3-Bi(Zn1/2Ti1/2)O3 Quaternary Solid Solution Ceramics

    NASA Astrophysics Data System (ADS)

    Yue, Ruifang; Hou, Xianbo; He, Wenze; Yu, Jian

    2013-06-01

    On the basis of solid state reaction eutectic behavior between Pb(Mg1/3Nb2/3)O3-Pb(Zr,Ti)O3 (PMN-PZT) and metastable perovskite-type Bi(Zn1/2Ti1/2)O3 (BZT), perovskite-structured PMN-PZT-BZT quaternary solid solution piezoceramics with various compositions were experimentally demonstrated with an intrinsic low sintering temperature in the windows of 950-1050 °C. These fine-grained densified PMN-PZT-BZT ceramics were able to be poled sufficiently at room temperature through polarization-electric field hysteresis loop measurement, different from normal poling treatment with DC bias field at high temperature, which will simplify future device processing of monolithic multilayer piezoceramic transducers. A typical piezoelectric property of dielectric constant ɛ33T/ɛ0 = 3471, piezoelectric constant d33 = 480 pC/N, planar coupling coefficient kp = 0.41, thickness coupling coefficient kt = 0.50, mechanical quality factor Qm = 68 and relaxor ferroelectric phase transition temperature Tm = 167 °C at 1 MHz was obtained for the fine-grained densified Pb0.96Sr0.04(Mg1/3Nb2/3)0.37Zr0.24Ti0.39O3+3%Bi(Zn0.5Ti0.5)O3+2%NiO ceramics sintered at 1020 °C, which is much promising to manufacture monolithic multilayer piezoelectric transducers with Ag95/Pd5 as inner electrode material.

  8. Effects of Ti, Zr, and Hf on the Phase Stability of Mo-Mo3Si+Mo5SiB2 Alloys at 1600 C

    SciTech Connect

    Yang, Ying; Bei, Hongbin; Chen, Shuanglin; George, Easo P; Tiley, Jaimie; Chang, Y. Austin

    2010-01-01

    Understanding the stability of the three-phase Mo{_}+Mo{sub 3}Si+Mo{sub 5}SiB{sub 2} region is important for alloy design of Mo-Si-B-based refractory metal intermetallic composites. In this work, thermodynamic modeling is coupled with guided experiments to study phase stability in this three-phase region of the Mo-Si-B-X (X = Ti, Zr, Hf) system. Both the calculated and experimental results show that additions of Zr and Hf limit significantly the stability of the three-phase region because of the formation of the ternary phases MoSiZr and MoSiHf, while Ti addition leads to a much larger region of stability for the three-phase equilibrium.

  9. Grain size effect on impedance and modulus properties of (Na0.5Bi0.5TiO3) (1-x) (BaZrO3) x ceramics

    NASA Astrophysics Data System (ADS)

    Selvamani, Rachna; Singh, Gurvinderjit; Tiwari, V. S.

    2016-05-01

    A complex impedance spectroscopy procedure was utilized to examine the impedance and modulus of (Na0.5Bi0.5TiO3) (1-x) (BaZrO3) x (x = 0.00, 0.03, 0.05 and 0.07) solid solution. The microstructural examinations demonstrate that BaZrO3 acts as a grain development inhibitor. The imaginary part of the impedance plot shows the presence of non-Debye type grain and grain boundary relaxation. The activation energy obtained from impedance and modulus plots was found to increase with an increase in BaZrO3 content. The Cole-Cole investigation reveals a colossal augmentation in the grain boundary resistance with BaZrO3 content. However the grain resistance was observed to be almost the same for all the compositions. These outcomes are clarified on the premise of grain boundary-space charge impact and grain-size.

  10. Prediction of the quantum spin Hall effect in monolayers of transition-metal carbides MC (M = Ti, Zr, Hf)

    NASA Astrophysics Data System (ADS)

    Zhou, Liujiang; Shao, Bin; Shi, Wujun; Sun, Yan; Felser, Claudia; Yan, Binghai; Frauenheim, Thomas

    2016-09-01

    We report the existence of the quantum spin Hall effect (QSHE) in monolayers of transition-metal carbides MC (M = Zr, Hf). Under ambient conditions, the ZrC monolayer exhibits QSHE with an energy gap of 54 meV, in which topological helical edge states exist. Enhanced d xy -d xy interaction induces band inversion, resulting in nontrivial topological features. By applying in-plane strain, the HfC monolayer can be tuned from a trivial insulator to a quantum spin Hall insulator with an energy gap of 170 meV, three times that of the ZrC monolayer. The strong stability of MC monolayers provides a new platform for QSHE and spintronic applications.

  11. Dielectric relaxation analysis of Pb(Zr0.54,Ti0.46)O3 thin films: Electric field dependence

    NASA Astrophysics Data System (ADS)

    Ponchel, F.; Sama, N.; Rémiens, D.; Lasri, T.

