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Sample records for povedenie ti zr

  1. Local structure of deuterated Ti-Zr alloy

    NASA Astrophysics Data System (ADS)

    Fukunaga, T.; Itoh, K.; Hashi, K.; Aoki, K.

    The Ti-Zr alloy system is isomorphous over the total concentration range. A neutron zero-scattering alloy can be obtained at the composition Ti0.676Zr0.324 because of negative and positive coherent neutron scattering amplitudes of Ti and Zr respectively. A (Ti0.676Zr0.324)D0.31 amorphous alloy was synthesized by mechanical alloying (MA) under a deuterium-gas atmosphere of 0.08 MPa. In contrast, it is found that the MA of Ti and Zr powders under a deuterium-gas atmosphere of 2.0 MPa forms a nano-crystalline (Ti0.676Zr0.324)D1.54 alloy, which is composed of TiH2 and ZrH2 crystalline compounds.

  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. PMID:25579891

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

    NASA Astrophysics Data System (ADS)

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

    2015-03-01

    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. Mg0.40Zr0.60D1.78 and Mg0.40Zr0.26Ti0.34D1.98 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 MgD2, ZrD2 or TiD2; 528 and 575 K in the Mg-Zr-D and Mg-Zr-Ti-D system, respectively. Interestingly, Mg0.40Zr0.26Ti0.34D1.98 stores deuterium reversibly at 673 K and 10 MPa of D2.

  5. Ti- and Zr-based metal-air batteries

    NASA Astrophysics Data System (ADS)

    Van der Ven, Anton; Puchala, Brian; Nagase, Takeshi

    2013-11-01

    We propose a high-temperature, rechargeable metal-air battery that relies on Ti or Zr metal as the anode and the shuttling of oxygen anions between the cathode and the anode through a solid-oxide ion-conducting electrolyte. The cathode has much in common with solid-oxide fuel cells. Key in the proposed battery is the use of Ti or Zr as the anode as these metals are unique in their ability to dissolve oxygen up to concentrations of 33% with minimal structural and volumetric changes. First-principles statistical mechanics calculations predict open circuit voltages around 2.5 V, substantially larger than the open circuit voltage of high-temperature solid-oxide fuel cells. The calculations predict the stability of TiO and ZrO monoxides along with TiOx and ZrOx (with x as high as ½) solid solutions. These suboxide phases are all predicted to be metallic, indicating that electron transport in the anodes will not be rate limiting. The oxygen diffusion coefficients in the Ti and Zr suboxides at high temperature (˜700-800 °C) are predicted to be comparable to that of Li ions in intercalation compounds. These properties suggest theoretical capacities as high as 840 mAh g-1 and 500 mAh g-1 for Ti and Zr based metal-air batteries respectively.

  6. 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.

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

    NASA Astrophysics Data System (ADS)

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

    2013-07-01

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

  8. Hydriding of TiZrNiFe nanocompounds

    NASA Astrophysics Data System (ADS)

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

    2010-01-01

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

  9. 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.

  10. 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.

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

    NASA Astrophysics Data System (ADS)

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

    2015-08-01

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

  15. 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. PMID:25842119

  16. 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.

  17. Generalized melting criterion for amorphization. [NiZr, NiZr[sub 2], NiTi, FeTi

    SciTech Connect

    Devanathan, R. Northwestern Univ., Evanston, IL . Dept. of Materials Science and Engineering); Lam, N.Q.; Okamoto, P.R. ); Meshii, M. . Dept. of Materials Science and Engineering)

    1992-12-01

    We present a thermodynamic model of solid-state amorphization based on a generalization of the well-known Lindemann criterion. The original Lindemann criterion proposes that melting occurs when the root-mean-square amplitude of thermal displacement exceeds a critical value. This criterion can be generalized to include solid-state amorphization by taking into account the static displacements. In an effort to verify the generalized melting criterion, we have performed molecular dynamics simulations of radiation-induced amorphization in NiZr, NiZr[sub 2], NiTi and FeTi using embedded-atom potentials. The average shear elastic constant G was calculated as a function of the total mean-square atomic displacement following random atom-exchanges and introduction of Frenkel pairs. Results provide strong support for the generalized melting criterion.

  18. Electrolytic deposition of hydroxyapatite coating on thermal treated Ti-40Zr.

    PubMed

    Hsu, Hsueh-Chuan; Wu, Shih-Ching; Lin, Chih-Hung; Ho, Wen-Fu

    2009-09-01

    In this study, hydroxyapatite (HA) was coated on both thermal treated and untreated Ti-40Zr substrates by means of electrolytic deposition. It was predicted that the HA layer would increase the bioactivity and osteoconductivity of the Ti-40Zr substrate, and a thermal treatment would improve the bonding strength between the HA layer and Ti-40Zr substrate, and prevent the corrosion of the Ti-40Zr substrate. First, the Ti-40Zr samples were annealed at various temperatures (200, 300, 400, 500 and 600 degrees C respectively). After annealing, samples were immersed in a Ca(NO(3))(2).4H(2)O and (NH(4))(3)PO(4).3H(2)O solution for the electrolytic deposition of the HA coating. Various analyses of the coating were conducted, including surface morphology, phase structure, corrosion resistance, biocompatibility, and bond strength between HA and Ti-40Zr. Experimental results indicated that the bonding strength of the HA coating on the thermal treated Ti-40Zr was markedly improved when compared to that of the HA coating on an untreated Ti-40Zr alloy. The corrosion resistance of Ti-40Zr was also improved by the use of the thermal treatment, as shown by a potentiodynamic polarization test. Finally, osteoblast-like cells cultured on the HA coating surface were found to have proliferated on all samples. PMID:19404722

  19. 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.

  20. Characteristics of Ti-Nb, Ti-Zr and Ti-Al containing hydrogenated carbon nitride films

    NASA Astrophysics Data System (ADS)

    Balaceanu, M.; Braic, V.; Braic, M.; Vladescu, A.; Zoita, C. N.; Grigorescu, C. E. A.; Grigore, E.; Ripeanu, R.

    2009-10-01

    Nanocomposite Me-C-N:H coatings (Me is TiNb, TiZr or TiAl), with relatively high non-metal/metal ratios, were prepared by cathodic arc method using TiNb, TiZr and TiAl alloy cathodes in a CH 4 + N 2 atmosphere. For comparison purposes, a-C-N:H films were also produced through evaporating a graphite cathode in a similar atmosphere. The films were characterized in terms of elemental and phase compositions, chemical bonds, texture, hardness, adhesion and friction behavior by GDOES, XPS, Raman spectroscopy and XRD techniques, surface profilometry, hardness and scratch adhesion measurements, and tribological tests. The nanocomposite films consisted of a mixture of crystalline metal carbonitride and amorphous carbon nitride. The non-metal/metal ratio in the films composition was found to range between 1.8 and 1.9. For the metal containing nanocomposites, grain size in the range 7-23 nm, depending on the metal nature, were determined. As compared with the a-C-N:H, the Me-C-N:H films exhibited a much higher hardness (up to about 39 GPa for Ti-Zr-C-N:H) and a better adhesion strength, while the coefficients of friction were somewhat higher (0.2-0.3 for Me-C-N:H and 0.1 for a-C-N:H).

  1. Zr-doped rutile TiO2: a nuclear quadrupole interaction study

    NASA Astrophysics Data System (ADS)

    Banerjee, D.; Das, S. K.; Das, P.; Thakare, S. V.; Butz, T.

    2010-04-01

    Role of Zr atom on the quadrupole interaction of 181Ta in rutile TiO2 has been investigated by time differential perturbed angular correlation (TDPAC) study. The quadrupole frequency remains same as that in the pure rutile TiO2 but its distribution increases with the amount of Zr. This indicates a metal-metal interaction between probe atom and Zr-atom in the nearest neighbour.

  2. Theoretical Analysis of Oxygen Vacancy Formation in Zr-Doped BaTiO3

    NASA Astrophysics Data System (ADS)

    Umeda, Yuji; Takano, Kosuke; Kojima, Takashi; Kuwabara, Akihide; Moriwake, Hiroki

    2012-09-01

    One of the most serious problems for the development of multilayer ceramic capacitors (MLCCs) is that their electrical resistance decreases under long-term DC voltage. Oxygen vacancy migration in BaTiO3 is thought to be one cause of this deterioration. In this study, to understand this mechanism, quantitative analysis of the oxygen vacancy formation energy [Ef(VO)] in Zr-doped and undoped BaTiO3 was performed. The Ef(VO) of Zr-doped BaTiO3 was higher than that of undoped BaTiO3 because the valence of Ti in undoped BaTiO3 easily changed from +4 to +3 owing to oxygen vacancy formation, compared with that in Zr-doped BaTiO3. We also prepared undoped (BaTiO3) and Zr-doped (BaZr0.05Ti0.95O3) ceramic samples sintered under reducing atmosphere (T = 1573 K pO2 = 10-13 MPa). BaZr0.05Ti0.95O3 remained an insulator, but BaTiO3 showed semiconducting behavior. This experimental result corresponds well to theoretical results of first-principles calculations.

  3. 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.

  4. 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.

  5. 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. PMID:27258932

  6. Dielectric response of BaZrO3/BaTiO3 superlattice

    NASA Astrophysics Data System (ADS)

    Wang, D.; Jiang, Z.

    2016-06-01

    We use the first-principles-based molecular dynamic approach to simulate dipolar dynamics of BaZrO3/BaTiO3 superlattice, and obtain its dielectric response. The dielectric response is decomposed into its compositional, as well as the in-plane and out-of-plane parts, which are then discussed in the context of chemical ordering of Zr/Ti ions. We reveal that, while the in-plane dielectric response of BaZrO3/BaTiO3 superlattice also shows dispersion over probing frequency, it shall not be categorized as relaxor.

  7. Physical properties modulation of Fe₃O₄/Pb(ZrTi)O₃ heterostructure via Fe diffusion.

    PubMed

    Chichvarina, O; Herng, T S; Ding, J

    2016-03-18

    The manipulation of material properties in perovskite oxide heterojunctions has been increasingly studied, owing to their interacting lattice, charge, spin and orbital degrees of freedom. In this work, the switching, ferroelectricity and magneto-transport properties of epitaxially grown perovskite Pb(Zr0.52Ti0.48)O3 layers sandwiched between Fe3O4 (top electrode) and SrRuO3 (bottom electrode) are investigated. These films show a typical ferroelectric polarization of ∼50 μC/cm(2). Once the Pb(Zr0.52Ti0.48)O3 films become thinner (∼30 nm), one can set (reset) the Fe3O4/Pb(Zr0.52Ti0.48)O3/SrRuO3 structures into a low (high) resistance state via formation (rupture) of an Fe-related filament in Pb(Zr0.52Ti0.48)O3 through manipulation of an electric field. Interestingly, at the low-resistance state, a prominent magnetoresistance signal of ∼3% was observed. There is no magnetoresistance signal detected in the virgin Pb(Zr0.52Ti0.48)O3 film (before switching), high-resistive state Pb(Zr0.52Ti0.48)O3 film and Au/Pb(Zr0.52Ti0.48)O3/SrRuO3. These phenomena are attributed to the diffusion of Fe-related ions into the Pb(Zr0.52Ti0.48)O3 film, turning a non-magnetic and insulating layer of perovskite Pb(Zr0.52Ti0.48)O3 into a magnetic and semiconducting-like Pb(Zr0.52Ti0.48)O3. The magneto-transport properties of Fe3O4/Pb(Zr0.52Ti0.48)O3/SrRuO3 have been studied extensively. Such resistance-ferroelectric-ferromagnetic coupling in a single compound paves the way to the realization of a non-volatile multiple-state Pb(ZrTi)O3 hybrid memory, as well as new computing approaches. PMID:26875549

  8. Nucleation and Precipitation Strengthening in Dilute Al-Ti and Al-Zr Alloys

    NASA Astrophysics Data System (ADS)

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

    2007-10-01

    Two conventionally solidified Al-0.2Ti alloys (with 0.18 and 0.22 at. pct Ti) exhibit no hardening after aging up to 3200 hours at 375 °C or 425 °C. This is due to the absence of Al3Ti precipitation, as confirmed by electron microscopy and electrical conductivity measurements. By contrast, an Al-0.2Zr alloy (with 0.19 at. pct Zr) displays strong age hardening at both temperatures due to precipitation of Al3Zr (L12) within Zr-enriched dendritic regions. This discrepancy between the two alloys is explained within the context of the equilibrium phase diagrams: (1) the disparity in solid and liquid solubilities of Ti in α-Al is much greater than that of Zr in α-Al; and (2) the relatively small liquid solubility of Ti in α-Al limits the amount of solute retained in solid solution during solidification, while the comparatively high solid solubility reduces the supersaturation effecting precipitation during post-solidification aging. The lattice parameter mismatch of Al3Ti (L12) with α-Al is also larger than that of Al3Zr (L12), further hindering nucleation of Al3Ti. Classical nucleation theory indicates that the minimum solute supersaturation required to overcome the elastic strain energy of Al3Ti nuclei cannot be obtained during conventional solidification of Al-Ti alloys (unlike for Al-Zr alloys), thus explaining the absence of Al3Ti precipitation and the presence of Al3Zr precipitation.

  9. 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.

  10. 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

  11. 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

  12. 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.

  13. Comments on the equilibrium diagram of the Ti-Zr system

    SciTech Connect

    Ruch, M. . Depto INEND); Arias, D. . Dept Materiales)

    1993-08-15

    The Ti-Zr system is a continuous series of solid solutions in both the [alpha]- and [beta]-phases, with a congruent minimum at Ti-50at%Zr. The equilibrium diagram has been reviewed by Murray in 1981, who accepts the [alpha]/[beta] temperature for this minimum determined by Farrar and Adler by metallographic techniques. Etchessahar and Debuigne measured by dilatometry a transformation temperature of (894 [plus minus])K and (859[plus minus]2)K for [alpha]/[alpha] + [beta] and [beta]/[alpha] + [beta] respectively, and later in a high temperature Calvet microcalorimeter, 883K. Blacktop et al find that this value is consistent with their measurements of the [alpha]/[beta] transformation temperature in Ti-40%Zr and Ti-60%Zr in a high temperature calorimeter. In the present work, the [alpha]/[beta] transformation temperature was measured by several techniques. The effect of impurities is considered in both transformation temperature and microstructure of product phases.

  14. Effect of Microstructure on Reliability of Ca(TiZr)O3-Based Multilayer Ceramic Capacitors

    NASA Astrophysics Data System (ADS)

    Motoki, Tomoo; Naito, Masahiro; Sano, Harunobu; Konoike, Takehiro; Tomono, Kunisaburo

    2000-09-01

    We examined the reliability of Ca(TiZr)O3 (CTZ)-based Ni-electrode multilayer ceramic capacitors (MLCs) prepared by two different processes with particular interest in the microstructure. One process was to calcine the mixture of CaCO3 and TiO2 to prepare CaTiO3 (CT) powder and the mixture of CaCO3 and ZrO2 to prepare CaZrO3 (CZ) powder, and then mix these calcined powders and sinter them to synthesize the CTZ-based ceramics. The other was to calcine the mixture of CaCO3, TiO2 and ZrO2 powders together to prepare CTZ powder and then sinter them. These two processes of CTZ ceramic preparation resulted in a different crystallinity and distribution of the elements. We found that these factors influenced the reliability of CTZ-based MLCs.

  15. 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. PMID:25105238

  16. 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)

  17. Calculation of isothermal sections of three ternary Ti-Zr-X systems

    SciTech Connect

    Lin, L.; Delaey, L.; Van Der Biest, O.; Wollants, P.

    1996-05-01

    The equilibrium phase diagram of the binary system Ti-Zr shows complete solubility in both allotropic forms, the high temperature {beta}-phase (bcc structure) and the low temperature {alpha}-phase (hexagonal structure). In the present paper the influence of additions of a third element (X = Hf, Nb, Ta) on the relative stability of both phases has been analyzed. Hf does also exhibit the two allotropic forms, and both show complete solubility for Zr and Ti. The other two elements crystallize as bcc. Nb is completely soluble in {beta}-Ti, but only at higher temperatures in {beta}-Zr. Its solubility in the {alpha}-Ti and {alpha}-Zr phases is very limited. Ta is also completely soluble in {beta}-Ti but shows only limited solubility in {beta}-Zr, {alpha}-Zr and {alpha}-Ti. Calculated isothermal sections of these three ternary equilibrium phase diagrams as well as considerations concerning thermodynamic parameters are presented and discussed in this work.

  18. 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.

  19. 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.

  20. 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).

  1. 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.

  2. Photoelectron spectroscopy of metallocarbohedrenes M8C12- (M=Ti, V, Cr, ZR, NB)

    SciTech Connect

    Li, San; Wu, Hongbin; Li, Xi; Ding, Chuanfan

    1997-12-31

    Photoelectron spectroscopy experiments have been performed on five metallocarbohedrene (met-car) anions, Ti8C12-, V8C12-, Cr8C12-, Zr8C12-, Nb8C12-. These met-car anions were produced by two different methods. We found that the Ti and Zr met-cars show unusually low electron affinities (EAs) and the EAs increase from Ti to Cr met-cars. The observed photoelectron spectra and the electronic structure of the met-cars are interpreted using existing theoretical calculations.

  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. Characteristics of DLC containing Ti and Zr films deposited by reactive magnetron sputtering

    NASA Astrophysics Data System (ADS)

    Ma, Guojia; Lin, Guoqiang; Sun, Gang; Zhang, Huafang; Wu, Hongchen

    The purpose of this paper is to investigate metal doping effects on micro-structural, mechanical and corrosive behavior of the DLC film. Ti and Zr doped DLC films were prepared on NiTi alloys by reactive magnetron sputtering combined with plasma source ion implantation (PSII) technology used to improve the coherent strength, respectively. The mechanical properties of the doped DLC films were investigated by means of nano-indentation technique, microscratch and frictional wear testing. The potentiodynamic polarization measurement was employed to value the corrosion resistance of DLC with Ti and Zr films in Hank's simulated body fluid. It was found that Ti-doped DLC films embraced higher nano-hardness, somewhat lower coefficient of friction and better corrosion resistance than Zr-doped DLC films.

