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Sample records for zr3al2 structure types

  1. Structural stability and electronic properties of AlCu3, AlCu2Zr in AlZr3: Stabilnost strukture in elektronske lastnosti AlCu3, AlCu2Zr in AlZr3:

    OpenAIRE

    Cheng, Rong; Wu, Xiao-Yu

    2013-01-01

    First-principles calculations were performed to study the alloying stability and electronic structure of the Al-based intermetallic compounds AlCusub3, AlCusub{2}Zr and AlZrsub3. The results show that the lattice parameters obtained after the full relaxation of the crystalline cells are consistent with the experimental data, and these intermetallics have a strong alloying ability and structural stability due to their negative formation energies and their cohesive energies. A further analysis ...

  2. Atomic-scale microstructures of Zr2Al3C4 and Zr3Al3C5 ceramics

    International Nuclear Information System (INIS)

    Lin, Z.J.; Zhuo, M.J.; He, L.F.; Zhou, Y.C.; Li, M.S.; Wang, J.Y.

    2006-01-01

    The microstructures of bulk Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 ceramics have been investigated using transmission electron microscopy and scanning transmission electron microscopy. These two carbides were determined to have a point group 6/mmm and a space group P6 3 /mmc using selected-area electron diffraction and convergent beam electron diffraction. The atomic-scale microstructures of Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 were investigated through high-resolution imaging and Z-contrast imaging. Furthermore, intergrowth between Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 was identified. Stacking faults in Zr 3 Al 3 C 5 were found to result from the insertion of an additional Zr-C layer. Cubic ZrC was occasionally identified to be incorporated in elongated Zr 3 Al 3 C 5 grains. In addition, Al may induce a twinned ZrC structure and lead to the formation of ternary zirconium aluminum carbides

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

    International Nuclear Information System (INIS)

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

    2007-01-01

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

  4. Synthetic of Zr2Al3C5 material

    International Nuclear Information System (INIS)

    Leela-Adisorn, U.; Yamaguchi, A.

    2005-01-01

    Synthesis method of Zr 2 Al 3 C 5 via solid state reaction between Al, ZrC and carbon powder was studied. Al-ZrC-C compact with equivalent mol ratio of Zr 2 Al 3 C 5 was heated up to 1600 C in Ar atmosphere for 1 h and 4 h but ZrC phase still existed as major phase with very small amount of Zr 2 Al 3 C 5 . Because ZrC started to oxidize at low temperature under very low oxygen partial pressure, the same mol ratio of Al-ZrC-C compact was heated at 1600 C in vacuum for 1 h as parallel test. After firing in vacuum, some carbon still exist with small amount of AlZrC 2 occurred with Zr 2 Al 3 C 5 as a main phase, but no ZrC was found. Different result from firing in Ar atmosphere and in vacuum had been discussed here. It was believed that very small amount of impurities in Ar had some effect on the formation of Al-Zr-C compound. The effect of very small amount of impurities in Ar was studied by thermal analysis (DTA/TG) and XRD. It was found that very small amount of impurities in Ar has effect on the reaction between Al, ZrC and carbon by diffusion through the surface and form Zr-C-O-N solid solution. This solid solution cannot differentiate from ZrC by XRD. With help of thermal analysis method (DTA/TG), Zr-C-O-N solid solution can be differentiated from ZrC. Therefore, synthesis of Al-Zr-C compound should be done in vacuum. Zr 2 Al 3 C 5 can be prepared from mixture of Al-ZrC-C with excess amount of Al at 1600 C for 1 h. (orig.)

  5. Miscibility of amorphous ZrO2-Al2O3 binary alloy

    Science.gov (United States)

    Zhao, C.; Richard, O.; Bender, H.; Caymax, M.; De Gendt, S.; Heyns, M.; Young, E.; Roebben, G.; Van Der Biest, O.; Haukka, S.

    2002-04-01

    Miscibility is a key factor for maintaining the homogeneity of the amorphous structure in a ZrO2-Al2O3 binary alloy high-k dielectric layer. In the present work, a ZrO2/Al2O3 laminate thin layer has been prepared by atomic layer chemical vapor deposition on a Si (100) wafer. This layer, with artificially induced inhomogeneity (lamination), enables one to study the change in homogeneity of the amorphous phase in the ZrO2/Al2O3 system during annealing. High temperature grazing incidence x-ray diffraction (HT-XRD) was used to investigate the change in intensity of the constructive interference peak of the x-ray beams which are reflected from the interfaces of ZrO2/Al2O3 laminae. The HT-XRD spectra show that the intensity of the peak decreases with an increase in the anneal temperature, and at 800 °C, the peak disappears. The same samples were annealed by a rapid thermal process (RTP) at temperatures between 700 and 1000 °C for 60 s. Room temperature XRD of the RTP annealed samples shows a similar decrease in peak intensity. Transmission electronic microscope images confirm that the laminate structure is destroyed by RTP anneals and, just below the crystallization onset temperature, a homogeneous amorphous ZrAlxOy phase forms. The results demonstrate that the two artificially separated phases, ZrO2 and Al2O3 laminae, tend to mix into a homogeneous amorphous phase before crystallization. This observation indicates that the thermal stability of ZrO2-Al2O3 amorphous phase is suitable for high-k applications.