    2014-12-01

    350 nm-thick Perovskite PbZr0.54Ti0.46O3 (PZT) thin films were deposited on Al2O3 substrates by sputtering with and without an additional 10-nm-thick TiOx buffer layer. X-ray diffraction patterns showed that in presence of TiOx buffer layer, PZT film was highly oriented along the (111) direction film, whereas the unbuffered, counterpart was polycrystalline. A full wave electromagnetic analysis using a vector finite element method was performed to determine the tunability and the complex permittivity up to 67 GHz. A comparison between the electromagnetic analysis and Cole-Cole relaxation model was proposed. Through an original study of the relaxation time as a function of the electric field, values, such as 2 ps and 0.6 ps, were estimated for EDC = 0 kV/cm and 235 kV/cm, respectively, and in both cases (111)-PZT and polycrystalline-PZT. The distribution of relaxation times is found to be larger for (111)-PZT film, which is probably related to the film microstructure.

  12. Dielectric relaxation analysis of Pb(Zr{sub 0.54},Ti{sub 0.46})O{sub 3} thin films: Electric field dependence

    SciTech Connect

    Ponchel, F. Rémiens, D.; Sama, N.; Lasri, T.

    2014-12-28

    350 nm-thick Perovskite PbZr{sub 0.54}Ti{sub 0.46}O{sub 3} (PZT) thin films were deposited on Al{sub 2}O{sub 3} substrates by sputtering with and without an additional 10-nm-thick TiO{sub x} buffer layer. X-ray diffraction patterns showed that in presence of TiO{sub x} buffer layer, PZT film was highly oriented along the (111) direction film, whereas the unbuffered, counterpart was polycrystalline. A full wave electromagnetic analysis using a vector finite element method was performed to determine the tunability and the complex permittivity up to 67 GHz. A comparison between the electromagnetic analysis and Cole-Cole relaxation model was proposed. Through an original study of the relaxation time as a function of the electric field, values, such as 2 ps and 0.6 ps, were estimated for E{sub DC} = 0 kV/cm and 235 kV/cm, respectively, and in both cases (111)-PZT and polycrystalline-PZT. The distribution of relaxation times is found to be larger for (111)-PZT film, which is probably related to the film microstructure.

  13. Quaternary Ti-20Nb-10Zr-5Ta alloy during immersion in simulated physiological solutions: formation of layers, dissolution and biocompatibility.

    PubMed

    Milošev, Ingrid; Hmeljak, Julija; Žerjav, Gregor; Cör, Andrej; Calderon Moreno, Jose Maria; Popa, Monica

    2014-04-01

    Samples of the quaternary Ti-20Nb-10Zr-5Ta alloy were immersed in Hanks' simulated physiological solution and in minimum essential medium (MEM) for 25 days. Samples of Ti metal served as controls. During immersion, the concentration of ions dissolved in MEM was measured by inductively coupled plasma mass spectrometry, while at the end of the experiment the composition of the surface layers was analyzed by X-ray photoelectron spectroscopy, and their morphology by scanning electron microscopy equipped for chemical analysis. The surface layer formed during immersion was comprised primarily of TiO2 but contained oxides of alloying elements as well. The degree of oxidation differed for different metal cations; while titanium achieved the highest valency, tantalum remained as the metal or is oxidized to its sub-oxides. Calcium phosphate was formed in both solutions, while formation of organic-related species was observed only in MEM. Dissolution of titanium ions was similar for metal and alloy. Among alloying elements, zirconium dissolved in the largest quantity. The long-term effects of alloy implanted in the recipient's body were investigated in MEM, using two types of human cells-an osteoblast-like cell line and immortalized pulmonary fibroblasts. The in vitro biocompatibility of the quaternary alloy was similar to that of titanium, since no detrimental effects on cell survival, induction of apoptosis, delay of growth, or change in alkaline phosphatase activity were observed on incubation in MEM. PMID:24452270

  14. Quaternary Ti-20Nb-10Zr-5Ta alloy during immersion in simulated physiological solutions: formation of layers, dissolution and biocompatibility.

    PubMed

    Milošev, Ingrid; Hmeljak, Julija; Žerjav, Gregor; Cör, Andrej; Calderon Moreno, Jose Maria; Popa, Monica

    2014-04-01

    Samples of the quaternary Ti-20Nb-10Zr-5Ta alloy were immersed in Hanks' simulated physiological solution and in minimum essential medium (MEM) for 25 days. Samples of Ti metal served as controls. During immersion, the concentration of ions dissolved in MEM was measured by inductively coupled plasma mass spectrometry, while at the end of the experiment the composition of the surface layers was analyzed by X-ray photoelectron spectroscopy, and their morphology by scanning electron microscopy equipped for chemical analysis. The surface layer formed during immersion was comprised primarily of TiO2 but contained oxides of alloying elements as well. The degree of oxidation differed for different metal cations; while titanium achieved the highest valency, tantalum remained as the metal or is oxidized to its sub-oxides. Calcium phosphate was formed in both solutions, while formation of organic-related species was observed only in MEM. Dissolution of titanium ions was similar for metal and alloy. Among alloying elements, zirconium dissolved in the largest quantity. The long-term effects of alloy implanted in the recipient's body were investigated in MEM, using two types of human cells-an osteoblast-like cell line and immortalized pulmonary fibroblasts. The in vitro biocompatibility of the quaternary alloy was similar to that of titanium, since no detrimental effects on cell survival, induction of apoptosis, delay of growth, or change in alkaline phosphatase activity were observed on incubation in MEM.