  7. Nanostructured Ti-Zr-Pd-Si-(Nb) bulk metallic composites: Novel biocompatible materials with superior mechanical strength and elastic recovery.

    PubMed

    Hynowska, A; Blanquer, A; Pellicer, E; Fornell, J; Suriñach, S; Baró, M D; Gebert, A; Calin, M; Eckert, J; Nogués, C; Ibáñez, E; Barrios, L; Sort, J

    2015-11-01

    The microstructure, mechanical behaviour, and biocompatibility (cell culture, morphology, and cell adhesion) of nanostructured Ti45 Zr15 Pd35- x Si5 Nbx with x = 0, 5 (at. %) alloys, synthesized by arc melting and subsequent Cu mould suction casting, in the form of rods with 3 mm in diameter, are investigated. Both Ti-Zr-Pd-Si-(Nb) materials show a multi-phase (composite-like) microstructure. The main phase is cubic β-Ti phase (Im3m) but hexagonal α-Ti (P63/mmc), cubic TiPd (Pm3m), cubic PdZr (Fm3m), and hexagonal (Ti, Zr)5 Si3 (P63/mmc) phases are also present. Nanoindentation experiments show that the Ti45 Zr15 Pd30 Si5 Nb5 sample exhibits lower Young's modulus than Ti45 Zr15 Pd35 Si5 . Conversely, Ti45 Zr15 Pd35 Si5 is mechanically harder. Actually, both alloys exhibit larger values of hardness when compared with commercial Ti-40Nb, (HTi-Zr-Pd-Si ≈ 14 GPa, HTi-Zr-Pd-Si-Nb ≈ 10 GPa and HTi-40Nb ≈ 2.7 GPa). Concerning the biological behaviour, preliminary results of cell viability performed on several Ti-Zr-Pd-Si-(Nb) discs indicate that the number of live cells is superior to 94% in both cases. The studied Ti-Zr-Pd-Si-(Nb) bulk metallic system is thus interesting for biomedical applications because of the outstanding mechanical properties (relatively low Young's modulus combined with large hardness), together with the excellent biocompatibility. PMID:25533018

  8. Influence of Zr/Ti Ratio on the Microwave Dielectric Behavior of xZrO2-0.4(Zn1/3Nb2/3)O2- yTiO2 Ceramics

    NASA Astrophysics Data System (ADS)

    Cui, Zhiyuan; Shen, Chunying; Qiu, Tai

    2015-01-01

    xZrO2-0.4(Zn1/3Nb2/3)O2- yTiO2 ( x + y + 0.4 = 2, x/ y = 7/9, 8/8, 9/7, and 10/6, denoted as Z7T9, Z8T8, Z9T7, and Z10T6, respectively) ceramics were prepared by the conventional solid-state ceramic route. The objective of the present work is to determine an excellent Zr/Ti ratio for the xZrO2-0.4(Zn1/3Nb2/3)O2- yTiO2 system. The microstructure and microwave dielectric properties have been investigated as functions of the Zr/Ti ratio and sintering temperature. The crystalline phases of the (Zn1/3Nb2/3)4+-doped ZrO2-TiO2 ceramics depended greatly on the Zr/Ti ratio. The samples with Zr/Ti ratio of 7/9 and 8/8 crystallized as columbite-type-structured ZrTi2O6 phase, while the samples with Zr/Ti ratio of 9/7 and 10/6 crystallized in orthorhombic α-PbO2 ZrTiO4 structure. Secondary phase of monoclinic ZrO2 appeared when the Zr/Ti ratio was high at 10/6. Scanning electron microscopy (SEM) analysis demonstrated that dense ceramics were obtained, with increasing average grain size as the Zr/Ti ratio was increased. The microwave dielectric properties, especially the quality factor ( Q× f) and temperature coefficient of resonance frequency( τ f ) values, were sensitive to the Zr/Ti ratio. The 0.8ZrO2-0.4(Zn1/3Nb2/3)O2-0.8TiO2 ceramic sintered at 1320°C for 3 h exhibited an excellent combination of microwave dielectric properties with dielectric constant ( ɛ r) of 40.89, Q× f of 43,300 GHz, and τ f of -3.8 ppm/°C.

  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. 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}.

  11. p-t-x diagram of Pb(TiZr)O/sub 3/ solid solutions

    SciTech Connect

    Polandov, I.N.; Alekhina, N.S.; Gulish, O.K.; Isaev, G.P.; Malyutin, B.I.

    1986-07-01

    This paper attempts to generalize work the authors performed at high pressures on the phase equilibria in the PbTiO/sub 3/-PbZrO/sub 3/ system for Ti contents up to 50 at.%, i.e., the most interesting compositions from the practical standpoint. It is established that the rhombohedral ferroelectric phase, localized near the Curie point, not only expands its region of temperature stability, but also shifts its region of temperature stability to higher pressures with rise of solid solution Ti content. The authors construct for the first time the complete p-t-x diagram of Pb(Ti, Zr)O/sub 3/ solid solutions with Ti contents up to 50 at.%.

  12. 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. PMID:22520431

  13. 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

  14. Decomposition of the ω-phase in the equiatomic TiZr alloy under high pressure

    NASA Astrophysics Data System (ADS)

    Bashkin, I. O.; Shestakov, V. V.; Sakharov, M. K.; Ponyatovsky, E. G.

    2008-07-01

    The phase decomposition phenomenon is found in the hexagonal ω-phase of the Ti—Zr system under high pressure. The ω → ω1 + ω2 decomposition of the equiatomic TiZr alloy occurred due to long thermobaric treatment at P = 5.5±0.6 GPa and T = 710±30 K. The chemical compositions of the ω1- and ω2-phases recovered to ambient conditions were estimated from the X-ray data to be around Ti20Zr80 and Ti83Zr17. The experimental data were used to calculate the mixing energy and the top of the decomposition curve in the isobaric T-C diagram of this system. We find that the equilibrium T-C phase diagram of the Ti-Zr system at pressures above ~8 GPa is of the eutectoid type with the high-temperature β-phase and the low-temperature ω1- and ω2-phases.

  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. Preparation and Mechanism of Cu-Decorated TiO2-ZrO2 Films Showing Accelerated Bacterial Inactivation.

    PubMed

    Rtimi, Sami; Pulgarin, Cesar; Sanjines, Rosendo; Nadtochenko, Victor; Lavanchy, Jean-Claude; Kiwi, John

    2015-06-17

    Antibacterial robust, uniform TiO2-ZrO2 films on polyester (PES) under low intensity sunlight irradiation made up by equal amounts of TiO2 and ZrO2 exhibited a much higher bacterial inactivation kinetics compared to pure TiO2 or ZrO2. The TiO2-ZrO2 matrix was found to introduce a drastic increase in the Cu-dopant promoter enhancing bacterial inactivation compared to Cu sputtered in the same amount on PES. Furthermore, the bacterial inactivation was accelerated by a factor close to three, by Cu- on TiO2-ZrO2 at extremely low levels ∼0.01%. Evidence is presented by X-ray photoelectron spectroscopy for redox catalysis taking place during bacterial inactivation. The TiO2-ZrO2-Cu band gap is estimated and the film properties were fully characterized. Evidence is provided for the photogenerated radicals intervening in the bacterial inactivation. The photoinduced TiO2-ZrO2-Cu interfacial charge transfer is discussed in term of the electronic band positions of the binary oxide and the Cu TiO2 intragap state. PMID:26023896

  20. 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. PMID:24280708

  1. Enhanced dielectric response of ZrO2 upon Ti doping and introduction of O vacancies

    NASA Astrophysics Data System (ADS)

    Dutta, Gargi; Hembram, K. P. S. S.; Rao, G. Mohan; Waghmare, Umesh V.

    2008-01-01

    We determine the electronic properties and dielectric response of zirconia (ZrO2) with oxygen vacancies (O vacancies) and Ti doping using first-principles density functional theory calculations based on pseudopotentials and a plane wave basis. We find significantly enhanced static dielectric response in zirconia with Ti doping and introduction of oxygen vacancies. Softening of phonon modes are responsible for the enhanced dielectric response of doped samples compared to pure zirconia.

  2. 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.

  3. First-Principles Investigations of Pb Anti-Site Defects in PbZrO3 and Pb(Zr, Ti)O3 Perovskites

    NASA Astrophysics Data System (ADS)

    Kagimura, Ricardo; Singh, David J.

    2008-03-01

    Lead zirconate (PZ) and lead zirconate titanate (PZT) have the perovskite type structure, ABO3. Bivalent lead (Pb^+2) ions occupy the A site, while tetravalent titanium and zirconium (Zr^+4, Ti^+4) ions occupy the B site at random of the PZT solid solution. Also, lead can be tetravalent (Pb^+4), such as in PbO2 structure. Recent experimental work has reported that tetravalent Pb ions can locate at the B site of the PZT perovskite forming a lead zirconate-titanate-plumbate solid solution. The experimental results suggest that, based on a PbZrO3-PbTiO3-PbPbO3 ternary solution phase diagram [G. Suchaneck et al., Ferroelectrics 318, 3 (2005)], the substitutional Pb atom prefers to occupy the Zr site instead of the Ti one. In this work, we report density functional supercell calculations for pure PbZrO3 perovskite and for ordered Pb(Zr1/2Ti1/2)O3 solid solution with different configurations for the Zr and Ti atoms. We investigate the anti-site defect energies and the effects on the electronic structure.

  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. The effect of C content on the mechanical properties of Ti-Zr coatings.

    PubMed

    Rodríguez-Hernández, M G; Jiménez, O; Alvarado-Hernández, F; Flores, M; Andrade, E; Canto, C E; Ávila, C; Espinoza-Beltrán, F

    2015-09-01

    In this study, Ti-Zr and Ti-Zr-C coatings were deposited at room temperature via pulsed-DC magnetron sputtering. A 70Ti-30Zr at% target and a 99.99% graphite plate were used to deposit samples. In order to modify C content, coatings were deposited at different target powers such as 50, 75 and 100 W. Changes on the structure, microstructure and mechanical properties due to C addition were studied. Results indicate that the as-deposited coatings were partly crystalline and that an increment on C content stabilized α' phase and inhibited the appearance of ω precipitates. Therefore, Ti-Zr-C alloys with C>1.9 at% showed only α' phase whereas the others alloys exhibited α'+ω structures. Hardness values from 12.94 to 34.31 GPa were obtained, whereas the elastic modulus was found between 181.84 and 298 GPa. Finally, a high elastic recovery ratio (0.69-0.87) was observed as a function of composition. The overall properties of these coatings were improved due to C content increment, martensitic α' phase and nanocrystalline grain size (10-16 nm). PMID:26056996

  6. Synthesis of Li 2MO 3 ( M = Ti or Zr) by the combustion method

    NASA Astrophysics Data System (ADS)

    Cruz, Daniel; Pfeiffer, Heriberto; Bulbulian, Silvia

    2006-05-01

    The advantages and disadvantages of the combustion method to prepare Li 2TiO 3 and Li 2ZrO 3 ceramics were studied. Firstly, the ceramic powders were prepared by the combustion process using LiOH, MO 2 (where M = Ti or Zr) and urea in different molar ratios (from 2:1:3 to 3:1:3) at different temperatures for 5 minutes. Li 2TiO 3 and Li 2ZrO 3 were also obtained by the solid-state method, and the results were compared with those obtained by the combustion process. The powders were characterized by X-ray diffraction and scanning electron microscopy. It was found that the combustion process reduces the synthesis time of Li 2TiO 3 (1 minute at 750 °C), but it does not have any advantage on producing Li 2ZrO 3, due to thermodynamic factors. On the other hand, the combustion process produces carbon contaminants in the solids. It was necessary to add excess of lithium hydroxide, in order to compensate the quantity of Li sublimated during the production of the ceramics. Finally, it seems that both reactions follow the same mechanism, which is determined by the lithium diffusion into the metal oxides.

  7. 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.

  8. Development and intrinsic properties of hexagonal ferromagnetic (Zr,Ti)Fe{sub 2}

    SciTech Connect

    Zhang, W. Y. Skomski, R.; Sellmyer, D. J.; Li, X. Z.; Valloppilly, S.; Shield, J. E.

    2014-05-07

    Nanocrystalline Ti{sub 0.75}Zr{sub 0.25}Fe{sub 2+x} (x = 0-0.4) and Ti{sub 0.75−y}B{sub y}Zr{sub 0.25}Fe{sub 2.4} (y = 0-0.35) with high saturation magnetization have been fabricated by the melt-spinning technique. Nanocrystalline Ti{sub 0.75}Zr{sub 0.25}Fe{sub 2+x} consists of the hexagonal C14 Laves phase (Ti,Zr)Fe{sub 2}. Fe addition decreases the lattice parameter a and shrinks the cell volume. The antiferromagnetic Fe-Fe interactions may decrease with the increase of x, leading to a significant enhancement of saturation polarization (J{sub s}) and Curie temperature (T{sub c}). The magnetocrystalline anisotropy constant K also increases with increasing x. Excessive Fe addition (x > 0.25) may induce structural disorder which lowers the J{sub s} and T{sub c}. Nanocrystalline Ti{sub 0.75−y}B{sub y}Zr{sub 0.25}Fe{sub 2.4} is composed of hexagonal (Ti,Zr)Fe{sub 2} and Fe-rich amorphous phases with relatively high J{sub s}. The lattice parameters a, c and cell volume V are almost unchanged with the increase of y for y ≥ 0.16. Simultaneously, the T{sub c} of (Ti,Zr)Fe{sub 2} remains unchanged, indicating that B does not enter this lattice but takes part in forming the amorphous phase, in good agreement with the X-ray diffraction results. The volume fraction of the amorphous phase increases with the increase of B content and results in a large enhancement of J{sub s} up to 10.8 kG. Further B addition (y > 0.30) decreases J{sub s}, possibly due to the decrease of the J{sub s} of the amorphous phase.

  9. 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

  10. 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.

  11. 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. PMID:26297184

  12. Temperature dependence of Zr and Ti K-edge XANES spectra for para- and ferro-electric perovskite-type PbZrO3, PbTiO3 and BaTiO3

    NASA Astrophysics Data System (ADS)

    Yoshiasa, A.; Nakatani, T.; Hiratoko, T.; Tobase, T.; Nakatsuka, A.; Okube, M.; Arima, H.; Sugiyama, K.

    2016-05-01

    Zr and Ti K-edge XANES spectra of PbZrO3, PbTiO3 and BaTiO3 perovskite-type compounds were measured in the temperature range from 10K to 850K. Quantitative comparisons for the near-edge spectra were performed in a wide temperature range using the absorption intensity invariant point (AIIP) standardization. Clear temperature dependence for pre-edge shoulder is identified by the calculating the temperature difference of the XANES spectrum intensity. Decrease of pre-edge shoulder and peak intensity is observed only in the para- and ferro-electric phases and draw curves, not straight lines. The gradients for shoulder and pre-edge peak intensity are rich in a variety. The decrease in absorption of pre-edge peak and shoulder is speculated due to the shift from the off-centre position of the Zr atom with respect to the oxygen octahedron to center position. The Zr ion in the PbZrO3 para-electric phase has same temperature behaviors of Ti ions in the ferroelectric perovskite.

  13. 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.

  14. 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.

  15. 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. PMID:21889399

  16. Thermal Evaporation Loss Measurements on Quasicrystal (Ti-Zr-Ni) and Glass Forming (Vit 106 and Vit 106a) Liquids

    NASA Astrophysics Data System (ADS)

    Blodgett, M. E.; Gangopadhyay, A. K.; Kelton, K. F.

    2015-04-01

    Thermal evaporation loss measurements made using the electrostatic levitation (ESL) technique for one binary Ti-Zr, two ternary Ti-Zr-Ni, and two glass-forming (Vit 106 and Vit 106a) alloy liquids are reported. The containerless environment enables measurements not only for the equilibrium liquids but also for the metastable supercooled liquids. The data follow the Langmuir equation when the activity coefficient of the solute atoms, a measure for the deviation from the ideal solution behavior, is taken into account. An estimate for the activity coefficient of Ni in the Ti-Zr liquid is made from these data, demonstrating the effectiveness of ESL for such measurements.

  17. Physical properties modulation of Fe3O4/Pb(ZrTi)O3 heterostructure via Fe diffusion

    NASA Astrophysics Data System (ADS)

    Chichvarina, O.; Herng, T. S.; Ding, J.

    2016-03-01

    The manipulation of material properties in perovskite oxide heterojunctions has been increasingly studied, owing to their interacting lattice, charge, spin and orbital degrees of freedom. In this work, the switching, ferroelectricity and magneto-transport properties of epitaxially grown perovskite Pb(Zr0.52Ti0.48)O3 layers sandwiched between Fe3O4 (top electrode) and SrRuO3 (bottom electrode) are investigated. These films show a typical ferroelectric polarization of ˜50 μC/cm2. Once the Pb(Zr0.52Ti0.48)O3 films become thinner (˜30 nm), one can set (reset) the Fe3O4/Pb(Zr0.52Ti0.48)O3/SrRuO3 structures into a low (high) resistance state via formation (rupture) of an Fe-related filament in Pb(Zr0.52Ti0.48)O3 through manipulation of an electric field. Interestingly, at the low-resistance state, a prominent magnetoresistance signal of ˜3% was observed. There is no magnetoresistance signal detected in the virgin Pb(Zr0.52Ti0.48)O3 film (before switching), high-resistive state Pb(Zr0.52Ti0.48)O3 film and Au/Pb(Zr0.52Ti0.48)O3/SrRuO3. These phenomena are attributed to the diffusion of Fe-related ions into the Pb(Zr0.52Ti0.48)O3 film, turning a non-magnetic and insulating layer of perovskite Pb(Zr0.52Ti0.48)O3 into a magnetic and semiconducting-like Pb(Zr0.52Ti0.48)O3. The magneto-transport properties of Fe3O4/Pb(Zr0.52Ti0.48)O3/SrRuO3 have been studied extensively. Such resistance-ferroelectric-ferromagnetic coupling in a single compound paves the way to the realization of a non-volatile multiple-state Pb(ZrTi)O3 hybrid memory, as well as new computing approaches.