  6. Structural, vibrational and morphological properties of layered double hydroxides containing Ni2+, Zn2+, Al3+ and Zr4+ cations

    International Nuclear Information System (INIS)

    Bezerra, Débora M.; Rodrigues, João E.F.S.; Assaf, Elisabete M.

    2017-01-01

    Layered double hydroxides are anionic clays with formula [M II 1−x M III x (OH) 2 ] q+ [A n− ] q/n ·mH 2 O, finding possible uses as catalyst support, adsorbents and so on. In this paper, we address the phase formation of layered double hydroxides containing Ni 2+ , Zn 2+ , Al 3+ and Zr 4+ cations, namely, NiZn-Al, NiZn-AlZr and NiZn-Zr compositions obtained by the coprecipitation method. Such systems were characterized by X-ray diffraction, confirming the phase formation for NiZn-Al and NiZn-AlZr samples. Infrared and Raman spectroscopies elucidated the anion and water molecules occurrence in the interlayer. Nitrogen physisorption (BET method) determined the presence of pores and specific surface area. The isotherm shapes were Type IV, according to the IUPAC, and represent a mesoporous structure. A morphological study was performed by means of scanning and transmission electron microscopies, and particle size values of 120, 131 and 235 nm for NiZn-Al, NiZn-AlZr and NiZn-Zr, respectively, were determined. Thermogravimetric analysis of the decomposition of the systems revealed that their complete disintegration occurred at ~ 450 °C and resulted in mixed oxides.

  7. Site preference of Zr in Ti 3 Al and phase stability of Ti 2 ZrAl

    Indian Academy of Sciences (India)

    Calculated values of equilibrium lattice parameters, heat of formation and bulk modulus of Ti2ZrAl are presented. The basis for the structural stability and bonding are analysed in terms of the density of states. Between the two possible 2-like structures, Ti2ZrAl shows enhanced stability for the one where Zr is substituted in ...

  8. Structure of as cast L12 compounds in Al3Zr-base alloys containing Cu and Mn

    International Nuclear Information System (INIS)

    Virk, I.S.; Varin, R.A.

    1991-01-01

    It was first shown that the low symmetry, tetragonal DO 23 crystal structure of Al 3 Zr intermetallic can be changed to the related cubic L1 2 crystal structure by alloying with Ni (Al 5 NiZr 2 ) and Cu(Al 5 CuZr 2 ). It has been reported that previous work has successfully modified Al 3 Zr with Fe, Cu, Cr and Ni obtaining nearly single phase materials with L1 2 structure. However, they only studied the microstructure and mechanical properties of Fe - modified intermetallic (Al-6at% Fe-25at% Zr). The purpose of the paper is to describe and interpret experimental observations on the microstructure of Al 5 CuZr 2 and Al 66 Mn 9 Zr 25 (at.%) modifications of base Al 3 Zr intermetallic. The one modified with Mn has not been reported in literature although its Al 3 Ti - base counterpart has recently been successfully produced (3, 4)

  9. The influence of thermal treatment on the phase development in HfO2-Al2O3 and ZrO2-Al2O3 systems

    International Nuclear Information System (INIS)

    Stefanic, G.; Music, S.; Trojko, R.

    2005-01-01

    Amorphous precursors of HfO 2 -AlO 1.5 and ZrO 2 -AlO 1.5 systems covering the whole concentration range were co-precipitated from aqueous solutions of the corresponding salts. The thermal behaviour of the amorphous precursors was examined by differential thermal analysis, X-ray powder diffraction (XRD), laser Raman spectroscopy and scanning electron microscopy. The crystallization temperature of both systems increased with increase in the AlO 1.5 content, from 530 to 940 deg. C in the HfO 2 -AlO 1.5 system, and from 405 to 915 deg. C in the ZrO 2 -AlO 1.5 system. The results of phase analysis indicate an extended capability for the incorporation of Al 3+ ions in the metastable HfO 2 - and ZrO 2 -type solid solutions obtained after crystallization of amorphous co-gels. Precise determination of lattice parameters, performed using whole-powder-pattern decomposition method, showed that the axial ratio c f /a f in the ZrO 2 - and HfO 2 -type solid solutions with 10 mol% or more of Al 3+ approach 1. The tetragonal symmetry of these samples, as determined by laser Raman spectroscopy, was attributed to the displacement of the oxygen sublattice from the ideal fluorite positions. It was found that the lattice parameters of the ZrO 2 -type solid solutions decreased with increasing Al 3+ content up to ∼10 mol%, whereas above 10 mol%, further increase of the Al 3+ content has very small influence on the unit-cell volume of both HfO 2 - and ZrO 2 -type solid solutions. The reason for such behaviour was discussed. The solubility of Hf 4+ and Zr 4+ ions in the aluminium oxides lattice appeared to be negligible