  15. The in vitro and in vivo performance of a strontium-containing coating on the low-modulus Ti35Nb2Ta3Zr alloy formed by micro-arc oxidation.

    PubMed

    Liu, Wei; Cheng, Mengqi; Wahafu, Tuerhongjiang; Zhao, Yaochao; Qin, Hui; Wang, Jiaxing; Zhang, Xianlong; Wang, Liqiang

    2015-07-01

    The β-titanium alloy is thought to be a promising alloy using as orthopedic or dental implants owing to its characteristics, which contains low elastic modulus, high corrosion resistance and well biocompatibility. Our previous study has reported that a new β-titanium alloy Ti35Nb2Ta3Zr showed low modulus close to human bone, equal tissue compatibility to a traditional implant alloy Ti6Al4V. In this study, micro-arc oxidation (MAO) was applied on the Ti35Nb2Ta3Zr alloy to enhance its surface characteristics and biocompatibility and osseointegration ability. Two different coatings were formed, TiO2 doped with calcium-phosphate coating (Ca-P) and calcium-phosphate-strontium coating (Ca-P-Sr). Then we evaluated the effects of the MAO coatings on the Ti35Nb2Ta3Zr alloy through in vitro and in vivo tests. As to the characteristics of the coatings, the morphology, chemical composition, surface roughness and contact angle of MAO coatings were tested by scanning electron microscopy, energy dispersive spectroscopy, atomic force microscopy, and video contact-angle measurement system respectively. Besides, we performed MTT assay, ALP test and cell morphology-adhesion test on materials to evaluate the MAOed coating materials' biocompatibility in vitro. The in vivo experiment was performed through rabbit model. Alloys were implanted into rabbits' femur shafts, then we performed micro-CT, histological and sequential fluorescent labeling analysis to evaluate implants' osseointegration ability in vivo. Finally, the Ca-P specimens and Ca-P-Sr specimens exhibited a significant enhancement in surface roughness, hydrophilicity, cell proliferation, cell adhesion. More new bone was found around the Ca-P-Sr coated alloy than Ca-P coated alloy and Ti35Nb2Ta3Zr alloy. In conclusion, the MAO treatment improved in vitro and in vivo performance of Ti35Nb2Ta3Zr alloy. The Ca-P-Sr coating may be a promising modified surface formed by MAO for the novel β-titanium alloy Ti35Nb2Ta3Zr.

  16. The in vitro and in vivo performance of a strontium-containing coating on the low-modulus Ti35Nb2Ta3Zr alloy formed by micro-arc oxidation.

    PubMed

    Liu, Wei; Cheng, Mengqi; Wahafu, Tuerhongjiang; Zhao, Yaochao; Qin, Hui; Wang, Jiaxing; Zhang, Xianlong; Wang, Liqiang

    2015-07-01

    The β-titanium alloy is thought to be a promising alloy using as orthopedic or dental implants owing to its characteristics, which contains low elastic modulus, high corrosion resistance and well biocompatibility. Our previous study has reported that a new β-titanium alloy Ti35Nb2Ta3Zr showed low modulus close to human bone, equal tissue compatibility to a traditional implant alloy Ti6Al4V. In this study, micro-arc oxidation (MAO) was applied on the Ti35Nb2Ta3Zr alloy to enhance its surface characteristics and biocompatibility and osseointegration ability. Two different coatings were formed, TiO2 doped with calcium-phosphate coating (Ca-P) and calcium-phosphate-strontium coating (Ca-P-Sr). Then we evaluated the effects of the MAO coatings on the Ti35Nb2Ta3Zr alloy through in vitro and in vivo tests. As to the characteristics of the coatings, the morphology, chemical composition, surface roughness and contact angle of MAO coatings were tested by scanning electron microscopy, energy dispersive spectroscopy, atomic force microscopy, and video contact-angle measurement system respectively. Besides, we performed MTT assay, ALP test and cell morphology-adhesion test on materials to evaluate the MAOed coating materials' biocompatibility in vitro. The in vivo experiment was performed through rabbit model. Alloys were implanted into rabbits' femur shafts, then we performed micro-CT, histological and sequential fluorescent labeling analysis to evaluate implants' osseointegration ability in vivo. Finally, the Ca-P specimens and Ca-P-Sr specimens exhibited a significant enhancement in surface roughness, hydrophilicity, cell proliferation, cell adhesion. More new bone was found around the Ca-P-Sr coated alloy than Ca-P coated alloy and Ti35Nb2Ta3Zr alloy. In conclusion, the MAO treatment improved in vitro and in vivo performance of Ti35Nb2Ta3Zr alloy. The Ca-P-Sr coating may be a promising modified surface formed by MAO for the novel β-titanium alloy Ti35Nb2Ta3Zr. PMID

  17. Dielectric and piezoelectric properties of lead-free 0.5Ba(Zr0.2 Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 piezoelectric ceramics with glass additive.