  18. 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. PMID:25659946

  19. Multifunctional Ti-(Ca,Zr)-(C,N,O,P) films for load-bearing implants.

    PubMed

    Shtansky, D V; Gloushankova, N A; Bashkova, I A; Kharitonova, M A; Moizhess, T G; Sheveiko, A N; Kiryukhantsev-Korneev, F V; Petrzhik, M I; Levashov, E A

    2006-07-01

    Films of Ti-Ca-P-C-O-(N), Ti-Ca-C-O-(N) and Ti-Zr-C-O-(N) were deposited by DC magnetron sputtering or ion implantation-assisted magnetron sputtering of composite targets TiC0.5 + 10%Ca10(PO4)6(OH)2, TiC0.5 + 20%(CaO + TiO2) and TiC0.5 + 10%ZrO2 in an Ar atmosphere or reactively in a gaseous mixture of Ar + 14%N2. The microstructure, elemental and phase composition of films were studied by means of X-ray diffraction, transmission electron microscopy, scanning force microscopy, X-ray photoelectron spectroscopy and energy-dispersive X-ray spectroscopy. The films were characterized in terms of their hardness, Young's modulus, elastic recovery, adhesion strength, and friction and wear both in air and under physiological solution. Particular attention was paid to the analysis of deformation and fracture for various film/substrate systems during scratch testing. The biocompatibility of the films was evaluated by both in vitro and in vivo experiments. In vitro studies involved the investigation of adhesion, spreading, and proliferation of MC3T3-E1 osteoblasts and IAR-2 epithelial cells, morphometric analysis, actin cytoskeleton, focal contacts staining, alkaline phosphatase activity and von Kossa staining of osteoblastic culture. Cell culture experiments demonstrated an increase of osteoblastic proliferation on Ca- and P-incorporated films. In vivo studies were fulfilled by subcutaneous implantation of Teflon plates coated with the tested films in mice and analysis of the population of adherent cells on their surfaces. The results obtained show that multicomponent nanostructured Ti-(Ca, Zr)-(C, N, O, P) films possess a combination of high hardness, wear resistance and adhesion strength, reduced Young's modulus, low friction coefficient and high biocompatibility. PMID:16530825

  20. Effect of ZrO2 addition on the mechanical properties of porous TiO2 bone scaffolds.

    PubMed

    Tiainen, Hanna; Eder, Georg; Nilsen, Ola; Haugen, Håvard J

    2012-08-01

    This study aimed at the investigation of the effect of zirconium dioxide (ZrO2) addition on the mechanical properties of titanium dioxide (TiO2) bone scaffolds. The highly biocompatible TiO2 has been identified as a promising material for bone scaffolds, whereas the more bioinert ZrO2 is known for its excellent mechanical properties. Ultra-porous TiO2 scaffolds (>89% porosity) were produced using polymer sponge replication with 0-40 wt.% of the TiO2 raw material substituted with ZrO2. Microstructure, chemical composition, and pore architectural features of the prepared ceramic foams were characterised and related to their mechanical strength. Addition of 1 wt.% of ZrO2 led to 16% increase in the mean compressive strength without significant changes in the pore architectural parameters of TiO2 scaffolds. Further ZrO2 additions resulted in reduction of compressive strength in comparison to containing no ZrO2. The appearance of zirconium titanate (ZrTiO4) phase was found to hinder the densification of the ceramic material during sintering resulting in poor intergranular connections and thus significantly reducing the compressive strength of the highly porous ceramic foam scaffolds. PMID:24364936

  1. Origin of nondetectable x-ray diffraction peaks in nanocomposite CuTiZr alloys

    NASA Astrophysics Data System (ADS)

    Jiang, J. Z.; Kato, H.; Ohsuna, T.; Saida, J.; Inoue, A.; Saksl, K.; Franz, H.; Stâhl, K.

    2003-10-01

    Microscopic structures of Cu60Ti10+xZr30-x (x=0 and 10) alloys have been investigated by transmission electron microscopy, x-ray diffraction (XRD) and differential scanning calorimeter (DSC). In the Cu60Ti10Zr30 samples annealed at 708 K for times ranging from 0 to 130 min, where the enthalpy of the first exothermic peak decreases by 80%, the corresponding XRD patterns still look similar to that for the as-prepared sample. However, the simulated XRD patterns for the pure Cu51Zr14 phase, which is the crystalline phase formed during the first exothermic reaction, with small grain sizes and defects clearly show a broadened amorphous-like feature. This might be the reason that no diffraction peaks from the nanocrystalline component were detected in the XRD patterns recorded for the as-cast or as-spun Cu60Ti10+xZr30-x (x=0 and 10) alloys and for the alloys annealed at lower temperatures, in which the enthalpy of the first exothermic peak has a significant reduction. The second exothermic peak found in DSC curves is due to the formation of another hexagonal phase, spacing group P63/mmc (194) and lattice parameters a=5.105 Å and c=8.231 Å.

  2. A conjoint XRD-ND analysis of the crystal structures of austenitic and martensitic Ti 0.64Zr 0.36Ni hydrides

    NASA Astrophysics Data System (ADS)

    Cuevas, F.; Latroche, M.; Bourée-Vigneron, F.; Percheron-Guégan, A.

    2006-11-01

    The crystal structures of the hydrides of austenitic and martensitic Ti 0.64Zr 0.36Ni alloy have been investigated by conjoint X-ray diffraction (XRD)-neutron diffraction (ND) analysis. Austenitic Ti 0.64Zr 0.36Ni alloy with cubic CsCl-type structure preserves its metal sublattice structure after deuteration. It forms a Ti 0.64Zr 0.36NiD 1.5 deuteride with D-atoms occupying half of the octahedrally coordinated 3 d sites. On the contrary, the monoclinic TiNi-type structure of martensitic Ti 0.64Zr 0.36Ni alloy is modified after deuterium absorption. At P=103 Pa and T=298 K, two deuterides coexist with orthorhombic CrB-type structure for the metal sublattice and compositions Ti 0.64Zr 0.36NiD ( β-deuteride) and Ti 0.64Zr 0.36NiD 2.6 ( γ-deuteride). For the β-monodeuteride, deuterium atoms are tetrahedrally coordinated by (Ti,Zr) atoms. For the γ-deuteride, D-atoms fully occupy tetrahedrally coordinated (Ti,Zr) 3Ni 8 f sites and partially occupy pyramidal (Ti,Zr) 3Ni 2 4 c sites. At higher pressures, deuterium solution occurs in the γ-phase with a partial occupancy of octahedrally coordinated (Ti,Zr) 2Ni 4 4 a sites.

  3. Secondary Electron Yield Measurements of TiN coating and TiZrV getter film(LCC-128)

    SciTech Connect

    Le Pimpec, F

    2003-10-09

    In the beam pipe of the positron Main Damping Ring (MDR) of the Next Linear Collider (NLC), ionization of residual gases and secondary electron emission give rise to an electron cloud which can cause the loss of the circulating beam. One path to avoid the electron cloud is to ensure that the vacuum wall has low secondary emission yield and, therefore, we need to know the secondary emission yield (SEY) for candidate wall coatings. We report on SEY measurements at SLAC on titanium nitride (TiN) and titanium-zirconium-vanadium (TiZrV) thin sputter deposited films, as well as describe our experimental setup.

  4. Investigation of the peptide adsorption on ZrO2, TiZr, and TiO2 surfaces as a method for surface modification.

    PubMed

    Micksch, Tina; Liebelt, Nora; Scharnweber, Dieter; Schwenzer, Bernd

    2014-05-28

    Specific surface binding peptides offer a versatile and interesting possibility for the development of biocompatible implant materials. Therefore, eight peptide sequences were examined in regard to their adsorption on zirconium oxide (ZrO2), titanium zircon (TiZr), and titanium (c.p. Ti). Surface plasmon resonance (SPR) measurements were performed on Ti coated sensor chips to determine the kinetics of the interactions and kinetic rate constants (kon, koff, KD, and Rmax). We also investigated the interactions which are present in our system. Electrostatic and coordinative interactions were found to play a major role in the adsorption process. Four of the eight examined peptide sequences showed a significant adsorption on all investigated materials. Moreover, the two peptides with the highest adsorption could be quantified (up to 370 pmol/cm(2)). For potential biomaterials applications, we proved the stability of the adsorption of selected peptides in cell culture media, under competition with proteins and at body temperature (37 °C), and their biocompatibility via their effects on the adhesion and proliferation of human mesenchymal stem cells (hMSCs). The results qualify the peptides as anchor peptides for the biofunctionalization of implants. PMID:24735333

  5. 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. PMID:21514799

  6. Decomposition of a solid solution in the ω phase of the Ti-Zr system under high pressure

    NASA Astrophysics Data System (ADS)

    Bashkin, I. O.; Shestakov, V. V.; Sakharov, M. K.; Fedotov, V. K.; Ponyatovskiĭ, E. G.

    2008-07-01

    Phase separation in the hexagonal ω modification of the Ti-Zr system was observed. The ω → ω1 + ω2 decomposition in an equiatomic TiZr alloy after prolonged thermal treatment at P = 5.5 ± 0.6 GPa and T = 440 ± 30°C was revealed using x-ray diffraction. It is found that the concentration dependence of the specific volume of the ω phase of Ti-Zr alloys deviates from the Vegard law to higher values. An isobaric section of the equilibrium P- T- x phase diagram of the Ti-Zr system is shown to have the shape of an eutectoid diagram at pressures higher than 8 GPa.

  7. 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.

  8. 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).

  9. Hydrogen absorption by Zr-1Nb alloy with TiNx film deposited by filtered cathodic vacuum arc

    NASA Astrophysics Data System (ADS)

    Kashkarov, E. B.; Nikitenkov, N. N.; Syrtanov, M. S.; Babihina, M. N.

    2016-02-01

    coating for Zr-2.5Nb alloy from hydrogenation. Dense TiNx films were prepared by filtered cathodic vacuum arc (CVA). Hydrogen absorption rate was calculated from the kinetic curves of hydrogen sorption at elevated temperature of the sample (T = 673 K) and pressure (P = 2 atm). Results revealed that TiNx films significantly reduced hydrogen absorption rate of Zr-2.5Nb.

  10. Formation ranges of icosahedral, amorphous and crystalline phases in rapidly solidified Ti-Zr-Hf-Ni alloys

    SciTech Connect

    Chen, N. . E-mail: asyzxy@imr.edu; Louzguine, D.V.; Ranganathan, S.; Inoue, A.

    2005-02-01

    From the quaternary Ti-Zr-Hf-Ni phase diagram, the cross-section at 20 at.% Ni was selected for investigation. The icosahedral quasicrystalline, crystalline and amorphous phases were observed to form in nine kinds of rapidly solidified (Ti{sub x}Zr{sub y}Hf{sub z}){sub 80}Ni{sub 20} (x + y + z = 1) alloys at different compositions. The quasilattice constants of 0.519 and 0.531 nm were obtained for the icosahedral phase formed in the melt-spun Ti{sub 40}Zr{sub 20}Hf{sub 20}Ni{sub 20} and Ti{sub 20}Zr{sub 40}Hf{sub 20}Ni{sub 20} alloys, respectively. The icosahedral phase formed in the melt-spun Ti{sub 40}Zr{sub 20}Hf{sub 20}Ni{sub 20} alloy especially is thermodynamically stable. The supercooled liquid region of the Ti{sub 20}Zr{sub 20}Hf{sub 40}Ni{sub 20} glassy alloy reached 64 K. From these results a comparison of quasicrystal-forming and glass-forming abilities was carried out. The quasicrystal-forming ability was reduced and glass-forming ability was improved with an increase in Hf and Zr contents in the (Ti{sub x}Zr{sub y}Hf{sub z}){sub 80}Ni{sub 20} alloys. On the other hand, an increase in Ti content caused an improvement in quasicrystal-forming ability.

  11. Zr-shift at the origin of the exceptional piezoelectric properties of PbZr0.52Ti0.48O3

    NASA Astrophysics Data System (ADS)

    Al-Zein, A.; Fraysse, G.; Rouquette, J.; Papet, Ph.; Haines, J.; Hehlen, B.; Levelut, C.; Aquilanti, G.; Joly, Y.

    2010-05-01

    In spite of intensive experimental and theoretical studies, no model at the atomic scale has been proposed to explain the large piezoelectric effect in PbZr0.52Ti0.48O3 (PZT) compared to the low piezoelectric response in the simple end-member lead titanate PbTiO3 . X-ray absorption spectroscopy (XAS) appears as the technique of choice not only to clarify the role of Zr, but also to quantify the Zr displacement through the Ferroelectric-Paraelectric (F-P) transition. We clearly show evidence of the polar character of the Zr-atoms in PZT with a Zr-shift which will produce a small polarization. Such an atomic configuration for one type of atoms leads to relatively easy switching, i.e., relatively low electric field to align the Zr-polar atoms, which will create a favorable energetic situation for the cooperative switching of the strongly polar Ti-O dipole and would therefore account for the large piezoelectric effect in PZT.

  12. Photo-induced and electrooptic properties of (Pb,La)(Zr,Ti)O{sub 3} films

    SciTech Connect

    Dimos, D.; Warren, W.L.; Tuttle, B.A.

    1993-07-01

    Photo-induced changes in the hysteresis behavior of sol-gel derived Pb(Zr,Ti)O{sub 3} (PZT) and (Pb,La)(Zr,Ti)O{sub 3} (PLZT) films have been characterized. Film photosensitivity has been evaluated with respect to magnitude of effects, time response and spectral dependence. Photo-induced hysteresis changes exhibit a stretched-exponential time dependence, which implies a dispersive mechanism. The spectral dependence is strongly peaked at the band edge ({approximately} 3.4 eV), which indicates that generation of electron-hole pairs in the material is critical. The photo-induced hysteresis changes are reproducible and stable, which indicates that the controlling charge traps are stable. However, improvements in film photosensitivity will be required to develop these materials for optical memory applications.

  13. 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.

  14. Structure and transformations of metastable phases. in Zr-Nb and Ti-V alloys

    NASA Astrophysics Data System (ADS)

    Cuello, G. J.; Aurelio, G.; Fernández Guillermet, A.; Campo, J.

    An experimental study is presented of the effect of an isothermal heat treatment (`aging') upon the structural properties of three metastable phases in Zr-Nb and Ti-V alloys, viz. α (hcp), β (bcc) and Ω, formed by quenching the alloys from 1273 K. Using neutron-diffraction experiments, the constitution of the aged alloys and the structural parameters of the resulting aged phases were determined. By combining lattice-parameter measurements with previously established correlations in the Zr-Nb and Ti-V systems, new information on the composition of the aged phases was obtained. For long aging times the α and β phases seem to be approaching equilibrium conditions, which opens up the possibility of using quenching-and-aging experiments to gain insight into the metastable phase diagram of these systems, which is not accurately known from experiments.

  15. Phase Diagram of Pb(Zr,Ti)O{sub 3} Solid Solutions from First Principles

    SciTech Connect

    Kornev, Igor A.; Bellaiche, L.; Janolin, P.-E.; Dkhil, B.; Suard, E.

    2006-10-13

    A first-principles-derived scheme that incorporates ferroelectric and antiferrodistortive degrees of freedom is developed to study finite-temperature properties of Pb(Zr{sub 1-x}Ti{sub x})O{sub 3} solid solution near its morphotropic phase boundary. The use of this numerical technique (i) resolves controversies about the monoclinic ground state for some Ti compositions (ii) leads to the discovery of an overlooked phase, and (iii) yields three multiphase points that are each associated with four phases. Additional neutron diffraction measurements strongly support some of these predictions.

  16. 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.

  17. Nqrs Data for Al10Cu20Ni8Ti3Zr59 (Subst. No. 0110)

    NASA Astrophysics Data System (ADS)

    Chihara, H.; Nakamura, N.

    This document is part of Subvolume A `Substances Containing Ag … C10H15' of Volume 48 `Nuclear Quadrupole Resonance Spectroscopy Data' of Landolt-Börnstein - Group III `Condensed Matter'. It contains an extract of Section `3.2 Data tables' of the Chapter `3 Nuclear quadrupole resonance data' providing the NQRS data for Al10Cu20Ni8Ti3Zr59 (Subst. No. 0110)

  18. [Animal experiment study of titanium with surface coatings of (Ti,Nb)ON and (Ti,Zr)O].