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

    Energy Technology Data Exchange (ETDEWEB)

    McWhorter, Sean William [Iowa State Univ., Ames, IA (United States)

    2006-01-01

    electrons can be accounted for. A series of electronic structure calculations were performed on models with the U3Si2 and Zr3Al2 structures, using Zr and A1 as the building blocks. The starting point for these models was the U3Si2 structure, and models were created to simulate the transition from the idealized U3Si2 structure to the distorted Zr3Al2 structure. Analysis of the band structures of the models has shown that the transition from the U3Si2 structure to the Zr3Al2 structure lifts degeneracies along the Λ → Z direction, indicating a Peierls-type mechanism for the displacement occurring in the positions of the Zr atoms.

  11. Structural, vibrational and morphological properties of layered double hydroxides containing Ni{sup 2+}, Zn{sup 2+}, Al{sup 3+} and Zr{sup 4+} cations

    Energy Technology Data Exchange (ETDEWEB)

    Bezerra, Débora M. [Instituto de Química de São Carlos, Universidade de São Paulo, CP 780, CEP 13566-590 São Carlos, SP (Brazil); Rodrigues, João E.F.S. [Instituto de Física de São Carlos, Universidade de São Paulo, CP 780, CEP 13560-970 São Carlos, SP (Brazil); Assaf, Elisabete M., E-mail: eassaf@iqsc.usp.br [Instituto de Química de São Carlos, Universidade de São Paulo, CP 780, CEP 13566-590 São Carlos, SP (Brazil)

    2017-03-15

    Layered double hydroxides are anionic clays with formula [M{sup II}{sub 1−x} M{sup III}{sub x}(OH){sub 2}]{sup q+}[A{sup n−}]{sub q/n}·mH{sub 2}O, finding possible uses as catalyst support, adsorbents and so on. In this paper, we address the phase formation of layered double hydroxides containing Ni{sup 2+}, Zn{sup 2+}, Al{sup 3+} and Zr{sup 4+} cations, namely, NiZn-Al, NiZn-AlZr and NiZn-Zr compositions obtained by the coprecipitation method. Such systems were characterized by X-ray diffraction, confirming the phase formation for NiZn-Al and NiZn-AlZr samples. Infrared and Raman spectroscopies elucidated the anion and water molecules occurrence in the interlayer. Nitrogen physisorption (BET method) determined the presence of pores and specific surface area. The isotherm shapes were Type IV, according to the IUPAC, and represent a mesoporous structure. A morphological study was performed by means of scanning and transmission electron microscopies, and particle size values of 120, 131 and 235 nm for NiZn-Al, NiZn-AlZr and NiZn-Zr, respectively, were determined. Thermogravimetric analysis of the decomposition of the systems revealed that their complete disintegration occurred at ~ 450 °C and resulted in mixed oxides.

  12. A comparative study of charge trapping in HfO{sub 2}/Al{sub 2}O{sub 3} and ZrO{sub 2}/Al{sub 2}O{sub 3} based multilayered metal/high-k/oxide/Si structures

    Energy Technology Data Exchange (ETDEWEB)

    Spassov, D., E-mail: d_spassov@abv.bg [Institute of Solid State Physics, Bulgarian Academy of Sciences, Tzarigradsko Chaussee 72, Sofia 1784 (Bulgaria); Skeparovski, A. [Institute of Physics, Faculty of Natural Sciences and Mathematics, University “Ss. Cyril and Methodius”, Arhimedova 3, 1000 Skopje (Macedonia, The Former Yugoslav Republic of); Paskaleva, A. [Institute of Solid State Physics, Bulgarian Academy of Sciences, Tzarigradsko Chaussee 72, Sofia 1784 (Bulgaria); Novkovski, N. [Institute of Physics, Faculty of Natural Sciences and Mathematics, University “Ss. Cyril and Methodius”, Arhimedova 3, 1000 Skopje (Macedonia, The Former Yugoslav Republic of)