    PubMed

    Im, In-Ho; Chung, Kwang-Hyun

    2014-12-01

    We have investigated the dielectric and piezoelectric properties of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics with BaO-CaO-SiO2 glass additive as a function of sintering temperatures. With adding BaO-CaO-SiO2 glass additive, diffusivity of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics was increased. The dispersion constant γ of BZT-BCT ceramics with BaO-CaO-SiO2 glass was changed from 1.9683 to 1.7673 by decreasing sintering temperature ranging from 1450 degrees C to 1350 degrees C, while 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics at sintered 1450 degrees C showed γ = 1.5055. The piezoelectric properties such as electromechanical coupling factor (k(p)) and piezoelectric constant (d33) of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics with BaO-CaO-SiO2 glass additive sintered at 1400 degrees C showed similar values compared with 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics without BaO-CaO-SiO2 glass additive sintered at 1450 degrees C. The addition of BaO-CaO-SiO2 glass additive can be of help to decrease sintering temperature of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics.

  18. Dielectric and piezoelectric properties of lead-free 0.5Ba(Zr0.2 Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 piezoelectric ceramics with glass additive.

    PubMed

    Im, In-Ho; Chung, Kwang-Hyun

    2014-12-01

    We have investigated the dielectric and piezoelectric properties of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics with BaO-CaO-SiO2 glass additive as a function of sintering temperatures. With adding BaO-CaO-SiO2 glass additive, diffusivity of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics was increased. The dispersion constant γ of BZT-BCT ceramics with BaO-CaO-SiO2 glass was changed from 1.9683 to 1.7673 by decreasing sintering temperature ranging from 1450 degrees C to 1350 degrees C, while 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics at sintered 1450 degrees C showed γ = 1.5055. The piezoelectric properties such as electromechanical coupling factor (k(p)) and piezoelectric constant (d33) of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics with BaO-CaO-SiO2 glass additive sintered at 1400 degrees C showed similar values compared with 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics without BaO-CaO-SiO2 glass additive sintered at 1450 degrees C. The addition of BaO-CaO-SiO2 glass additive can be of help to decrease sintering temperature of lead-free 0.5Ba(Zr0.2Ti0.8)O3-0.5(Ba0.7Ca0.3)TiO3 ceramics. PMID:25970982

  19. First-principles-based effective Hamiltonian simulations of bulks and films made of lead-free Ba(Zr,Ti)O3 relaxor ferroelectrics.

    PubMed

    Prosandeev, Sergey; Wang, Dawei; Akbarzadeh, A R; Bellaiche, L

    2015-06-10

    A review of the recent development and application of a first-principles-derived effective Hamiltonian technique to the study of lead-free Ba(Zr,Ti)O3 (BZT) relaxor ferroelectrics is provided. In addition to the computation and analysis of macroscopic properties (such as different types of dielectric responses and electric polarization) and their connections to previous published works, particular emphasis is given to microscopic insights arising from this atomistic technique. These include (i) the numerically-found determination of the physical origin of the relaxor behavior in BZT; and (ii) the prediction of polar nanoregions and the evolution of their morphology as a response to temperature, electric fields and epitaxial misfit strain. Other striking phenomena that were predicted in BZT compounds, such as Fano resonance and field-driven percolation, are also documented and discussed. Finally, a brief perspective of possible remaining computational studies to be conducted in relaxor ferroelectrics, in order to further understand them, is attempted.

  20. First-principles-based effective Hamiltonian simulations of bulks and films made of lead-free Ba(Zr,Ti)O3 relaxor ferroelectrics

    NASA Astrophysics Data System (ADS)

    Prosandeev, Sergey; Wang, Dawei; Akbarzadeh, A. R.; Bellaiche, L.

    2015-06-01

    A review of the recent development and application of a first-principles-derived effective Hamiltonian technique to the study of lead-free Ba(Zr,Ti)O3 (BZT) relaxor ferroelectrics is provided. In addition to the computation and analysis of macroscopic properties (such as different types of dielectric responses and electric polarization) and their connections to previous published works, particular emphasis is given to microscopic insights arising from this atomistic technique. These include (i) the numerically-found determination of the physical origin of the relaxor behavior in BZT; and (ii) the prediction of polar nanoregions and the evolution of their morphology as a response to temperature, electric fields and epitaxial misfit strain. Other striking phenomena that were predicted in BZT compounds, such as Fano resonance and field-driven percolation, are also documented and discussed. Finally, a brief perspective of possible remaining computational studies to be conducted in relaxor ferroelectrics, in order to further understand them, is attempted.