    PubMed

    Thull, R; Handke, K D; Karle, E J

    1995-10-01

    Titanium is considered to be biocompatible as long as the passive layer of TiO2 which is formed within the body, is not destroyed mechanically by the shearing forces acting on implants during function. Mechanically stable hard coatings on the basis of the so-called refractory metals render titanium wear-and-tear-resistant, with the added advantage for its biocompatibility of keeping its the physical and electrochemical properties constant, even in the event of relative movement against hard or soft tissue. Biological testing of coated and uncoated titanium in experimental animals shows that the deposition of new bone on (Ti,Zr)O or (Ti,Nb)ON surfaces takes place in the same way as on the surface of titanium. PMID:8527641

  19. A modular peptide-based immobilization system for ZrO2, TiZr and TiO2 surfaces.

    PubMed

    Micksch, Tina; Herrmann, Elisa; Scharnweber, Dieter; Schwenzer, Bernd

    2015-01-01

    The present study describes a novel versatile immobilization system for the modification of implant materials with biologically active molecules (BAMs), e.g. antibiotics or growth factors. Specific adsorbing peptides are used as anchor molecules to immobilize oligodesoxynucleotides (ODNs) on the implant surface (anchor strand, AS). The BAM is conjugated to a complementary ODN strand (CS) which is able to hybridize to the AS on the implant surface to immobilize the BAM. The ODN double strand allows for a controlled release of the BAM adjustable by the ODN sequence and length. The immobilization system was developed and proven on three typical implant materials, namely ZrO2, TiZr and Ti, respectively. The parathyroid hormone (PTH) fragment 1-34 was conjugated to the CS and immobilized on these different implant materials. To investigate the biological activity of the immobilized PTH, alkaline phosphatase was quantified after incubation of the osteoblast precursor cells C2C12 on the modified samples. The results demonstrate the successful immobilization of biologically active PTH (1-34) and the high potential of the established surfaces to achieve an increased osseointegration of variable implants, especially for patients with risk factors. PMID:25449919

  20. Curie temperature and high temperature behavior of Pb(Zr,Ti)O3/Pb(Zr,Ti)O3 sol-gel composites

    NASA Astrophysics Data System (ADS)

    Fujimoto, Shota; Namihira, Takao; Iwata, Kazuki; Kobayashi, Makiko

    2015-07-01

    The Curie temperature of Pb(Zr,Ti)O3/Pb(Zr,Ti)O3 (PZT/PZT) sol-gel composites was investigated empirically in order to determine the maximum operation temperature of PZT/PZT ultrasonic transducers. A PZT/PZT film was fabricated on a stainless steel substrate and the piezoelectric constant d33 and ultrasonic response were measured after 1 h heating at a specified temperature in a furnace in order to investigate the Curie temperature indirectly. It was found that the Curie temperature of PZT/PZT was between 770 and 870 K. Second, real-time monitoring of the capacitance at various temperatures was attempted in order to measure the Curie temperature directly. A PZT/PZT film was fabricated on a stainless steel substrate and the sample was placed in a furnace and then heated from RT to 870 K. Peaks in the capacitance appeared around 670 and 820 K; thus, it was concluded that a Curie temperature shift of PZT/PZT occurred around 820 K, which was 250 K higher than that of PZT powder made from the bulk material. The high-temperature ultrasonic performance was also monitored and clear reflected echoes were clearly observed at ˜724 K.

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

    SciTech Connect

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

    2012-09-15

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

  2. Mixing thermodynamics of TM1-xGdxN (TM=Ti,Zr,Hf) from first principles

    NASA Astrophysics Data System (ADS)

    Alling, B.; Höglund, C.; Hall-Wilton, R.; Hultman, L.

    2011-06-01

    The mixing thermodynamics of GdN with TiN, ZrN, and HfN is studied using first-principles methods. We find that while Ti1-xGdxN has a strong preference for phase separation due to the large lattice mismatch, Zr1-xGdxN and Hf1-xGdxN readily mix, possibly in the form of ordered compounds. In particular, ZrGdN2 is predicted to order in a rocksalt counterpart to the L11 structure at temperatures below 1020 K. These mixed nitrides are promising candidates as neutron absorbing, thermally and chemically stable, thin film materials.

  3. 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.

  4. Critical cooling rate and thermal stability of Zr--Ti--Cu--Ni--Be alloys

    SciTech Connect

    Waniuk, Theodore A.; Schroers, Jan; Johnson, William L.

    2001-02-26

    The critical cooling rate as well as the thermal stability are measured for a series of alloys in the Zr--Ti--Cu--Ni--Be system. Upon cooling from the molten state with different rates, alloys with compositions ranging along a tie line from (Zr{sub 70}Ti{sub 30}){sub 55}(Ni{sub 39}Cu{sub 61}){sub 25}Be{sub 20} to (Zr{sub 85}Ti{sub 15}){sub 55}(Ni{sub 57}Cu{sub 43}){sub 22.5}Be{sub 27.5} show a continuous increase in the critical cooling rate to suppress crystallization. In contrast, thermal analysis of the same alloys shows that the undercooled liquid region, the temperature difference between the glass transition temperature and the crystallization temperature, is largest for some compositions midway between the two endpoints, revealing that glass forming ability does not correlate with thermal stability. The relationship between the composition-dependent glass forming ability and thermal stability is discussed with reference to a chemical decomposition process.

  5. Microstructure and Characteristics of Ba(Ti,Zr)O3 Ceramics with Addition of Glass Frit

    NASA Astrophysics Data System (ADS)

    Wang, Chun-Huy

    2002-08-01

    Microstructure and characteristics of Ba(Ti,Zr)O3 ceramics are significantly influenced by the addition of 4PbO.B2O3. The melting temperature of 4PbO.B2O3 was approximately 500°C, and thus it provides a liquid phase during sintering. At low sintering temperatures, the grain growth of Ba(Ti,Zr)O3 ceramics is enhanced by capillary rearrangement and solution-reprecipitation from the liquid phase. At high sintering temperatures, exaggerated grain growth of Ba(Ti,Zr)O3 ceramics is restrained by the presence of a liquid phase. The spreading liquid can penetrate the solid-solid interfaces. Penetration leads to disintegration of the solid and the subsequent rearrangement of fragments. With increasing amounts of 4PbO.B2O3, the tetragonal c/a ratio and Curie point temperature increase, but the dielectric loss tangent is depressed. With a suitable amount of glass frit and temperature for sintering, the density is enhanced and the values of the planar coupling factor and the poled dielectric constant are improved.

  6. Stabilization of MIV = Ti, Zr, Hf, Ce, and Th using a selenium bis(phenolate) ligand.

    PubMed

    Behrle, Andrew C; Levin, Jessica R; Kim, Jee Eon; Drewett, Jonathan M; Barnes, Charles L; Schelter, Eric J; Walensky, Justin R

    2015-02-14

    We report M(iv) M = Ti, Zr, Hf, Ce, and Th, complexes of a selenium bis(phenolate) ligand, 2,2'-selenobis(4,6-di-tert-butylphenol), (H(2)(Ar)OSeO), 1. Reaction of Ti(NEt(2))(4) with two equivalents of affords Ti((Ar)OSeO)(2), 2. Salt metathesis of ZrCl(4) and HfCl(4) with two equivalents of Na(2)(Ar)OSeO produces Zr((Ar)OSeO)(2)(THF), 3, and Hf((Ar)OSeO)(2)(THF), 4, respectively. Protonolysis of ThCl[N(SiMe(3))(2)](3) with two equivalents of yields Th((Ar)OSeO)(2)(THF)(2), 5. Salt metathesis of Ce(OTf)(3) and two equivalents of Na(2)(Ar)OSeO produces [Na(THF)(3)][Ce((Ar)OSeO)(2)], which was oxidized in situ using 0.5 equivalents of I(2) to yield the diamagnetic Ce(iv) product, Ce((Ar)OSeO)(2)(THF)(2), 6. Addition of 2,2'-bipyridyl to forms Ce((Ar)OSeO)(2)(bipy), 6a. Each diamagnetic complex was characterized using (1)H, (13)C, and (77)Se NMR and IR spectroscopy and the structures of 2-6a were established with X-ray crystallography. Electrochemical measurements using cyclic voltammetry on complexes 2, 5, and 6a re also reported. PMID:25209827

  7. A theoretical study of the low-lying states of Ti2 and Zr2

    NASA Technical Reports Server (NTRS)

    Bauschlicher, Charles W., Jr.; Partridge, Harry; Langhoff, Stephen R.; Rosi, Marzio

    1991-01-01

    The low-lying states of Ti2 and the valence isoelectronic Zr2 are examined theoretically by means of a multireference configuration-interaction (MRCI) method. MRCI calculations demonstrate that two of the Zr2 states are very low-lying and that the resulting vertical excitation is consistent with the optical spectrum of Zr2. The ground state is predicted for Ti2 on the basis of valence correlation with the MRCI method and the average coupled-pair functional technique. Calculations of the inner-shell correlation effects are estimated and found to lower the 3Delta g state to a ground state, and another to a very low-lying state. The ground state of Ti2 is assigned to 3Delta g since it is lower than the other state at all levels of correlation and is derived from the same atomic asymptote. This conclusion is supported by the lack of an electron-spin resonance signal but contradicts the absence of subcomponents on the Raman spectral lines.

  8. Bioactivity of coatings formed on Ti-13Nb-13Zr alloy using plasma electrolytic oxidation.

    PubMed

    Sowa, Maciej; Piotrowska, Magdalena; Widziołek, Magdalena; Dercz, Grzegorz; Tylko, Grzegorz; Gorewoda, Tadeusz; Osyczka, Anna M; Simka, Wojciech

    2015-04-01

    In this work, we investigated the bioactivity of anodic oxide coatings on Ti-13Nb-13Zr alloy by plasma electrolytic oxidation (PEO) in solutions containing Ca and P. The bioactive properties of the films were determined by immersion in simulated body fluid (SBF), and their biocompatibility was examined using adult human bone marrow derived mesenchymal stem cells (hBMSCs). The oxide layers were characterised based on their surface morphology (SEM, AFM, profilometry) as well as on their chemical and phase compositions (EDX, XRF, XRD, XPS). We report that anodic oxidation of Ti-13Nb-13Zr led to the development of relatively thick anodic oxide films that were enriched in Ca and P in the form of phosphate compounds. Furthermore, the treatment generated rough surfaces with a significant amount of open pores. The surfaces were essentially amorphous, with small amounts of crystalline phases (anatase and rutile) being observed, depending on the PEO process parameters. SBF soaking led to the precipitation of small crystals after one week of experiment. During culturing of hBMSCs on the bioactive Ti-13Nb-13Zr surfaces the differentiation of human mesenchymal stem cells toward osteoblasts was promoted, which indicated a potential of the modified materials to improve implant osseointegration. PMID:25686936

  9. The structural, electronic and magnetic properties of quaternary Heusler alloy TiZrCoIn

    NASA Astrophysics Data System (ADS)

    Yan, Peng-Li; Zhang, Jian-Min; Xu, Ke-Wei

    2016-04-01

    Employing the first-principles calculations, we have investigated the structural, electronic and magnetic properties of quaternary Heusler alloy TiZrCoIn. The TiZrCoIn alloy with type (I) configuration is predicted to be half-metallic ferromagnet at its equilibrium lattice constant 6.525 Å with an indirect band gap of 0.930 eV in minority spin channel. The total magnetic moment is 2 μB/f.u., following the Slater-Pauling rule μt=Zt-18. Moreover, the negative formation energy indicates the thermodynamical stability of this alloy. The band gap of minority spin channel is determined by the bonding (t2g) and antibonding (t1u) states created from the hybridizations of the d states of transition metal atoms Ti, Zr and Co. In addition, the HM, character is kept as hydrostatic strain ranged from -10% to 7.6% and tetragonal strain ranged from -19% to 27%.

  10. Structural and electronic properties of Sr(Zr,Ti)O3 alloys for use in oxide heterostructures

    NASA Astrophysics Data System (ADS)

    Weston, Leigh; Janotti, Anderson; Cui, Xiangyuan; Himmetoglu, Burak; Stampfl, Catherine; van de Walle, Chris G.

    Sr(Ti,Zr)O3 alloys are promising materials for use in oxide heterostructures, however the fundamental properties of this system have not yet been characterized. Using hybrid density functional calculations, we study the electronic and structural properties of ordered SrTixZr1-xO3 alloys at x=0, 0.25, 0.5, 0.75, and 1. As Ti is added to SrZrO3, the lattice parameter is reduced according to Vegard's law, while the band gap shows a large bowing and is sensitive to the Ti distribution. For x=0.5, arranging the Ti and Zr atoms into a 1 ×1 SrZrO3/SrTiO3 superlattice along the [001] direction leads to a highly dispersive single band at the conduction-band minimum (CBM) that is absent in the parent compounds, and a direct gap close to that of pure SrTiO3. This is explained by the splitting of the Ti 3 d t2 g states in the reduced symmetry of the superlattice, lowering the band originating from the Ti 3dxy orbitals. The lifting of the orbital degeneracy around the CBM suppresses scattering due to electron-phonon interactions. We propose that short-period SrZrO3/SrTiO3 superlattices could be exploited to engineer the band structure and improve carrier mobility compared to bulk SrTiO3. This work was supported by NSF, ONR and ARC.

  11. 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.

  12. Gradient stress induced coexistence of tetragonal and rhombohedral phases in Pb(Zr,Ti)O 3 films

    NASA Astrophysics Data System (ADS)

    Li, Liben; Chen, Qingdong; Li, Xinzhong; Hu, Zhixiang; Zhen, Zhiqiang

    2009-05-01

    Thermodynamic theory has been used to explain quantitatively the coexistence of tetragonal and rhombohedral phases in Zr-rich Pb(Zr, Ti)O 3 (PZT) films grown on a compressive substrate. The key is to consider a set of gradient thermal stresses imposed on the films. The “stress-temperature” phase diagrams were developed for PZT films of several different compositions (Ti/Zr=20/80, 30/70, 40/60, 50/50). The characteristic feature of the phase diagrams for Zr-rich PZT films is the coexistence of tetragonal and rhombohedral phases in the compressive stress region. The volume fractions of the rhombohedral phase were calculated for the Zr-rich PZT films grown on MgO substrate. The result agrees with the experiment.

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

    NASA Astrophysics Data System (ADS)

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

    2014-01-01

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

  14. 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.

  15. 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.

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

    PubMed Central

    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. PMID:24369051

  17. 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. PMID:20876964

  18. 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.

  19. 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%.

  20. 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.

  1. Ab-initio study of Pb antisite defects in PbZrO3 and Pb(Zr,Ti)O3

    SciTech Connect

    Kagimura, Ricardo; Singh, David J

    2008-01-01

    We report an ab initio study of Pb antisite defects in PbZrO{sub 3} (PZ) and Pb(Zr,Ti)O{sub 3} (PZT) perovskites. Also, we calculated the enthalpy of formation of PZ. Our results show that, under strong oxidizing conditions, Pb on the Zr-site antisite defects are unavoidable in PZ. Moreover, a positive enthalpy of formation (0.15 eV) of PZ is found. This indicates that PZ is metastable for low temperature and may help explain the difficulty in synthesizing high-quality Zr-rich PZT crystals. The Pb antisite defects in PZT alloys have low formation energies. This result is in agreement with experiments, which report the predominance of this defect in PZT films. We find that the Pb antisite defect produces electron traps 0.2-0.8 eV below the conduction-band edge.

  2. Structural properties and stability of Zr and Ti germanosilicides formed by rapid thermal annealing

    NASA Astrophysics Data System (ADS)

    Aubry-Fortuna, V.; Chaix-Pluchery, O.; Fortuna, F.; Hernandez, C.; Campidelli, Y.; Bensahel, D.

    2002-04-01

    Because of their good ohmic and rectifying properties, silicides are routinely used in Si technology. This approach has been recently extended to the novel devices produced using Si1-xGex alloys. Here, we study the Zr and Ti germanosilicides produced in the low thermal budget contact formation during Si/Si1-xGex heterodevice processing. Phase formation was monitored by combining a range of spectrometries with electron microscopy and x-ray diffraction techniques, while sheet resistance measurements allowed correlation of phase formation with film conductance. After completion of the reaction, the final crystalline phase was either C49-Zr(Si1-yGey)2 in the entire Ge composition (x) range, or C54-Ti(Si1-yGey)2 in the Ge composition range 0-0.47. In the Zr-Si-Ge system, the C49-Zr(Si1-yGey)2 formation temperature (Tf) decreases as x increases, and films formed at this temperature are continuous. Excess heating (above Tf) produces islanded films with embedded grains. A most significant feature of the results was that no Ge segregation was detected at any annealing temperature and that the Ge content in the C49 phase (y) remained equal to x for all x. This is in contrast to results on the C54-Ti(Si1-yGey)2 films, which were discontinuous when x>0.10, and in which Ge segregation occurred in the form of Ge-rich SiGe decorations separating the germanosilicide grains. The Ge content in the final C54 phase (y) was always lower than the value of x in the initial SiGe alloy, and the measured sheet resistance of the corresponding contacts was large. Our results indicate that the alloys formed between Zr and Si1-xGex are good candidates as stable contacts on Si1-xGex, and hence that Zr should be preferred for contacting in Ge-rich SiGe-based applications.

  3. 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

  4. Histomorphometric and histologic evaluation of titanium-zirconium (aTiZr) implants with anodized surfaces.

    PubMed

    Sharma, Ajay; McQuillan, A James; Shibata, Yo; Sharma, Lavanya A; Waddell, John Neil; Duncan, Warwick John

    2016-05-01

    The choice of implant surface has a significant influence on osseointegration. Modification of TiZr surface by anodization is reported to have the potential to modulate the osteoblast cell behaviour favouring more rapid bone formation. The aim of this study is to investigate the effect of anodizing the surface of TiZr discs with respect to osseointegration after four weeks implantation in sheep femurs. Titanium (Ti) and TiZr discs were anodized in an electrolyte containing DL-α-glycerophosphate and calcium acetate at 300 V. The surface characteristics were analyzed by scanning electron microscopy, electron dispersive spectroscopy, atomic force microscopy and goniometry. Forty implant discs with thickness of 1.5 and 10 mm diameter (10 of each-titanium, titanium-zirconium, anodized titanium and anodized titanium-zirconium) were placed in the femoral condyles of 10 sheep. Histomorphometric and histologic analysis were performed 4 weeks after implantation. The anodized implants displayed hydrophilic, porous, nano-to-micrometer scale roughened surfaces. Energy dispersive spectroscopy analysis revealed calcium and phosphorous incorporation into the surface of both titanium and titanium-zirconium after anodization. Histologically there was new bone apposition on all implanted discs, slightly more pronounced on anodised discs. The percentage bone-to-implant contact measurements of anodized implants were higher than machined/unmodified implants but there was no significant difference between the two groups with anodized surfaces (P > 0.05, n = 10). The present histomorphometric and histological findings confirm that surface modification of titanium-zirconium by anodization is similar to anodised titanium enhances early osseointegration compared to machined implant surfaces. PMID:26970768

  5. Structural characterization and photocatalytic activity of hollow binary ZrO{sub 2}/TiO{sub 2} oxide fibers

    SciTech Connect

    Wu Baochao; Yuan Rusheng Fu Xianzhi

    2009-03-15

    The formation of hollow binary ZrO{sub 2}/TiO{sub 2} oxide fibers using mixed precursor solutions was achieved by activated carbon fibers templating technique combined with solvothermal process. The samples were characterized by scanning electron microscopy (SEM), transmission electron microscopy (TEM), X-ray diffraction (XRD), N{sub 2} adsorption, X-ray photoelectron spectroscopy (XPS), UV-vis, and infrared (IR) spectroscopy. The binary oxide system shows the anatase-type TiO{sub 2} and tetragonal phase of ZrO{sub 2}, and the introduction of ZrO{sub 2} notably inhibits the growth of TiO{sub 2} nanocrystallites. Although calcined at 575 deg. C, all hollow ZrO{sub 2}/TiO{sub 2} fibers exhibit higher surface areas (>113 m{sup 2}/g) than pure TiO{sub 2} hollow fibers. The Pyridine adsorption on ZrO{sub 2}/TiO{sub 2} sample indicates the presence of stronger surface acid sites. Such properties bring about that the binary oxide system possesses higher efficiency and durable activity stability for photodegradation of gaseous ethylene and trichloromethane than P25 TiO{sub 2}. In addition, the macroscopic felt form for the resulting materials is more beneficial for practical applications than traditional catalysts forms. - Graphical abstract: The final ZrO{sub 2}/TiO{sub 2} products composed of hollow fibers are in the form of felt on the centimeter scale and possess certain strength and flexibleness. Moreover, they exhibit excellent efficiency and durable activity stability for photodegradation of gaseous ethylene and trichloromethane, reaching about 136% and 387% of the P25 activity after 10 h, respectively.