  1. A-site stoichiometry and piezoelectric response in thin film PbZr1-xTixO3

    SciTech Connect

    Marincel, Dan; Jesse, Stephen; Belianinov, Alex; Okatan, Mahmut Baris; Kalinin, Sergei V.; Jackson, T. N.; Randall, Clive; Trolier-McKinstry, Susan E

    2015-05-29

    Lead zirconate titanate (PZT) films with Zr/Ti ratios of 52/48 and 30/70 annealed at varying partial pressures of PbO within the perovskite phase field exhibited permittivities of 1150 and 600, respectively, with loss tangents of 0.02. Many of the functional properties, including the permittivity, piezoelectricity as indicated via the Rayleigh coefficients, and the aging rates were found to be weakly dependent of the lead content in the single phase field. Minor polarization electric field hysteresis loops and piezoelectric coefficient e31,f values after a hot poling process suggest that the point defect helps stabilize the aligned domain states. Measurements of the local nonlinear response show an increased low response cluster size with decreasing PbO content, indicating that PbO deficiency acts to reduce domain wall motion where it is already low

  2. Process for production of solution-derived (Pb,La)(Nb,Sn,Zr,Ti)O{sub 3} thin films and powders

    DOEpatents

    Boyle, T.J.

    1999-01-12

    A simple and rapid process for synthesizing (Pb,La)(Nb,Sn,Zr,Ti)O{sub 3} precursor solutions and subsequent ferroelectric thin films and powders of the perovskite phase of these materials has been developed. This process offers advantages over standard methods, including: rapid solution synthesis (<10 minutes), use of commercially available materials, film production under ambient conditions, ease of lanthanum dissolution at high concentrations, and no heating requirements during solution synthesis. For lanthanum-doped ferroelectric materials, the lanthanum source can be added with total synthesis time less than 10 minutes. Films and powders are crystallized at approximately 650 C and exhibit ferroelectric properties comparable to films and powders produced by other techniques which require higher crystallization temperatures. 2 figs.

  3. Process for production of solution-derived (Pb,La)(Nb,Sn,Zr,Ti)O.sub.3 thin films and powders

    DOEpatents

    Boyle, Timothy J.

    1999-01-01

    A simple and rapid process for synthesizing (Pb,La)(Nb,Sn,Zr,Ti)O.sub.3 precursor solutions and subsequent ferroelectric thin films and powders of the perovskite phase of these materials has been developed. This process offers advantages over standard methods, including: rapid solution synthesis (<10 minutes), use of commercially available materials, film production under ambient conditions, ease of lanthanum dissolution at high concentrations, and no heating requirements during solution synthesis. For lanthanum-doped ferroelectric materials, the lanthanum source can be added with total synthesis time less than 10 minutes. Films and powders are crystallized at approximately 650.degree. C. and exhibit ferroelectric properties comparable to films and powders produced by other techniques which require higher crystallization temperatures.

  4. High-T C fully compensated ferrimagnetic semiconductors as spin-filter materials: the case of CrVXAl (X = Ti, Zr, Hf) Heusler compounds.

    PubMed

    Galanakis, I; Özdoğan, K; Şaşıoglu, E

    2014-02-26

    We extend our recent work on spin-filter materials (Galanakis et al 2013 Appl. Phys. Lett.103 142404) to the case of CrVXAl (X = Ti, Zr, Hf) compounds, for which, using ab initio electronic structure calculations, we show that p-d hybridization leads to the formation of a fully compensated ferrimagnetic semiconducting state with moderate exchange splitting. The magnetism is of covalent-type and the very strong antiferromagnetic Cr-V exchange interactions lead to extremely high Curie temperature, TC, values. Furthermore, all three compounds are thermodynamically and magnetically stable. The combination of very high TC values with a zero total net magnetization makes them promising materials for spintronics applications.

  5. H2 damage of ferroelectric Pb(Zr,Ti)O3 thin-film capacitors—The role of catalytic and adsorptive activity of the top electrode

    NASA Astrophysics Data System (ADS)

    Shimamoto, Y.; Kushida-Abdelghafar, K.; Miki, H.; Fujisaki, Y.

    1997-06-01

    Large-scale integrated fabrication in a H2 containing atmosphere, for example, during the passivation process, can cause serious damage in metal/Pb(Zr,Ti)O3/metal capacitors (i.e., Pt/PZT/Pt capacitors). To reveal the cause of the H2 damage, we investigated the behavior of hysteresis curves and the leakage current of capacitors with a top electrode of Pt, Pd, Au, or Ag. Capacitors with a top electrode of Au or Ag are more resistant to the H2 annealing damage than those of Pt or Pd. We found that the H2 damage was strongly affected by the catalytic activity and adsorptive properties of the top electrode when exposed to H2.

  6. The microstructure of a multielement nanostructured (TiZrHfVNbTa)N coating and its resistance to irradiation with Au- ions

    NASA Astrophysics Data System (ADS)

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

    2015-11-01

    The formation of a phase with a FCC lattice of the NaCl structure type is observed following the deposition of a multielement nanostructured (TiZrHfVNbTa)N coating. An increase in pressure results in a change in the preferred orientation of crystallite growth from the [100] axis perpendicular to the growth plane to [111]. The implantation of negative Au- ions with a dose of 1 × 1017 cm-2 and a concentration of 2.1 at % leads to the formation of a disordered polycrystalline structure with no preferred orientation of the FCC phase, reduces the size of nanocrystallites from 8 to 1-3 nm in a layer with a depth of up to 30-35 nm, and increases the nanohardness to 33.0 GPa. The large difference in atomic radii of refractory metals and the reduction in the size of nanograins in the coating contribute to an increase in hardness (51 GPa).

  7. Multiple caloric effects in (Ba0.865Ca0.135Zr0.1089Ti0.8811Fe0.01)O3 ferroelectric ceramic

    NASA Astrophysics Data System (ADS)

    Patel, Satyanarayan; Chauhan, Aditya; Vaish, Rahul

    2015-07-01

    Multiple caloric effects have been investigated for Fe-doped bulk (Ba0.865Ca0.135Zr0.1089Ti0.8811Fe0.01)O3 (BCZTO-Fe) ferroelectric ceramic. Indirect predictions were made using Maxwell's relations in conjunction with data from experimental observations. It was revealed that bulk BCZTO-Fe has huge untapped potential for solid-state refrigeration. A peak electrocaloric effect of 0.45 K (347 K) was predicted for 0-3 kV.mm-1 electric field, significantly higher than other BCZTO based materials. A maximum elastocaloric cooling of 1.4 K (298 K) was achieved for applied stress of 0-200 MPa. Finally, an unforeseen component of electric field driven caloric effect has been reported as inverse piezocaloric effect, with a maximum temperature change of 0.28 K (298 K).

  8. A cost-effective self-biased magnetoelectric effect in SrFe12O19/Metglas/Pb(Zr,Ti)O3 laminates

    NASA Astrophysics Data System (ADS)

    Ma, J. N.; Xin, C. Z.; Ma, J.; Lin, Y. H.; Nan, C. W.

    2016-10-01

    By introducing the hard magnetic SrFe12O19 ribbon, a self-biased magnetoelectric laminate—SrFe12O19/Metgals/Pb(Zr,Ti)O3 was successfully designed. Without any external magnetic field, the laminates exhibit giant self-biased ME responses of 1 V (cm Oe)-1 at quasi-static condition, and up to 29 V (cm Oe)-1 at high-frequency resonance. The induced ME voltage shows a good linear relationship to the applied ac magnetic field with amplitude as low as 10-8 T at 1 kHz, and the self-biased ME property presents an outstanding stability in a time span of 12 months.

  9. Enhancement of optical properties of hydrothermally synthesized TiO{sub 2}/ZrO{sub 2} nanoparticles by Al, Ce Co-doping

    SciTech Connect

    Tomar, Laxmi J.; Bhatt, Piyush J. Desai, Rahul K.; Chakrabarty, Bishwajit S.

    2015-06-24

    Al, Ce co-doped TiO{sub 2}/ZrO{sub 2} (TZ) nano composites have been prepared by hydrothermal method. The structural and optical properties of the obtained samples were investigated by X –ray diffraction (XRD) and UV-Visible spectroscopy respectively. It has been found that the crystallite size of all the samples was distributed in the range 9.19 to 17.41 nm. The content of anatase phase varied in the range 48.71 to 100% depending on doping. The dopant produced lattice strain in material and it was found between 0.027 - 0.069. A clear shift of absorption edge for different dopant has been observed from UV-Visible absorption spectra. The change in optical bandgap, refractive index, absorption co efficient and optical conductivity was also evaluated from absorption spectra.

  10. Theoretical investigations on vibrational properties and thermal conductivities of ternary antimonides TiXSb, ZrXSb and HfXSb (X = Si, Ge)

    NASA Astrophysics Data System (ADS)

    Deligoz, E.; Ozyar, U. F.; Ozisik, H. B.

    2016-06-01

    We have performed density functional calculations of the vibrational and thermodynamic properties of the ternary antimonides TiXSb, ZrXSb and HfXSb (X = Si, Ge). The direct method is used to calculate the phonon dispersion relation and phonon density of states for these compounds as well as their infrared and Raman active mode frequencies for the first time. Their dynamical stability is confirmed by phonon spectra. The lattice thermal conductivities of these compounds have been calculated from third-order force constants and plotted as a function of temperature. We have also evaluated the high temperature thermal conductivity by means of the Clarke's model and Cahill's model. Some selected thermodynamical properties, e.g. Gibbs free energy, entropy and heat capacity at constant volume are predicted theoretically and discussed. We have showed the relationships between thermodynamical properties and temperature. The numerical calculations reported in this paper were partially performed at Aksaray University, Science and Technology Application and Research Center.

  11. Size-controlled synthesis of ZrO{sub 2}-TiO{sub 2} nanoparticles prepared via reverse micelle method

    SciTech Connect

    Ghiaci, Mehran Aghaei, Hamidreza; Abbaspur, Alireza

    2008-05-06

    Zirconium-titanium mixed oxide nanoparticles have been synthesized using microreactors made of bis-(2-ethylhexyl) sulfosuccinate (AOT)/water/n-hexane microemulsions. The control of particle size was achieved by varying the process variables, such as water-to-surfactant molar ratio and reagent concentration. Their sizes, appearances, crystal structures, pore diameter and surface area were characterized by TEM, XRD, N{sub 2} adsorption/desorption methods. The results revealed that samples prepared in reverse micelles had no crystalline phase. The Beckmann rearrangement of cyclohexanone oxime on ZrO{sub 2}-TiO{sub 2} nanoparticles was carried out in a fixed-bed down flow reactor to investigate the effect of particle size on catalytic activity and selectivity. Samples synthesized in reverse micelles had better reaction performance than samples prepared via sol-gel method. A parallel relationship could be drawn between the catalytic activity and the particle size as well as the selectivity of the catalyst.