  6. 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

  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. PMID:26773649

  8. 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. PMID:25175186

  9. 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.

  10. Interaction of Al2O3-ZrO2 fibers with a Ti-Al matrix during pressure casting

    NASA Astrophysics Data System (ADS)

    Nourbakhsh, S.; Liang, F. L.; Margolin, H.

    1990-01-01

    Electron and optical electron microscopy, together with energy dispersive X-ray (EDX) chemical microanalysis, were employed to examine the microstructure of a pressure-cast composite consisting of a Ti-48.4 at. pct Al-1 at. pct Mn matrix reinforced with DuPont’s PRD-166 A12O3 fibers containing 20 wt pct partially stabilized ZrO2. The originally cylindrical fibers were found to have a scalloped surface, and a zone just below the surface was free of ZrO2. In addition, the fibers contained entrapped TiAl, and a small portion of the fiber periphery was covered by ZrO2 particles, which were free of the Y2O3 and HfO2 oxides present in the ZrO2 within the fibers. The matrix consisted of a mixture of TiAl and a lamellar structure of TiAl and Ti3Al and contained Zr not originally present in the matrix alloy. An analysis of the origin of this microstructure is presented.

  11. 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.

  12. Bone bonding bioactivity of Ti metal and Ti-Zr-Nb-Ta alloys with Ca ions incorporated on their surfaces by simple chemical and heat treatments.

    PubMed

    Fukuda, A; Takemoto, M; Saito, T; Fujibayashi, S; Neo, M; Yamaguchi, S; Kizuki, T; Matsushita, T; Niinomi, M; Kokubo, T; Nakamura, T

    2011-03-01

    Ti15Zr4Nb4Ta and Ti29Nb13Ta4.6Zr, which do not contain the potentially cytotoxic elements V and Al, represent a new generation of alloys with improved corrosion resistance, mechanical properties, and cytocompatibility. Recently it has become possible for the apatite forming ability of these alloys to be ascertained by treatment with alkali, CaCl2, heat, and water (ACaHW). In order to confirm the actual in vivo bioactivity of commercially pure titanium (cp-Ti) and these alloys after subjecting them to ACaHW treatment at different temperatures, the bone bonding strength of implants made from these materials was evaluated. The failure load between implant and bone was measured for treated and untreated plates at 4, 8, 16, and 26 weeks after implantation in rabbit tibia. The untreated implants showed almost no bonding, whereas all treated implants showed successful bonding by 4 weeks, and the failure load subsequently increased with time. This suggests that a simple and economical ACaHW treatment could successfully be used to impart bone bonding bioactivity to Ti metal and Ti-Zr-Nb-Ta alloys in vivo. In particular, implants heat treated at 700 °C exhibited significantly greater bone bonding strength, as well as augmented in vitro apatite formation, in comparison with those treated at 600 °C. Thus, with this improved bioactive treatment process these advantageous Ti-Zr-Nb-Ta alloys can serve as useful candidates for orthopedic devices. PMID:20883837

  13. 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.

  14. 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.

  15. 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.

  16. 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

  17. 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

    2016-04-01

    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.

  18. 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

  19. 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.

  20. In vitro biocompatibility, mechanical properties, and corrosion resistance of Ti-Zr-Nb-Ta-Pd and Ti-Sn-Nb-Ta-Pd alloys.

    PubMed

    Ito, A; Okazaki, Y; Tateishi, T; Ito, Y

    1995-07-01

    There is much discussion about the toxic effect of vanadium and aluminum contained in Ti-6Al-4V alloy for prosthetic implants. The goal of the present investigation was to develop new titanium alloys with sufficient mechanical properties using more biocompatible alloying elements: zirconium, tin, niobium, tantalum, and palladium. The relative growth rates of L929 and MC3T3-E1 cells were significantly higher when cultured with the extraction of Ti-10Zr-8Nb-2Ta-0.2Pd or Ti-15Zr-4Nb-2Ta-0.2Pd alloys than when cultured with the extraction of Ti-6Al-4AV ELI alloy. The tensile strength, elongation, and reduction of area for Ti-15Sn-4Nb-2Ta-0.2Pd alloy were 989 MPa, 14.4%, and 49.3%, respectively, surpassing Ti-6Al-4V ELI alloy. (ASTM F138-84); those for Ti-15Zr-4Nb-2Ta-0.2Pd alloy were 725 MPa, 23.6% and 54.9%, respectively. More than 15% addition of tin as well as zirconium deteriorated the tensile properties. Titanium release into a 5% hydrochloric acid solution from the new titanium alloys was 20-50 micrograms/cm2 per day, though that from Ti-6Al-4V ELI alloy was 1300 micrograms/cm2 per day. The optimum alloy compositions are Ti-15Zr-4Nb-2Ta-0.2Pd and Ti-15Sn-4Nb-2Ta-0.2Pd, judging from cytocompatibility, corrosion resistance, and mechanical properties. The former is characterized by its higher level cytocompatibility and corrosion resistance, while the latter is characterized by mechanical properties. PMID:7593029

  1. 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.

  2. 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.

  3. 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

  4. Phase Diagram of Pb(Zr,Ti)O3 Solid Solutions from First Principles

    NASA Astrophysics Data System (ADS)

    Kornev, Igor A.; Bellaiche, L.; Janolin, P.-E.; Dkhil, B.; Suard, E.

    2006-10-01

    A first-principles-derived scheme that incorporates ferroelectric and antiferrodistortive degrees of freedom is developed to study finite-temperature properties of Pb(Zr1-xTix)O3 solid solution near its morphotropic phase boundary. The use of this numerical technique (i) resolves controversies about the monoclinic ground state for some Ti compositions, (ii) leads to the discovery of an overlooked phase, and (iii) yields three multiphase points that are each associated with four phases. Additional neutron diffraction measurements strongly support some of these predictions.

  5. Epitaxial Pb(Zr,Ti)O3 Ultrathin Films under Open-Circuit Electrical Boundary Conditions

    NASA Astrophysics Data System (ADS)

    Sichuga, David; Bellaiche, L.

    2011-05-01

    The temperature-versus-misfit-strain phase diagram of Pb(Zr,Ti)O3 ultrathin films under open-circuit electrical boundary conditions is simulated via the use of an effective Hamiltonian. Two novel phases, both exhibiting dipolar nanodomains and oxygen octahedral tilting, are discovered. The interplay between dipolar, antiferrodistortive, alloying, and strain degrees of freedom induces several striking features in these two phases, such as the chemical pinning of domain walls, the enhancement of oxygen octahedral tilting near the domain walls, and the existence of dipolar waves and cylindrical dipolar chiral bubbles.

  6. Phase diagrams of epitaxial Pb(Zr,Ti)O3 ultrathin films from first principles

    NASA Astrophysics Data System (ADS)

    Sichuga, David; Ponomareva, I.; Bellaiche, L.

    2009-10-01

    An ab-initio-based approach, that includes strain, ferroelectricity, and tilting of the oxygen octahedra as degrees of freedom, is developed to investigate temperature-versus-misfit-strain and temperature-versus-composition phase diagrams of Pb(Zr,Ti)O3 ultrathin films near their morphotropic phase boundaries. Many features—originating from the interplay between composition, strain, polarization and oxygen octahedra tilting—are observed. Examples of such features are (i) an unusual behavior of the Curie temperature as a function of the compressive strain; (ii) a very rich variety of low symmetry phases; and (iii) several multiphase points that are each associated with four phases.

  7. 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.

  8. 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.

  9. (29)Si, (47)Ti, (49)Ti and (195)Pt solid state MAS NMR spectroscopic investigations of ternary silicides TPtSi, germanides TPtGe (T = Ti, Zr, Hf) and stannide TiPtSn.

    PubMed

    Benndorf, Christopher; Eckert, Hellmut; Pöttgen, Rainer

    2016-05-10

    Eight ternary tetrelides TPtX (T = Ti, Zr, Hf; X = Si, Ge, Sn) were synthesized from the elements by arc-melting and subsequent annealing. TiPtSi, ZrPtSi, ZrPtGe, HfPtSi and HfPtGe crystallize with the orthorhombic TiNiSi type structure, in the space group Pnma. The structures of HfPtSi (a = 654.44(9), b = 387.97(6), c = 750.0(1) pm, wR2 = 0.0592, 411 F(2) values, 20 variables) and HfPtGe (a = 660.36(7), b = 395.18(4), c = 763.05(8) pm, wR2 = 0.0495, 430 F(2) values, 20 variables) were refined from single crystal X-ray diffractometer data. TiPtSn adopts the cubic MgAgAs type. TiPtGe is dimorphic with a TiNiSi type high-temperature modification which transforms to cubic LT-TiPtGe (MgAgAs type). All phases were investigated by high resolution (29)Si, (47)Ti, (49)Ti and (195)Pt solid state MAS NMR spectroscopy. In the cubic compounds, the (47/49)Ti NMR signals are easily detected owing to the absence of quadrupolar broadening effects. The (195)Pt resonances of the orthorhombic compounds are characterized by strongly negative isotropic Knight shifts and large Knight shift anisotropies, whereas positive isotropic Knight shifts and no anisotropies are observed for the cubic compounds. These results indicate that the phase transition in TiPtGe is associated with dramatic changes in the electronic properties. Within each group of isotypic compounds the isotropic (29)Si, (47/49)Ti and (195)Pt Knight shifts show systematic dependences on the transition metal or tetrel atomic number, suggesting that the numerical values are influenced by the electronegativities of the metallic (or metalloid) neighbours. PMID:27097719

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

    NASA Astrophysics Data System (ADS)

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

    2016-02-01

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

  11. 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.

  12. 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.

  13. Zr Incorporation into TiO2 Electrodes Reduces Hysteresis and Improves Performance in Hybrid Perovskite Solar Cells while Increasing Carrier Lifetimes.

    PubMed

    Nagaoka, Hirokazu; Ma, Fei; deQuilettes, Dane W; Vorpahl, Sarah M; Glaz, Micah S; Colbert, Adam E; Ziffer, Mark E; Ginger, David S

    2015-02-19

    We investigate zirconium (Zr) incorporation into the titanium dioxide (TiO2) electron-transporting layer used in organometal halide perovskite photovoltaics. Compared to Zr-free controls, solar cells employing electrodes containing Zr exhibit increased power conversion efficiency (PCE) and decreased hysteresis. We use transient photovoltage and photocurrent extraction to measure carrier lifetimes and densities and observe longer carrier lifetimes and higher charge densities in devices on Zr-containing electrodes at microsecond times as well as longer persistent photovoltages extending from ∼milliseconds to tens of seconds. We characterize the surface stoichiometry and change in work function and reduction potential of the TiO2 upon incorporation of Zr and discuss the charge recombination at the TiO2 interface in the context of these variables. Finally, we show that the combination of Zr-TiO2 electrode modification with device pyridine treatment leads to a cumulative improvement in performance. PMID:26262483

  14. A conjoint XRD-ND analysis of the crystal structures of austenitic and martensitic Ti{sub 0.64}Zr{sub 0.36}Ni hydrides

    SciTech Connect

    Cuevas, F. . E-mail: fermin.cuevas@glvt-cnrs.fr; Latroche, M.; Bouree-Vigneron, F.; Percheron-Guegan, A.

    2006-11-15

    The crystal structures of the hydrides of austenitic and martensitic Ti{sub 0.64}Zr{sub 0.36}Ni alloy have been investigated by conjoint X-ray diffraction (XRD)-neutron diffraction (ND) analysis. Austenitic Ti{sub 0.64}Zr{sub 0.36}Ni alloy with cubic CsCl-type structure preserves its metal sublattice structure after deuteration. It forms a Ti{sub 0.64}Zr{sub 0.36}NiD{sub 1.5} deuteride with D-atoms occupying half of the octahedrally coordinated 3d sites. On the contrary, the monoclinic TiNi-type structure of martensitic Ti{sub 0.64}Zr{sub 0.36}Ni alloy is modified after deuterium absorption. At P{sub D2}=10{sup 3}Pa and T=298K, two deuterides coexist with orthorhombic CrB-type structure for the metal sublattice and compositions Ti{sub 0.64}Zr{sub 0.36}NiD ({beta}-deuteride) and Ti{sub 0.64}Zr{sub 0.36}NiD{sub 2.6} ({gamma}-deuteride). For the {beta}-monodeuteride, deuterium atoms are tetrahedrally coordinated by (Ti,Zr) atoms. For the {gamma}-deuteride, D-atoms fully occupy tetrahedrally coordinated (Ti,Zr){sub 3}Ni 8f sites and partially occupy pyramidal (Ti,Zr){sub 3}Ni{sub 2} 4c sites. At higher pressures, deuterium solution occurs in the {gamma}-phase with a partial occupancy of octahedrally coordinated (Ti,Zr){sub 2}Ni{sub 4} 4a sites.

  15. Wear-resistant, hemocompatible Ti-Nb-Zr and Zr-Nb alloys to improve blood pump design and performance.

    PubMed

    Davidson, J A; Daigle, K P; Kovacs, P

    1996-06-01

    Over the past several years, we have developed novel titanium-niobium-zirconium (Ti-Nb-Zr) alloys to address the long-term performance needs of orthopedic implants. The unique properties of these alloys also render them promising candidates for blood pumps. These properties include excellent biocompatibility in combination with high strength and toughness, and low elastic modulus (low stiffness). Additionally, these metal alloys are readily hot or cold worked into complex shapes including wire, foil, tubing and bar. They are readily machined and polished, and they can be surface oxidized to form a hard, wear-resistant, low-friction ceramic surface layer. In this diffusion-hardened condition, oxygen also hardens the underlying metal to optimize the bone between the ceramic oxide surface and the tough metal substrate. Unlike metal surfaces, oxidative wear, which can alter surface energy, friction, and hemocompatibility, does not occur. Consequently, the combined benefits of a stable, wear-resistant, low-friction ceramic surface layer with the toughness, strength, formability, and thermal conductivity of metal may provide improvements in the design and performance of blood pumps and peripheral graft and percutaneous (power) components of the pump. PMID:8817948

  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. 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.

  18. Recovery of forming gas damaged Pb(Nb, Zr, Ti)O3 capacitors

    NASA Astrophysics Data System (ADS)

    Aggarwal, S.; Perusse, S. R.; Kerr, C. J.; Ramesh, R.; Romero, D. B.; Evans, J. T.; Boyer, L.; Velasquez, G.

    2000-02-01

    We report on the recovery of fully integrated Pb(Nb, Zr, Ti)O3 ferroelectric capacitors damaged during forming gas (4% H2, balance N2) annealing. The capacitors were encapsulated using TiOx and SiO2 as interlevel dielectrics to prevent any loss of oxygen or lead. Hydrogen, however, diffused into the ferroelectric film leading to the loss of ferroelectricity. To recover the properties of the capacitor, the fully integrated structure was annealed in N2 ambient to drive the hydrogen out. Raman scattering experiments performed in the high frequency regime to detect the [OH-] stretching vibration mode confirmed the removal of hydrogen after annealing in N2. The ferroelectric properties, including polarization and resistivity of the capacitors, were restored to their initial values prior to damage. This shows that the process of hydrogen damage is reversible with the time to recovery being dependent on the amount of hydrogen in the forming gas.

  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. Microstructure and Phase Transformation in Ti-22Al-(27- x)Nb- xZr Alloys During Continuous Heating

    NASA Astrophysics Data System (ADS)

    Dang, Wei; Li, Jinshan; Zhang, Tiebang; Kou, Hongchao

    2015-10-01

    Phase transformation during heating in homogenized Ti-22Al-(27- x)Nb- xZr ( x = 0, 1, 6) alloys is monitored by dilatometry, differential scanning calorimetry (DSC), and detailed metallographic examination. Moreover, the dissolution of α2 into the B 2/β matrix is investigated and discussed. In Ti-22Al-27Nb alloy, the sequence of phase transformation during heating can be concluded as follows: B 2/β → O, B 2/β + α2 → O, B 2/β + O→ B 2/β + O + α2, B 2/β + O + α2 → B 2/β + α2, and B 2/β + α2 → B 2/β. For Ti-22Al-21Nb-6Zr alloy, it is B 2/β → α2 + O, O + α2 + B 2/β → B 2/β + α2, and then α2 dissolves into B 2 matrix. There are considerable shifts in the maxima of the transformation rates in B 2/β + O+α2 → B 2/β + α2 and B 2/β + α2 → B 2/β transformed region to the higher temperatures with increasing x value. In the stage of B 2/β + α2 → B 2/β, there is a deceleration of reduction in α2 phase with increasing temperature for Ti-22Al-(27- x)Nb- xZr ( x = 0, 1, 6) alloys. And for Ti-22Al-21Nb-6Zr, the dissolution rate of α2 phase is accelerated.