  12. Micro-power generator supplying source for integrated circuit chip based on Pb(Sn,Zr,Ti)O3 ferroelectric ceramic

    NASA Astrophysics Data System (ADS)

    Zhang, Zhenhai; Cui, Zhanzhong; Yan, Jinglong; Li, Kejie

    2011-04-01

    We have demonstrated both experimentally and theoretically that a tin-modified and niobium-modified lead zirconate titanate (Pb(Sn,Zr,Ti)O3) ferroelectric generator system can function as a micro-power supplying source for integrated circuit (IC) chip of separate nonelectric impulse input shock tube digital delay detonator. The ferroelectric ceramic phase transition under transverse shock wave compression can charge an external storage capacitor. The ferroelectric ceramic micro-pulsed-power system is capable of generating low output voltage pulses with an amplitude of 54.2 V and with transferred energy of 1.73 mJ, ultimately supplying an IC chip with micro-power. This work presents the methodology for theoretical analysis and experimental operation of the ferroelectric generator. Theoretical calculations are conducted based on circuit analysis law and principles of dynamic high pressure and shock wave physics. The experimental results were in good agreement with the theoretical analysis.

  13. Large magnetoelectric effect in mechanically mediated structure of TbFe{sub 2}, Pb(Zr,Ti)O{sub 3}, and nonmagnetic flakes

    SciTech Connect

    Bi, K.; Wang, Y. G.; Wu, W.; Pan, D. A.

    2011-03-28

    Magnetoelectric (ME) effect has been studied in a structure of a magnetostrictive TbFe{sub 2} alloy, two piezoelectric Pb(Zr,Ti)O{sub 3} (PZT) ceramics, and two nonmagnetic flakes. The ME coupling originates from the magnetic-mechanical-electric transform of the magnetostrictive effect in TbFe{sub 2} and the piezoelectric effect in PZT by end bonding, instead of interface bonding. Large ME coefficients of 10.5 and 9.9 V cm{sup -1} Oe{sup -1} were obtained at the first planar acoustic and third bending resonance frequencies, which are larger than that of conventional layered TbFe{sub 2}/PZT composites. The results show that the large ME coupling can be achieved without interface coupling.

  14. Robocast Pb(Zr{sub 0.95}Ti{sub 0.05})O{sub 3} Ceramic Monoliths and Composites

    SciTech Connect

    TUTTLE,BRUCE A.; SMAY,JAMES E.; CESARANO III,JOSEPH; VOIGT,JAMES A.; SCOFIELD,TIMOTHY W.; OLSON,WALTER R.; LEWIS,J.A.

    2000-07-18

    Robocasting, a computer controlled slurry deposition technique, was used to fabricate ceramic monoliths and composites of chemically prepared Pb(Zr{sub 0.95}Ti{sub 0.05})O{sub 3} (PZT 95/5) ceramics. Densities and electrical properties of the robocast samples were equivalent to those obtained for cold isostatically pressed (CIP) parts formed at 200 MPa. Robocast composites consisting of alternate layers of the following sintered densities: (93.9%--96.1%--93.9%), were fabricated using different levels of organic pore former additions. Modification from a single to a multiple material deposition robocaster was essential to the fabrication of composites that could withstand repeated cycles of saturated polarization switching under 30 kV/cm fields. Further, these composites withstood 500 MPa hydrostatic pressure induced poled ferroelectric (FE) to antiferroelectric (AFE) phase transformation during which strain differences on the order of 0.8% occurred between composite elements.

  15. Resistivity of Pb(Zr0.52Ti0.48)O3 ferroelectric ceramics subjected to dynamic impact loading

    NASA Astrophysics Data System (ADS)

    Choi, Yoon Soo; Cho, Kyung Ho; Seo, Chang Eui

    2013-12-01

    Poled Pb(Zr0.52Ti0.48)O3 (PZT 52/48) ceramics have been prepared and impacted normally to the direction of polarization by a 40-mm gas-gun accelerated projectile. The impact depoled the PZT 52/48 ceramic and caused it to release electricity to the electrodes which was connected to an external resistor. The comparison of the voltage difference produced at the PZT specimen by the shock with that calculated from a simplified circuit model revealed that the resistivity of the PZT 52/48 ceramic under a 2.1-GPa initial shock stress was approximately 3.8·104 Ω-cm.

  16. Resonance magnetoelectric effect in Ni/Pb(Zr,Ti)O3/Terfenol-D trilayered composites with different mechanical boundary conditions

    NASA Astrophysics Data System (ADS)

    Cheng, J. H.; Wang, Y. G.; Xie, D.

    2014-06-01

    Magnetoelectric Ni/Pb(Zr,Ti)O3 (PZT)/Tb1-xDyxFe2-y (Terfenol-D) trilayered composites were made up of negative magnetostrictive/piezoelectric/positive magnetostrictive layers, and bonded to nonmagnetic glass plates to obtain three different mechanical boundary conditions: (i) both ends of sample traction free (F-F), (ii) one end clamped while the other traction free (C-F), and (iii) both ends of sample clamped (C-C). In these three modes, various experimental values of resonance frequencies were obtained in 1-140 kHz range, which agree well with the calculated ones. In the C-F mode six resonance frequencies exist, which may be useful for multifrequency operation. The low resonance frequency of the C-F mode can be used to decrease the eddy current loss of the magnetostrictive phase and increase the lifetime of the devices.

  17. Preparation and Characterization of Ti-Zr-V Non-Evaporable Getter Films to Be Used in Ultra-High Vacuum

    SciTech Connect

    Ferreira, Marcelo J.; Tallarico, Denise A.; Nascente, Pedro A. P.

    2009-01-29

    An appealing procedure to obtain operating pressures in the 10{sup -8} Pa range, which is necessary for the insertion devices elements of synchrotron sources, is to coat the inner ultra-high vacuum chamber walls with a thin film of non-evaporable getter (NEG) metals. Titanium, zirconium, vanadium, and their alloys are used as NEG materials due to their low activation temperature, high chemical activity, large solubility, and high diffusivity for gases. In this work, magnetron sputtering was employed to deposit thin films of Ti-Zr-V on a Si(111) substrate. The morphological, structural, and chemical analyses were carried out by atomic force microscopy (AFM), scanning electron microscopy (SEM) with energy-dispersive spectroscopy (EDS), and X-ray photoelectron spectroscopy (XPS)

  18. Thermal stability of field-forced and field-assisted antiferroelectric-ferroelectric phase transformations in Pb(Zr,Sn,Ti)O sub 3

    SciTech Connect

    Yang, P.; Payne, D.A. )

    1992-02-01

    Antiferroelectric (AFE)-ferroelectric phase transformations in tin-modified lead zirconate titanate, i.e., Pb(Zr,Sn,Ti)O{sub 3} are reported. A martensitic-type approach is developed to explain the observed thermal hysteresis and field-induced transformation behavior. A model is proposed with transformation fields where the forward {ital E}{sub {ital F}} and reverse {ital E}{sub {ital A}} field strengths are related to the transformation barrier to the ferroelectric state, and to the AFE sublattice coupling, respectively. The thermal stability of the AFE state can therefore be determined with respect to the field-induced transformation behavior. A distinction is made between field-forced and field-assisted transformations, which depend on temperature and thermal hysteresis, and which are related to reversible and irreversible field-induced characteristics. Data are reported for polarizations and strains, and discussed with respect to the proposed thermodynamic model and device applications.

  19. Electric field induced metastable ferroelectric phase and its behavior in (Pb, La)(Zr, Sn, Ti)O{sub 3} antiferroelectric single crystal near morphotropic phase boundary

    SciTech Connect

    Li, Yuanyuan; Li, Qiang Yan, Qingfeng; Gao, Jinghan; Zhuo, Fangping; Cao, Wenwu; Xi, Xiaoqing; Zhang, Yiling; Chu, Xiangcheng

    2014-02-03

    Antiferroelectric (AFE) (Pb, La)(Zr, Sn, Ti)O{sub 3} (PLZST) single crystal with composition near morphotropic phase boundary has been grown and studied. X-ray diffraction analysis and electrical properties reveal coexistence of antiferroelectric/ferroelectric (FE) phases, with the AFE phase dominated at room temperature. Temperature-dependent polarization and strain measurements indicate that the AFE phase can be induced into a metastable FE phase by electric field. The FE phase can be maintained in a wide temperature range above room temperature and recovers to AFE phase around a critical temperature of 90 °C, accompanied with remarkable change in field-induced strain. The strain at 90 °C (∼0.50%) is ten times larger than that at room temperature (∼0.04%), which makes the PLZST single crystal a promising candidate for thermal switch and actuator application.

  20. Electric field induced metastable ferroelectric phase and its behavior in (Pb, La)(Zr, Sn, Ti)O3 antiferroelectric single crystal near morphotropic phase boundary

    NASA Astrophysics Data System (ADS)

    Li, Yuanyuan; Cao, Wenwu; Li, Qiang; Yan, Qingfeng; Gao, Jinghan; Zhuo, Fangping; Xi, Xiaoqing; Zhang, Yiling; Chu, Xiangcheng

    2014-02-01

    Antiferroelectric (AFE) (Pb, La)(Zr, Sn, Ti)O3 (PLZST) single crystal with composition near morphotropic phase boundary has been grown and studied. X-ray diffraction analysis and electrical properties reveal coexistence of antiferroelectric/ferroelectric (FE) phases, with the AFE phase dominated at room temperature. Temperature-dependent polarization and strain measurements indicate that the AFE phase can be induced into a metastable FE phase by electric field. The FE phase can be maintained in a wide temperature range above room temperature and recovers to AFE phase around a critical temperature of 90 °C, accompanied with remarkable change in field-induced strain. The strain at 90 °C (˜0.50%) is ten times larger than that at room temperature (˜0.04%), which makes the PLZST single crystal a promising candidate for thermal switch and actuator application.