  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. 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.

  3. 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.

  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. Superelastic alloy Ti-22%Nb-6%Zr: X-ray study of deformation features

    NASA Astrophysics Data System (ADS)

    Perlovich, Yu; Isaenkova, M.; Chekanov, S.; Fesenko, V.; Krymskaya, O.

    2016-04-01

    In this paper features of deformation of superelastic Ti-22%Nb-6%Zr alloy were studied. Using X-ray method of generalized pole figures for study orientation dependence of martensite transformation in superelastic Ti-22%Nb-6%Zr alloy it was shown that: under compression the strain hardening due β → α '' transformation is significantly greater in grains with rolling plane {100} than in grains with a rolling plane {111}; the lattice microdeformation at β - and α '' - phase grains under loading is redistributed so that it extremely assist the sample macrodeformation (most of all); most intense β → α '' transformation occurs in grains, where Δd / dav> 0, most prone to increasing of its lattice volume. Diagrams of the cross-correlation substructural parameters built on the basis of generalized pole figure indicate that in loaded sample the deviation of interplanar space from the weight average level promotes the activation of martensite transformation at which the X-ray line broadening is minimal.

  6. Preparation of Pb(Zr, Ti)O3 Thin Films by Multitarget Sputtering

    NASA Astrophysics Data System (ADS)

    Hase, Takashi; Hirata, Kazuo; Amanuma, Kazushi; Hosokawa, Naokichi; Miyasaka, Yoichi

    1994-09-01

    Thin lead zirconate titanate [PZT] (Zr/Ti=50/50) films (230 430 nm) were deposited by multitarget sputtering with three stoichiometric PZT targets and one PbO target. To control Pb content in film, the rf power for the PbO target was varied. The rf power for each PZT target was also varied to control the deposition rate. PZT films with single perovskite phase or dominant perovskite phase were obtained only when the film composition was self-controlled. Low deposition rate resulted in a wider range of PbO input power in which Pb/(Zr+Ti) ratio was almost constant. Therefore low deposition rate would enhance the self composition control (SCC) mechanism. A 240-nm-thick PZT film deposited under the SCC mechanism and low deposition rate showed remanent polarization of 21.5 µ C/cm2, dielectric constant of 600 and leakage current of 7.0×10-8 A/cm2.

  7. 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). PMID:26766326

  8. Improvement of tribological behavior of a Ti Al Zr alloy by nitrogen ion implantation

    NASA Astrophysics Data System (ADS)

    Liu, Y. Z.; Zu, X. T.; He, X.; Qiu, S. Y.; Cao, J.; Huang, X. Q.

    2006-07-01

    Surface modification of a Ti-Al-Zr alloy with nitrogen implantation is considered as a method to improve its tribological properties especially wear and hardness. The implantation was carried out at fluences range from 1 × 10 16 to 1 × 10 17 ions/cm 2 and energy 65 keV. The tribological tests for the friction coefficients and wear were made on a pin-on-disk tribotester with the load 60 mN. Glancing angle X-ray diffraction (GAXRD) and X-ray photoelectron spectroscopy (XPS) analyses were performed to obtain surface characterization of the implanted sample. The unimplanted and implanted samples were also annealed at 500 °C in order to understand the influence of annealing on the tribological properties of Ti-Al-Zr. The hardness showed significant improvement at the higher fluence. After annealing at 500 °C, the friction coefficient exhibited a relative decrease for the nitrogen-implanted samples. In addition, the wear rates of the implanted samples exhibited a great decrease after annealing at 500 °C. Nature of the surface and reason for the variation and improvement in wear resistance were discussed in detail.

  9. Preparation and characterization of Zr doped TiO{sub 2} nanotube arrays on the titanium sheet and their enhanced photocatalytic activity

    SciTech Connect

    Liu Haijin; Liu Guoguang; Zhou Qingxiang

    2009-12-15

    This paper described a new method for the preparation of Zr doped TiO{sub 2} nanotube arrays by electrochemical method. TiO{sub 2} nanotube arrays were prepared by anodization with titanium anode and platinum cathode. Afterwards, the formed TiO{sub 2} nanotube arrays and Pt were used as cathode and anode, respectively, for preparation of Zr/TiO{sub 2} nanotube arrays in the electrolyte of 0.1 M Zr(NO{sub 3}){sub 4} with different voltage and post-calcination process. The nanotube arrays were characterized by field-emission scanning electron microscopy (FESEM), X-ray diffraction (XRD), X-ray photoelectron spectra (XPS) and UV-Vis diffusion reflection spectra (DRS). The photocatalytic activities of these nanotubes were investigated with Rhodamine B as the model pollutant and the results demonstrated that the photocatalytic efficiency of Zr doped TiO{sub 2} nanotubes was much better than that of TiO{sub 2} nanotubes under UV irradiation. Zr/TiO{sub 2} nanotube arrays doped at 7 V and calcined at 600 deg. C (denoted as TiO{sub 2}-7 V-600) achieved the best photocatalytic efficiency and the most optimal doping ratio was 0.047 (Zr/Ti). TiO{sub 2}-7 V-600 could be reused for more than 20 times and maintained good photocatalytic activities. - Graphical abstract: Zr-doped TiO{sub 2} nanotube arrays were prepared by two-step electrochemical process. The photocatalytic efficiency of Zr/TiO{sub 2} was much better than that of TiO{sub 2} nanotubes under UV irradiation. Nanotube arrays prepared by this method could be reused for more than 20 times and maintained good photocatalytic activities.

  10. 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.

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

    PubMed

    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. 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

  13. 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’.

  14. Electrochemical corrosion behavior of Ti-24Nb-4Zr-8Sn alloy in a simulated physiological environment

    NASA Astrophysics Data System (ADS)

    Bai, Y.; Li, S. J.; Prima, F.; Hao, Y. L.; Yang, R.

    2012-02-01

    Electrochemical corrosion behavior of a biomedical titanium alloy Ti-24Nb-4Zr-8Sn in weight percent was investigated in a phosphate buffered saline solution at 37 °C utilizing open-circuit potential, potentiodynamic polarization and electrochemical impedance spectroscopy (EIS) techniques. Both commercially pure titanium and Ti-6Al-4V alloy were also investigated to make a comparison. The results show that all the samples were spontaneously passivated once immersion into the electrolyte. Ti-24Nb-4Zr-8Sn alloy exhibited a much wider passive region compared with pure titanium and Ti-6Al-4V and also relatively low corrosion current density which is comparable to that of pure titanium in the buffered saline solution, which was attributed to a stable passive film mainly consisted of titanium oxide and niobium oxide on its surface. The EIS results indicated the presence of a single passive layer with thickness ∼2 nm for Ti-24Nb-4Zr-8Sn and pure titanium but a duplex film consisting an inner barrier layer and an outer porous layer on Ti-6Al-4V alloy with thickness of ∼3 nm and ∼2.5 nm, respectively.

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

    NASA Astrophysics Data System (ADS)

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

    2015-09-01

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

  16. 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.

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

    PubMed

    Sponza, Delia Teresa; Oztekin, Rukiye

    2016-04-01

    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. PMID:26560364

  18. Zr0.05Ti0.95O2-Nanowire-Based Ultraviolet Photodetector with Self-Powered Properties

    NASA Astrophysics Data System (ADS)

    Zhang, Haifeng; Liu, Guohua; Xu, Yang; Li, Hailong; Han, Xiaofei; Zhou, Bin; Zhang, Min; Feng, Caihui; Ruan, Shengping

    2013-06-01

    Zr0.05Ti0.95O2 solid solution nanowires were synthesized directly on a SnO2:F-coated glass via a low-temperature hydrothermal method, and a high-sensitivity self-powered ultraviolet detector based on SnO2:F/Zr0.05Ti0.95O2 heterojunction was fabricated subsequently. Zr doping not only improves the detector's photoresponse but also adjusts the response range to the short-wavelength direction. At 0 V bias, a highly responsivity of 1.03 A/W and an internal gain of 3.6 were obtained, together with favorable visible-blind characteristics and short response time. This high-sensitivity self-powered ultraviolet detector provides potential applications in wireless environmental monitoring, biological detection, and ultraviolet astronomy.

  19. 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

  20. Formation of Crystal Structure of Zirconium Titanate ZrTiO4 Powders Prepared by Sol-Gel Method

    NASA Astrophysics Data System (ADS)

    Oanh, Le Mai; Do, Danh Bich; Hung, Nguyen Manh; Thang, Dao Viet; Phuong, Doan Thuy; Ha, Dang Thu; Van Minh, Nguyen

    2016-05-01

    The crystal formation process of ZrTiO4 prepared by sol-gel method has been investigated using thermogravimetric analysis, differential thermal analysis, x-ray diffraction (XRD) analysis, scanning electron microscopy, Raman scattering, ultraviolet-visible (UV-Vis) absorption spectroscopy, and photoluminescence spectroscopy. Thermal analysis results and XRD patterns show that ZrTiO4 crystallizes in orthorhombic phase at 700°C with onset point at about 580°C. However, ZrTiO4 crystal exhibits a disordered structure according to Raman, UV-Vis, and photoluminescence spectroscopy up to calcination temperature of 1200°C. This indicates that, in the heat-treatment process, ZrTiO4 underwent three stages of oxide system self-organization: (1) short-range (<600°C), (2) disordered long-range (600°C to 1200°C), and (3) high-level of ordered orthorhombic structure (>1200°C).

  1. 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.

  2. Enhanced photoassisted water electrolysis using vertically oriented anodically fabricated Ti-Nb-Zr-O mixed oxide nanotube arrays.

    PubMed

    Allam, Nageh K; Alamgir, Faisal; El-Sayed, Mostafa A

    2010-10-26

    Self-ordered, highly oriented arrays of titanium-niobium-zirconium mixed oxide nanotube films were fabricated by the anodization of Ti(35)Nb(5)Zr alloy in aqueous and formamide electrolytes containing NH(4)F at room temperature. The nanostructure topology was found to depend on the nature of the electrolyte and the applied voltage. Our results demonstrate the possibility to grow mixed oxide nanotube array films possessing several-micrometer-thick layers by a simple and straightforward electrochemical route. The fabricated Ti-Nb-Zr-O nanotubes showed a ∼17.5% increase in the photoelectrochemical water oxidation efficiency as compared to that measured for pure TiO(2) nanotubes under UV illumination (100 mW/cm(2), 320-400 nm, 1 M KOH). This enhancement could be related to a combination of the effect of the thin wall of the fabricated Ti-Nb-Zr-O nanotubes (10 ± 2 nm) and the formation of Zr oxide and Nb oxide layers on the nanotube surface, which seems to slow down the electron-hole recombination in a way similar to that reported for Grätzel solar cells. PMID:20815374

  3. 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.

  4. Metal-insulator-metal capacitor with high capacitance density and low leakage current using ZrTiO4 film

    NASA Astrophysics Data System (ADS)

    Wu, Yung-Hsien; Chen, Bo-Yu; Chen, Lun-Lun; Wu, Jia-Rong; Wu, Min-Lin

    2009-09-01

    Thin amorphous and orthorhombic ZrTiO4 film with a high-work-function Ni top electrode has been explored in metal-insulator-metal (MIM) capacitors for analog circuit applications. It has been found that even though the permittivity can be as high as 78.9 for orthorhombic ZrTiO4, the extraordinarily high quadratic voltage coefficient of capacitance (VCC), and leakage current make it ineligible for reliable MIM capacitors. On the other hand, amorphous ZrTiO4 demonstrates a high capacitance density of 29.12 fF/μm2 and a low VCC of 2341 ppm/V2. Because of the amorphous phase and the conduction mechanism of Schottky emission, a low leakage current of 1.3×10-7 A/cm2 at -2 V and a good thermal leakage up to 125 °C has also been obtained. Besides these promising characteristics, amorphous ZrTiO4 holds a great potential for high-performance MIM capacitors not only in its process simplicity but also in the full compatibility with incumbent backend integrated circuit technology.

  5. 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

  6. Reactions on interfaces in heterophase TiN-Mo, TiN-W, ZrN-Mo, and ZrN-W materials during sintering

    SciTech Connect

    Pshenichnaya, O.V.; Verkhovodov, P.A.

    1985-08-01

    This paper reports on a study of the reactions on contact surfaces of solid titanium nitride and zirconium nitride specimens with molybdenum and tungsten in a vacuum corresponding to 0.01 Pa at temperatures in the range, 1900-2150/sup 0/C. The starting materials were titanium nitride containing 21.3% N and 0.3% O/sub 2/ dissolved in the TIN lattice; zirconium nitride containing 0.6-0.8% O/sub 2/; molybdenum with the impurities 0.02% C, 0.05% Ti, and 0.08% Zr; and tungsten with the impurities of 0.01% Si and 0.02% Hf. Polished end faces of specimens were pressed against each other with a small force, and in that position the specimens were annealed for an hour, after which microsections prepared in planes perpendicular to the control surfaces were investigated metallographically and by electron probe microanalysis. It is concluded that the development of bonds at interfaces between titanium nitride and zirconium nitride on the one hand, and molybdenum and tungsten on the other, is a consequence of diffusional reactions between the elements of the nitride phases and the metals which are accompanied by the formation of metal-base solid solutions localized within narrow contact zones.

  7. The formation of stable hydrogen impermeable TiN-based coatings on zirconium alloy Zr1%Nb

    NASA Astrophysics Data System (ADS)

    Kashkarov, E. B.; Nikitenkov, N. N.; Tyurin, Yu I.; Syrtanov, M. S.; Le, Zhang

    2015-04-01

    TiN coatings were deposited by DC reactive magnetron sputtering (dcMS) method on Zr1%Nb substrates with different film thickness. The influence of crystalline structure and thickness of the coatings on hydrogen permeation was investigated. The results revealed that the increase in thickness of the film reduced hydrogen permeability. 1.54 μm TiN deposited in N2/Ar gas mixture with a ratio of 3/1 reduces hydrogen permeation in more than two orders of magnitude at 350 °C. Adhesion strength decreased with increasing film thickness (0.55 to 2.04 μm) from 7.92 to 6.65 N, respectively. The Ti underlayer applied by arc ion plating (AIP) leads to the formation of stable Ti/TiN coatings on Zr1%Nb under thermocycling conditions up to 800 °C. Meanwhile, hydrogen permeation rate of Ti/TiN deposited by combination of AIP and dcMS remains at the same level with TiN deposited by dcMS.

  8. Examination of Multiphase (Zr,Ti)(V,Cr,Mn,Ni)2 Ni-MH Electrode Alloys: Part II. Solid-State Transformation of the Interdendritic B2 Phase

    NASA Astrophysics Data System (ADS)

    Bendersky, L. A.; Wang, K.; Boettinger, W. J.; Newbury, D. E.; Young, K.; Chao, B.

    2010-08-01

    Solidification microstructure of multicomponent (Zr,Ti)-Ni-(V,Cr,Mn,Co) alloys intended for use as negative electrodes in Ni-metal hydride (Ni-MH) batteries was studied in Part I of this series of articles. Part II of the series examines the complex internal structure of the interdendritic grains formed by solid-state transformation and believed to play an important role in the electrochemical charge/discharge characteristics of the overall alloy composition. By studying one alloy, Zr21Ti12.5V10Cr5.5Mn5.1Co5.0Ni40.2Al0.5Sn0.3, it is shown that the interdendritic grains solidify as a B2 (Ti,Zr)44(Ni,TM)56 phase, and then undergo transformation to Zr7Ni10-type, Zr9Ni11-type, and martensitic phases. The transformations obey orientation relationships between the high-temperature B2 phase and the low-temperature Zr-Ni-type intermetallics, and consequently lead to a multivariant structure. The major orientation relationship for the orthorhombic Zr7Ni10 type is [011]Zr7Ni10//[001]B2; (100)Zr7Ni10//(100)B2. The orientation relationship for the tetragonal Zr9Ni11 type is [001]Zr9Ni11//[001]B2; (130)Zr9Ni11//(100)B2. Binary Ni-Zr and ternary Ti-Ni-Zr phase diagrams were used to rationalize the formation of the observed domain structure.

  9. 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.

  10. 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.

  11. HRTEM studies of amorphous ZrNiTiCu nanocrystalline composites.

    PubMed

    Dutkiewicz, J; Lityńska-Dobrzyńska, L; Kovacova, A; Molnarova, M; Rogal, L; Maziarz, W

    2010-03-01

    Ball milling of easy glass forming Ti(25)Zr(17)Ni(29)Cu(29) alloys lead to the formation of an amorphous structure accompanied by a substantial increase of powder microhardness. The powders show clear glass transition effect and a few stage crystallization starting above 500 degrees C. High-resolution transmission electron microscope technique allowed identifying nanocrystalline inclusions as Cu(12)NiTi(7) within the amorphous powder. The amorphous powders mixed with nanocrystalline iron or silver powders were hot pressed to form composites. A narrow 200 nm broad intermediate single-phase layer at the amorphous-phase/iron interface containing all elements present in the composite was identified using transmission electron microscope and high-angle annular dark field detector techniques. scanning transmission electron microscopy energy dispersive spectroscopy line profile showed gradual change of composition within the intermediate zone. Amorphous phase contains small nanocrystals of size close to 10 nm identified using High-resolution transmission electron microscope as Cu(12)NiTi(7.) Compression tests have shown better plasticity of composites than in the case of pure hot-pressed amorphous powder; furthermore, high elastic limit of composites and the ultimate compression stress of about 1800 MPa for composites containing 20% Fe and near 700 MPa for those with 20% Ag. PMID:20500372

  12. Material characterization of superplastically formed titanium (Ti-6Al-2Sn-4Zr-2Mo) sheet

    NASA Technical Reports Server (NTRS)

    Ossa, William A.; Royster, Dick M.

    1987-01-01

    The aerospace industry has focused considerable interest on the near-alpha titanium alloy Ti-6Al-2Sn-4Zr-2Mo (Ti-6242) because of both its high-temperature properties and its superplastic forming (SPF) capabilities. This paper describes current research to characterize selected mechanical properties of Ti-6242 sheet in the SPF-strained condition, both with and without heat treatment, and compares the results with those obtained on as-received material. Tensile and creep tests were conducted, and metallographic analysis was performed to show the effect of 100 to 700 percent SPF strain on titanium properties. Analysis shows that as a result of SPF processing, both tensile and yield strengths, as well as elongation, are moderately reduced. Creep tests at 800 F and 1000 F show that the SPF processed material displays superior creep resistance compared with the as-received material. A post-SPF duplex-anneal heat treatment had no beneficial effect on tensile and creep properties.

  13. 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

  14. 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

  15. 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.

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

    PubMed

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

    2015-01-15

    In the present work, the multiphase Ti(x)Zr(1-x)O2 particles containing cubic-phase ZrO2 were fabricated via co-precipitation route. The mole ratios of Ti and Zr elements were controlled by three levels: Ti/Zr=7/3 (maximum), Ti/Zr=5/5 (medium), and Ti/Zr=3/7 (minimum). The materials prepared were characterized by using X-ray diffraction (XRD), field emission scanning electron microscope (FE-SEM), energy-dispersive X-ray (EDX), X-ray photoelectron spectroscopy (XPS), UV-vis diffuse reflectance spectra (DRS) and photoluminescence (PL) spectra. For the maximum usage of solar power with fabricated catalysts, elimination of gaseous toluene was chosen as a model to evaluate the performances under visible light. The results indicated that the degradation efficiency of toluene was about 80% after 6 h reaction using Ti(0.3)Zr(0.7)O2 as the photocatalyst. On the other hand, the multiphase Ti(x)Zr(1-x)O2 (x=0.7 or 0.5) photocatalysts showed significant enhancement in the activity, compared with the commercial TiO2 (Degussa P25). The enhanced performances of Ti(x)Zr(1-x)O2 might be attributed to the lower charge recombination rate of photoinduced electron-hole pairs. In addition, some intermediates (the benzaldehyde and benzoic acid) and final product (CO2) adsorbed on the surface of the particles were also detected by using in situ Fourier transform infrared (FTIR) spectroscopy. PMID:25454418

  17. Elastic, structural and magnetic properties of EuTi1-xAxO3 (A =Zr, Nb)

    NASA Astrophysics Data System (ADS)

    Li, Ling; Dun, Zhiling; Yan, Jiaqiang; Zhou, Haidong; Mandrus, David; Keppens, Veerle; Dept. of Materials Science and Engineering, University of Tennessee Team; Department of Physics and Astronomy, University of Tennessee Team; Materials Science and Technology Division, Oak Ridge National Laboratory Team

    2014-03-01

    The elastic moduli as a function of temperature (280-380 K) and magnetic field (0-9T) for single crystal EuTiO3 have been measured using resonant ultrasound spectroscopy (RUS). All the moduli show a sharp step-like softening upon the cubic-to-tetragonal transition at around 288K. We also present low-temperature XRD, magnetic susceptibility, and RUS results on polycrystalline EuTi1-xZrxO3 and EuTi1-xNbxO3 (x =0.015, 0.03 and 0.05). All of the compositions investigated present a cubic-to-tetragonal structural transition as temperature is lowered. Our results indicate that the transition temperature of the structural instability increases to higher temperatures with increasing Zr and Nb concentration in both solid-solutions, accompanied by the decrease of the antiferromagnetic transition temperature TN. While the structural distortion in EuTi1-xZrxO3 is suppressed with increasing Zr doping, the magnitude of the structural distortion in EuTi1-xNbxO3 is not affected by Nb-doping. The differences between Zr and Nb as dopants are discussed.

  18. 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.

  19. Phase Stability and Pressure Dependence of Defect Formation in Gd2Ti2O7 and Gd2Zr2O7 Pyrochlore

    SciTech Connect

    Zhang,F.; Wang, J.; Lian, J.; Lang, M.; Becker, U.; Ewing, R.

    2008-01-01

    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.

  20. Thick Pb(Zr,Ti)O{sub 3} film without substrate

    SciTech Connect

    Lee, Jae-Wung; Park, Chee-Sung; Jo, Ji-Hoon; Kim, Hyoun-Ee

    2007-08-13

    In order to fabricate thick PbZr{sub x}Ti{sub 1-x}O{sub 3} (PZT) films for microelectromechanical system applications, the authors introduce a concept of freestanding film without a substrate. PZT films with a thickness of up to 20 {mu}m were deposited on a very thin Pt layer without a substrate by the rf-magnetron sputtering method using a single oxide target. The Pt layer (thickness <1 {mu}m) was obtained by sputtering the Pt on a Si substrate with a carbon layer between them, and subsequently removing the carbon layer by oxidation in air at 400 deg. C. Piezoelectric properties of the film were comparable to those of bulk PZT as a result of the removal of clamping effect of the substrate.

  1. Mechanical property improvement by texture control of magnetron co-sputtered Zr-Ti films

    NASA Astrophysics Data System (ADS)

    Wang, Weipeng; Zhan, Peng; Xie, Zheng; Li, Zhengcao; Zhang, Zhengjun

    2014-01-01

    The present work studies the effect of substrate temperature and film composition on the structural and mechanical properties evolution of magnetron sputtered Zr-Ti films. As-deposited films show a monotonically strengthening (0002) crystallographic texture ranging from ambient temperature to 523 K, while then reveal a (0002) texture to randomly orientated structure transition at higher temperature. High Resolution TEM observations reveal a competitive and reconstruction growth mechanism which is in good agreement with the well-known Structure Zone Model. Nano-indentation measurements revealed that texture strengthening contribute to the improvement of mechanical properties. These results suggest that by establishing a semi-quantitative phase diagram based on the Structure Zone Model, structure and structure-related properties modification can be easily realized and precisely controlled by modifying the TS/Tm region during deposition.

  2. Temperature-time transformation diagram for Pb(Zr,Ti)O3 thin films

    NASA Astrophysics Data System (ADS)

    Varghese, Ronnie; Williams, Matthew; Gupta, Shashaank; Priya, Shashank

    2011-07-01

    In this paper, we describe an analytical model to define the temperature-time- transformation (TTT) diagram of sol-gel deposited Pb(Zr,Ti)O3 thin films on platinized silicon substrates. Texture evolution in film occurred as the pyrolysis and thermal annealing conditions were varied. We demonstrate that the developed model can quantitatively predict the outcome of thermal treatment conditions in terms of texture evolution. Multinomial and multivariate regression techniques were utilized to create the predictor models for TTT data. Further, it was found that multinomial regression can provide better fit as compared to standard regression and multivariate regression. We have generalized this approach so that it can be applied to other thin film deposition techniques and bulk ceramics.

  3. Photonic band gap in (Pb,La)(Zr,Ti)O3 inverse opals

    NASA Astrophysics Data System (ADS)

    Li, Bo; Zhou, Ji; Hao, Lifeng; Hu, Wei; Zong, Ruilong; Cai, Minmin; Fu, Min; Gui, Zhilun; Li, Longtu; Li, Qi

    2003-05-01

    (Pb,La)(Zr,Ti)O3 (PLZT) inverse opal photonic crystals were synthesized by a process of self-assembly in combination with a sol-gel technique. In this process, PLZT precursors were infiltrated into the interstices of the opal template assembled by monodisperse submicron polystyrene spheres, and then gelled in a humid environment. Polystyrene template was removed by calcining the specimen at a final temperature of 700 °C accompanied with the crystallization of perovskite phase in PLZT inverse opal network. Scanning electron microscope images show that the inverse opals possess a fcc structure with a lattice constant of 250 nm. A wide photonic band gap in the visible range is observed from transmission spectra of the sample. Such PLZT inverse opals as photonic crystals should be of importance in device applications.

  4. 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.

  5. Oxidation and embrittlement of Ti-6Al-2Sn-4Zr-2Mo alloy

    NASA Technical Reports Server (NTRS)

    Shenoy, R. N.; Unnam, J.; Clark, R.K.

    1986-01-01

    A thermogravimetric analysis monitoring study has been conducted for Ti-6Al-2Sn-4Zr-2Mo in the 593-760 C range, with a view to its total oxidation kinetics in laboratory air. In addition, tensile elongation was obtained for selected foil specimens after their exposure to simulated Space Shuttle reentry conditions. The total weight gain with time exhibited two parabolic stages separated by a transient region which is the result of a simultaneous increase in the parabolic growth rate constant for the oxide and in oxygen solubility at the oxide-metal interface. A model for the total oxidation kinetics accounting for the two individual components (oxide growth and solid solution formation) is proposed; the activation energy for oxygen diffusion in the alpha-solid solution is shown to approximate the activation energy for the degradation of tensile elongation of the alloy in its foil gage condition.

  6. Electric dipole sheets in BaTiO3/BaZrO3 superlattices

    NASA Astrophysics Data System (ADS)

    Jiang, Zhijun; Xu, Bin; Li, Fei; Wang, Dawei; Jia, C.-L.

    2015-01-01

    We investigate two-dimensional electric dipole sheets in the superlattice made of BaTiO3 and BaZrO3 using first-principles-based Monte Carlo simulations and density functional calculations. Electric dipole domains and complex patterns are observed and complex dipole structures with various symmetries (e.g., P m a 2 ,C m c m , and P m c 21 ) are further confirmed by density functional calculations, which are found to be almost degenerate in energy with the ferroelectric ground state of the A m m 2 symmetry, therefore strongly resembling magnetic sheets. More complex dipole patterns, including vortices and antivortices, are also observed, which may constitute the intermediate states that overcome the high-energy barrier of different polarization orientations previously predicted by A. I. Lebedev [Phys. Solid State 55, 1198 (2013), 10.1134/S1063783413060218]. We also show that such system possesses large electrostrictive effects that may be technologically important.

  7. Dissolution of amorphous Ti-Zr-Si alloy during anodic oxidation with formation of barrier films

    SciTech Connect

    Isaev, N.I.; Yakovlev, V.B.; Iovdal'skii, A.A.; Gorshkov, T.P.

    1988-07-01

    Radiometric analysis of a solution has been used to study kinetic mechanisms for dissolution of amorphous alloy components in acid aqueous solutions with anodic oxidation in different regimes. In a galvanostatic regime for alloy and crystalline Ti, Zr, and Ta two sections are detected: an initial section of accelerated dissolution and a steady section. An increase in dissolution of zirconium from the alloy has been revealed compared with pure crystalline zirconium. Potentiostatic oxidation is accompanied by a slowdown in dissolution similar to a change in current. Current yield has been analyzed for dissolution of the main elements and nonrectifying impurities of the alloy (for example copper). Gamma spectroscopy using the gamma radiation from neutron-activated isotopes of the components and impurities was performed.

  8. Ba(Ti, Zr)O3 Ceramics Sintered with Lead Borate Glass

    NASA Astrophysics Data System (ADS)

    Wang, Chunz-Heuy; Wu, Long

    1993-08-01

    The sintering of Ba(Ti, Zr)O3 ceramics is significantly influenced by the addition of 4PbO\\cdotB2O3. The eutectic temperature of 4PbO\\cdotB2O3 is around 500°C, so it exists as a liquid phase during the sintering process. Grain growth in Ba(TiyZr1-y)O3 exhibits a peculiar phenomenon. The liquid has high surface tension which aids solubility and penetration. As a consequence, the spreading liquid can penetrate solid-solid interfaces. Penetration leads to disintegration of the solid and subsequent rearrangement of fragments. The theory of grain growth in the presence of a liquid phase is examined in terms of the equation Rn{=}k*t. The grain growth kinetic exponent, n, has an inverse relationship with the rate of grain growth. With suitable amounts of glass frit and sintering temperature, the density of the ceramics was enhanced and the dielectric and piezoelectric properties were improved.

  9. Impact of nano and bulk ZrO2, TiO2 particles on soil nutrient contents and PGPR.

    PubMed

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

    2013-01-01

    Currently, nanometal oxides are used extensively in different industries such as medicine, cosmetics and food. The increased consumption of nanoparticles (NPs) leads the necessity to understand the fate of the nanoparticles in the environment. The present study focused on the ecotoxicological behaviour of bulk and nano ZrO2 (Zirconia) and TiO2 (Titania) particles on PGPR (plant growth promoting rhizobacteria), soil and its nutrient contents. The microbial susceptibility study showed that nano TiO2 had 13 +/- 0.9 mm (B. megaterium), 15 +/- 0.2 mm (P. fluorescens), 16 +/- 0.2 mm (A. vinelandii) and 12 +/- 0.3 mm (B. brevis) zones of inhibition. However, nano and bulk ZrO2 particles were non-toxic to PGPR. In addition, it was found that toxicity varied depends on the medium of reaction. The soil study showed that nano TiO2 was found to be highly toxic, whereas bulk TiO2 was less toxic towards soil bacterial populations at 1000 mg L(-1). In contrast, nano and bulk ZrO2 were found to be inert at 1000 mg L(-1). The observed zeta potential and hydrophobicity of TiO2 particles causes more toxic than ZrO2 in parallel with particle size. However, nano TiO2 decreases the microbial population as well as nutrient level of the soil but not zirconia. Our finding shows that the mechanism of toxicity depends on size, hydrophobic potential and zeta potential of the metal oxide particles. Thus, it is necessary to take safety measures during the disposal and use of such toxic nanoparticles in the soil to prevent their hazardous effects. PMID:23646796

  10. 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

  11. Domain formation in epitaxial Pb(Zr, Ti)O3 thin films

    NASA Astrophysics Data System (ADS)

    Lee, K. S.; Choi, J. H.; Lee, J. Y.; Baik, S.

    2001-10-01

    Ferroelectric twin-domain structures in epitaxial Pb(Zr, Ti)O3 (PZT) thin films grown on various single-crystal substrates such as MgO(001), KTaO3(001), and SrTiO3(001) were investigated by two-dimensional reciprocal space mapping using synchrotron x-ray diffraction. Each system showed a characteristic domain structure. PbTiO3 thin films grown on MgO(001) showed highly c-axis oriented domain structures consisting of a periodic array of 90° twinlike domains. Perfectly c-axis oriented films were obtained on SrTiO3(001), while the films grown on KTaO3(001) showed a-domain dominant structures with a small amount of c domains embedded in matrix a domains. Contributions of net elastic strain stored in each heteroepitaxial layer and its relaxation to the final domain structures were evaluated considering thermodynamic equilibrium relief of coherency strain by misfit dislocation generation at the film growth temperature. A comparison between theoretical consideration and experimental results clearly demonstrates that the nature of effective misfit strain and its relaxation during film growth play a critical role in the formation of domain structures in epitaxial PZT thin films. Moreover, it was verified that the control of such critical strain factors by changing film composition could modify dominant domain structures in a drastic way. In addition, it was found that the crystalline quality of the films is closely correlated to the tilting nature of the domain structure in each system and coherency strain across the 90° domain boundary is accommodated mainly by the domain tilt of the minor domain.

  12. Sintering ZrO{sub 2}/TiC composites with TiH{sub 2}: The role of transient liquid phase and of substoichiometry

    SciTech Connect

    Krell, A.; Blank, P.; Pippel, E.; Woltersdorf, J.

    1995-10-01

    Sintering tetragonal ZrO{sub 2} with 35 vol% TiC results in a microstructure where all grain facets are free of amorphous interfaces independent of sintering aids as TiH{sub 2} or MgO/Y{sub 2}O{sub 3}; grain sizes are below 1 {micro}m. With substoichiometric TiC{sub 1{minus}x}, a relative density of 95% and closed porosity are obtained at a lower sintering temperature than with stoichiometric TiC, but subsequent cladless hot isostatic pressing (HIP) is required to achieve 99% density. High densities of 98% accompanied by good mechanical properties become possible by pressureless sintering with the use of TiH{sub 2}. MgO/Y{sub 2}O{sub 3} doping also promotes densification, but results in less transformable zirconia and increases the number and size of amorphous triple junctions. The consequences are a lower fracture toughness and strength.

  13. Effective work function engineering for a TiN/XO(X = La, Zr, Al)/SiO2 stack structures

    NASA Astrophysics Data System (ADS)

    Lee, Dongjin; Cho, Eunae; Lee, Jieun; Jung, Kyoungho; Jeong, Moonyoung; Yamada, Satoru; Hong, Hyeongsun; Lee, Kyupil; Heo, Sung; Ko, Dongsu; Kim, Yong Su; Kyoung, Yong Koo; Lee, Hyung-Ik; Lee, Hyo Sug; Park, Gyeong-Su; Shin, Jai Kwang

    2016-05-01

    In this study, we demonstrated that work function engineering is possible over a wide range (+200 mV to -430 mV) in a TiN/XO (X = La, Zr, or Al)/SiO2 stack structures. From ab initio simulations, we selected the optimal material for the work function engineering. The work function engineering mechanism was described by metal diffusion into the TiN film and silicate formation in the TiN/SiO2 interface. The metal doping and the silicate formation were confirmed by transmission electron microscopy and energy dispersive spectroscopy line profiling, respectively. In addition, the amount of doped metal in the TiN film depended on the thickness of the insertion layer XO. From the work function engineering technique, which can control a variety of threshold voltages (Vth), an improvement in transistors with different Vth values in the TiN/XO/SiO2 stack structures is expected.

  14. 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.

  15. 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.

  16. Phase equilibria and solid solution relationships in the La 2O 3-TiO 2-ZrO 2 system

    NASA Astrophysics Data System (ADS)

    Škapin, S. D.; Kolar, D.; Suvorov, D.

    1999-07-01

    In the ternary La 2O 3-TiO 2-ZrO 2 system the subsolidus phase relations at 1350 °C were determined using X-ray diffraction, scanning electron microscopy end energy dispersive X-ray analysis. The collected results are presented in the form of a phase diagram. In the equilibrium state there are 7 ternary and 5 binary compatible subsystems. In the system TiO 2ss, ZrO 2ss, ZrTiO 4ss, La 2Zr 2O 7ss and La 2O 3ss solid solutions were confirmed and La 4Ti 9O 2ss and La 2Ti 2O 7ss solid solutions were identified. The addition of ZrO 2 does not stabilize the La 2/3TiO 3 perovskite compound, nor the addition of TiO 2 a highly temperature stable compound La 2/3ZrO 3.

  17. 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.

  18. Superconductivity in the ternary silicide TrIrSi (Tr = Ti, Zr, and Hf)

    NASA Astrophysics Data System (ADS)

    Kase, Naoki; Suzuki, Harufumi; Nakano, Tomohito; Takeda, Naoya

    2016-03-01

    We discover a new superconductor, TiIrSi at T c = 1.4 K, and reveal a superconducting state of TrIrSi (Tr = Ti, Zr, and Hf) by using dc magnetic susceptibility χ (T), electrical resistivity ρ (T), and specific heat C(T) measurements. Superconductivity of TrIrSi is confirmed in ρ (T) at T c = 1.4, 1.85, and 3.4 K, respectively. The electronic specific heat {C}{{e}}(T) of TrIrSi can be fitted with the theoretical BCS curve of the weak-coupling limit with {{Δ }}{C}{{e}}/γ {T}{{c}}= 1.43. Measurements in several magnetic fields suggest that TrIrSi is a type-II superconducting material with upper critical fields of {μ }0{H}{{c}2}(0) = 0.751, 0.618, and 2.23 T, respectively. The electron-phonon coupling constants {λ }{ep} are calculated to be 0.441, 0.464, and 0.545, which are consistent with the weak-coupling limit inferred from the specific jump. The T c of TrIrSi depends on {λ }{ep} and is inversely proportional to N({E}{{F}}).

  19. 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.

  20. Domain structure of tetragonal Pb(Zr,Ti)O3 nanorods and its size dependence

    NASA Astrophysics Data System (ADS)

    Yamada, Tomoaki; Ito, Daisuke; Sakata, Osami; Kuroishi, Junki; Namazu, Takahiro; Imai, Yasuhiko; Shiraishi, Takahisa; Shimizu, Takao; Funakubo, Hiroshi; Yoshino, Masahito; Nagasaki, Takanori

    2015-10-01

    We fabricated {100} Pb(Zr0.35Ti0.65)O3 (PZT) nanorods by partly etching a film grown on a Nb-doped SrTiO3 substrate using a focused ion beam, followed by annealing to recover the etching damage and promote the formation of a stable domain structure in the form of nanorods. The application of synchrotron micro-X-ray diffraction enabled the detection of the diffraction intensity from a single nanorod, which allowed us to clarify the size dependence of the domain structure of the fabricated nanorods. We found that the a-domain fraction in the tetragonal PZT nanorods decreased with decreasing rod width and that an exclusively c-domain structure was formed in nanorods of ≤1 µm width. The preferred formation of the c-domain in these nanorods can be rationalized in terms of the large depolarizing field in the a-domain and/or the in-plane compressive strain near the PZT/substrate interface.

  1. Sol-gel route to synthesis of microporous ceramic membranes: Thermal stability of TiO[sub 2]-ZrO[sub 2] mixed oxides

    SciTech Connect

    Qunyin Xu; Anderson, M.A. . Water Chemistry Program)

    1993-08-01

    In this paper concerning the synthesis of microporous ceramic membranes, the authors focus on the preparation and thermal stability of unsupported microporous TiO[sub 2]-ZrO[sub 2] mixed-oxide membranes. It has been observed that, by adding up to 20% ZrO[sub 2] into TiO[sub 2] or up to 10% TiO[sub 2] into ZrO[sub 2], these microporous membranes display improved thermal stability. They can be fired up to 500 C for 0.5 h without closing micropores. However, membranes containing almost equal percentages of each component have lost microporous features and have low surface areas and low porosities. A phase diagram of a two-component TiO[sub 2]-ZrO[sub 2] mixed-oxide membrane has been prepared based on DTA and X-ray diffraction data in order to better understand the microstructure changes upon firing.

  2. Strong flux pinning enhancement in YBa2Cu3O7-x films by embedded BaZrO3 and BaTiO3 nanoparticles

    NASA Astrophysics Data System (ADS)

    Ding, Fa-Zhu; Gu, Hong-Wei; Zhang, Teng; Wang, Hong-Yan; Qu, Fei; Qiu, Qing-Quan; Dai, Shao-Tao; Peng, Xing-Yu

    2013-07-01

    YBa2Cu3O7-x (YBCO) films with embedded BaZrO3 and BaTiO3 nanoparticles were fabricated by metalorganic deposition using trifluoroacetates (TFA-MOD). Both X-ray diffraction and transmission electron microscopy revealed that these BaZrO3 and BaTiO3 nanoparticles had random orientations and were distributed stochastically in the YBCO matrix. The unique combined microstructure enhances the critical current density (Jc) of the BaZrO3/BaTiO3 doped-YBCO films, while keeping the critical transition temperature (Tc) close to that in the pure YBCO films. These results indicate that BaZrO3 and BaTiO3 nanoparticles provide strong flux pinning in YBCO films.

  3. Optical and structural properties of sol gel made Ce/Ti/Zr mixed oxide thin films as transparent counter electrode for electrochromic devices

    NASA Astrophysics Data System (ADS)

    Ghodsi, F. E.; Tepehan, F. Z.; Tepehan, G. G.

    2008-09-01

    Ce/Ti/Zr mixed oxide thin films were prepared using sol-gel process with mole ratios from 45/5 to 5/45 of Ti/Zr and 50 of Ce and deposited by dip coating technique. Optical, electrochromic, and structural properties of such films were investigated. The thickness, refractive index, and extinction coefficient of the films were calculated through transmission and reflection measurement by an nkd spectrophotometer. The surface morphology and structural behaviors of the films were characterized by atomic force microscopy and X-ray diffraction. Cyclic voltammetry measurements also were used to study electrochromic properties of these films. The best counter electrode Ce/Ti/Zr oxide thin film is achieved for the sample with a mole ratio of 40/10 of Ti/Zr. The ratio between anodic and cathodic charge is about 0.95 for this sample with a surface roughness of 1.8 nm.

  4. 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.

  5. 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}.

  6. 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 .

  7. 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.

  8. Formation of Fe-Nb-X (X=Zr, Ti) amorphous alloys from pure metal elements by mechanical alloying

    NASA Astrophysics Data System (ADS)

    Xiao, Zhiyu; Tang, Cuiyong; Leo Ngai, Tungwai; Yang, Chao; Li, Yuanyuan

    2012-01-01

    Fe-based amorphous powders of Fe 56Nb 6Zr 38 and Fe 60Nb 6Ti 34 based on binary eutectic were prepared by mechanical alloying starting from mixtures of pure metal powders. The amorphization behavior and thermal stability were examined by x-ray diffraction, scanning electron microscopy, transmission electron microscopy and differential scanning calorimetry. Results show that Fe 56Nb 6Zr 38 alloy has a better glass forming ability and a relatively lower thermal stability comparing with Fe 60Nb 6Ti 34 alloy. The prepared amorphous powders have homogeneous element distribution and no obvious contaminants coming from mechanical alloying. The synthesized amorphous powders offer the potential for consolidation to full density with desirable mechanical properties through the powder metallurgy methods.

  9. 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.

  10. 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.

  11. Electrochemical formation of self-organized anodic nanotube coating on Ti-28Zr-8Nb biomedical alloy surface.

    PubMed

    Feng, X J; Macak, J M; Albu, S P; Schmuki, P

    2008-03-01

    In recent years, Ti-Zr-Nb alloys have become increasingly attractive as biomedical implant materials. In the present communication, we report the formation of self-organized nanotube oxide layers on a Ti-28Zr-8Nb biomedical alloy surface in 1M (NH4)2SO4 containing 0.25M NH4F. The morphology of the nanotube layers (the diameter and the length) is affected by the electrochemical conditions used (applied potential and time). Under specific conditions oxide layers consisting of highly ordered nanotubes with a wide range of diameters and lengths can be formed, varying, respectively, from approx. 50 to 300nm and from approx. 500nm to 22microm. The present results are highly promising for this biomedical alloy, as the large surface area and the tunable nanoscale geometry of the surface oxide provide novel pathways for the interaction of the materials with biorelevant species, such as cells and proteins. PMID:17923448

  12. 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.

  13. A Continuing Story on the Secondary Electron Yield Measurements of TiN Coating and TiZrV Getter Film

    SciTech Connect

    Le Pimpec, F.

    2004-06-07

    In the beam pipe of the positron Main Damping Ring (MDR) of the Next Linear Collider (NLC), ionization of residual gases and secondary electron emission will give rise to an electron cloud which can cause the loss of the circulating beam. One path to avoid the electron cloud is to ensure that the vacuum wall has low secondary emission yield and, therefore, we need to know the secondary emission yield (SEY) for candidate wall coatings. We report on the ongoing SEY measurements at SLAC on titanium nitride (TiN) and titanium-zirconium-vanadium (TiZrV) thin sputter-deposited films, as well as their effects on simulations.

  14. 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

  15. 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

  16. 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.

  17. An experimental study on the mixing behavior of Ti, Zr, V and Mo in the Elbe, Rhine and Weser estuaries

    NASA Astrophysics Data System (ADS)

    Schneider, Alexandre B.; Koschinsky, Andrea; Kiprotich, Joseph; Poehle, Sandra; do Nascimento, Paulo C.

    2016-03-01

    Estuaries are important interfaces between land and ocean, in which the input of trace metals into the ocean via the rivers is often significantly modified along the mixing gradient between freshwater and seawater. In the present study we have carried out mixing experiments using river water from the Rhine, the Elbe and the Weser and seawater from the North Sea with the aim of gaining more insights into the behavior of titanium (Ti), zirconium (Zr), vanadium (V) and molybdenum (Mo) and their distribution between dissolved and particulate forms during mixing in the estuaries. Little is known about the modification of their concentrations in estuaries and these metals increasingly enter the rivers and the ocean due to their application as so-called high-tech metals in industrial activities. Such laboratory experiments at controlled conditions allow the systematic investigation of chemical changes related to the mixing ratios, independent of further influence factors occurring in natural systems. Adsorptive stripping voltammetry was used for the analytical determination of the four metals. Although our data largely confirmed a strong particle-reactive behavior of Ti and Zr and a mostly conservative behavior of Mo, our mixing experiments revealed partial deviation from this behavior. Vanadium mostly does not follow a strict conservative mixing trend but shows both small ad- and desorption effects along the salinity transect. Also Mo shows some deviations from conservative mixing at mid-salinities. The enrichment of dissolved Ti and Zr at about 50:50 river: seawater mixtures agrees with recently published data of similar field studies and appears to be a systematic effect possibly related to charge transitions on particle surfaces or change of the dissolved metal speciation. The observed effects partly differed in experiments with filtered and non-filtered river water samples, especially for Ti and Zr, highlighting the role of riverine particulate matter for the

  18. The nature of magnetoelectric coupling in Pb(Zr,Ti)O3 -Pb(Fe,Ta)O3.

    PubMed

    Evans, Donald M; Alexe, Marin; Schilling, Alina; Kumar, Ashok; Sanchez, Dilsom; Ortega, Nora; Katiyar, Ram S; Scott, James F; Gregg, J Marty

    2015-10-21

    The coupling between magnetization and polarization in a room temperature multiferroic (Pb(Zr,Ti)O3 -Pb(Fe,Ta)O3 ) is explored by monitoring the changes in capacitance that occur when a magnetic field is applied in each of three orthogonal directions. Magnetocapacitance effects, consistent with P(2) M(2) coupling, are strongest when fields are applied in the plane of the single crystal sheet investigated. PMID:26351267

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

    PubMed

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

    2016-07-01

    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 (10(8)). 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. PMID:27297905

  20. Improving the electrochemical properties of Al, Zr Co-doped Li4Ti5O12 as a lithium-ion battery anode material

    NASA Astrophysics Data System (ADS)

    Park, Jung Soo; Baek, Seong-Ho; Park, Yiseul; Kim, Jae Hyun

    2014-05-01

    Li4Ti5O12 and Al3+, Zr4+ co-doped Li(4- x/3)Al x Ti(5-5 x/3)Zr x O12 ( x = 0.01, 0.05, 0.1, 0.15, 0.2) were synthesized at 950 °C via a solid state reaction by using rutile TiO2, Li2 CO3, and Al2O3 as precursors for the anode material of a lithium-ion battery. The average particle sizes of Li(4- x/3)Al x Ti(5-5 x/3)Zr x O12 ( x = 0, 0.01, 0.05, 0.1, 0.15, 0.2) range from 700 to 1200 nm. The particle sizes of pure Li4Ti5O12 and Al3+, Zr4+ co-doped Li4Ti5O12 were not obviously different, but did result in a shift in the (111) peak in X-ray diffraction. Li(4- x/3)Al x Ti(5-5 x/3)Zr x O12 ( x = 0.01) exhibits an excellent rate capability with a reversible capacity of 127.7 mAh/g at a 5 C-rate and even 113.1 mAh/g at a 10 C-rate. The capacity retention was improved remarkably compared to that for an undoped anode when discharged at a high C- rate.

  1. 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.

  2. 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.

  3. Physics of nanostructures at]radiation resistance of high-entropy nanostructured (Ti, Hf, Zr, V, Nb)N coatings

    NASA Astrophysics Data System (ADS)

    Komarov, F. F.; Pogrebnyak, A. D.; Konstantinov, S. V.

    2015-10-01

    The influence of high-fluence ion irradiation of nanostructured (Ti, Hf, Zr, V, Nb)N coatings is revealed for the first time. The energy of irradiating helium ions is equal to 500 keV, and their fluence falls into the interval 5 × 1016-3 × 1017 ions/cm2. The performance of the coatings in a nuclear reactor is simulated by conducting post-irradiation thermal annealing at 773 K for 15 min. The elemental composition, structure, morphology, and strength properties of the (Ti, Hf, Zr, V, Nb)N coatings are studied before and after irradiation. No considerable structural and phase modifications in the coatings are found after irradiation, except for the fact that crystallites in the coatings drastically reduce in size to less than 10 nm. Nor does the atomic composition of the coatings change. It is shown that the microhardness of the coatings depends on the fluence of irradiating ions nonlinearly. It can be argued that the (Ti, Hf, Zr, V, Nb)N coatings are radiationresistant and hence promising for claddings of fuel elements in nuclear reactors.

  4. 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

  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. 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.

  7. Temperature driven nano-domain evolution in lead-free Ba(Zr0.2Ti0.8)O3-50(Ba0.7Ca0.3)TiO3 piezoceramics

    NASA Astrophysics Data System (ADS)

    Lu, Shengbo; Xu, Zhengkui; Su, Shi; Zuo, Ruzhong

    2014-07-01

    Hierarchical micro- and nanoscale domain structures in Pb-free Ba(Zr0.2Ti0.8)O3-50(Ba0.7Ca0.3)TiO3 piezoceramics were investigated by transmission electron microscopy. In situ heating and cooling studies of domain structure evolution reveal an irreversible domain transformation from a wedge-shaped rhombohedral nanodomain structure to a lamellar tetragonal domain structure, which could be associated with strong piezoelectricity in Ba(Zr0.2Ti0.8)O3-50(Ba0.7Ca0.3)TiO3 piezoceramics.

  8. Surface characterization of Zr/Ti/Nb tri-layered films deposited by magnetron sputtering on Si(111) and stainless steel substrates

    SciTech Connect

    Tallarico, Denise A.; Gobbi, Angelo L.; Filho, Pedro I. Paulin; Galtayries, Anouk; Nascente, Pedro A. P.

    2012-09-15

    Among metallic materials, commercially pure titanium and titanium alloys are very often used as biomaterials for implants. Among these alloys, titanium-aluminum-vanadium alloy Ti-6 A-4 V is one of the most commonly used due to its excellent biocompatibility and ability to allow bone-implant integration. A new class of Ti alloys employs Zr for solid-solution hardening and Nb as {beta}-phase stabilizer. Metals such as Ti, Nb, and Zr-known as valve metals-usually have their surfaces covered by a thin oxide film that forms spontaneously in air. This oxide film constitutes a barrier between the metal and the medium. The Ti-Nb-Zr alloys have mechanical and corrosion resistance characteristics which make them suitable for use as implants. Tri-layered films of Ti-Nb-Zr were deposited on both Si(111) and stainless steel (SS) substrates using dc magnetron sputtering equipment, under an argon atmosphere according to the following methodology: a 100 nm thick layer of Nb was deposited on the substrate, followed by a 200 nm thick layer of Ti, and finally a 50 nm thick layer of Zr, on top of the multilayer stack. The morphology and chemical composition of the films were analyzed by atomic force microscopy (AFM), x-ray photoelectron spectroscopy (XPS), and time-of-flight secondary ion mass spectrometry (ToF-SIMS). AFM images showed that the Zr/Ti/Nb tri-layer films presented nanostructured grains and low roughness. The ToF-SIMS depth profiles confirmed the formation of a three-layered film on Si(111) with well-defined and sharp interfaces between the layers, while the deposition on the stainless steel substrate caused slight intermixing at the different alloy/Nb, Nb/Ti and Ti/Zr interfaces, reflecting the greater roughness of the raw substrate. The XPS results for the Zr/Ti/Nb layers deposited on Si(111) and SS confirmed that the outermost layer consisted of Zr only, with a predominance of ZrO{sub 2}, as the metal layer is passivated in air. An oxidation treatment of 1000 Degree

  9. 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

  10. 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.