    2016-09-01

    The electrical properties of multilayered HfO{sub 2}/Al{sub 2}O{sub 3}/HfO{sub 2}/SiO{sub 2} and ZrO{sub 2}/Al{sub 2}O{sub 3}/ZrO{sub 2}/SiO{sub 2} metal-oxide semiconductor capacitors were investigated in order to evaluate the possibility of their application in charge-trapping non-volatile memory devices. The stacks were deposited by reactive radiofrequency magnetron sputtering on Si substrates with thermal SiO{sub 2} with a thickness ranging from 2 to 5 nm. Both types of stacks show negative initial oxide charge and its density is higher for HfO{sub 2}-based structures. Memory window up to 6V at sweeping voltage range of ± 16V was obtained for HfO{sub 2}-based stacks. The hysteresis in these structures is mainly due to a trapping of electrons injected from the Si substrate. The charge-trapping properties of ZrO{sub 2}-based samples are compromised by the high leakage currents and the dielectric breakdown. The conduction through the capacitors at low applied voltages results from hopping of thermally excited electrons from one isolated state to another. The energy depth of the traps participating in the hopping conduction was determined as ~ 0.7 eV for the HfO{sub 2}-based layers and ~ 0.6 eV for ZrO{sub 2}-based ones, originating from negatively charged oxygen vacancies. At high electric fields, the current voltage characteristics were interpreted in terms of space charge limited currents, Fowler–Nordheim tunneling, Schottky emission, and Poole–Frenkel mechanism. The charge retention characteristics do not depend on the thickness of the tunnel SiO{sub 2}. - Highlights: • Sputtered HfO{sub 2}/Al{sub 2}O{sub 3}/HfO{sub 2} and ZrO{sub 2}/Al{sub 2}O{sub 3}/ZrO{sub 2} charge-trapping layers were studied. • HfO{sub 2}/Al{sub 2}O{sub 3}/HfO{sub 2} stacks show memory window up to 6 V and good retention times. • Negatively charged oxygen vacancies were identified as main defects in the stacks. • Electrical breakdown compromise the charge-trapping properties

  13. Low-temperature synthesis of Li{sub 7}La{sub 3}Zr{sub 2}O{sub 12} with cubic garnet-type structure

    Energy Technology Data Exchange (ETDEWEB)

    Xie, Hui [Texas Materials Institute, ETC 9.184, University of Texas at Austin, Austin, TX 78712 (United States); Li, Yutao [Texas Materials Institute, ETC 9.184, University of Texas at Austin, Austin, TX 78712 (United States); State Key Laboratory of New Ceramics and Fine Processing, Department of Materials Science and Engineering, Tsinghua University, Beijing 100084 (China); Goodenough, John B., E-mail: jgoodenough@mail.utexas.edu [Texas Materials Institute, ETC 9.184, University of Texas at Austin, Austin, TX 78712 (United States)

    2012-05-15

    Highlights: Black-Right-Pointing-Pointer One-step synthesis and its optimization of cubic garnet Li{sub 7}La{sub 3}Zr{sub 2}O{sub 12} at 750 Degree-Sign C. Black-Right-Pointing-Pointer Instability above 800 Degree-Sign C of the Al-free cubic Li{sub 7}La{sub 3}Zr{sub 2}O{sub 12}. Black-Right-Pointing-Pointer Li{sup +}-ion conductivity without adventitious Al{sup 3+}. -- Abstract: In this paper, we report the direct synthesis of Li{sub 7}La{sub 3}Zr{sub 2}O{sub 12} with the cubic garnet-type structure at low temperature with a lattice constant of 13.0035 Angstrom-Sign . The synthesis condition is optimized to be at 750 Degree-Sign C for 8 h with 30 wt% excess lithium salt. No intermediate grinding was involved in this straightforward route. Without the adventitious of Al{sup 3+}, the cubic Li{sub 7}La{sub 3}Zr{sub 2}O{sub 12} is unstable above 800 Degree-Sign C and has an ionic conductivity of the order of 10{sup -6} S cm{sup -1}.

  14. Effect of Al2O3 on the sintering of garnet-type Li6.5La3Zr1.5Ta0.5O12

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Yuxing; Yan, Pengfei; Xiao, Jie; Lu, Xiaochuan; Zhang, Ji-Guang; Sprenkle, Vincent L.

    2016-10-01

    It is widely recognized that Al plays a dual role in the fabrication of garnet-type solid electrolytes, i.e., as a dopant that stabilizes the cubic structure and a sintering aid that facilitates the densification. However, the sintering effect of Al2O3 has not been well understood so far because Al is typically “unintentionally” introduced into the sample from the crucible during the fabrication process. In this study, we have investigated the sintering effect of Al on the phase composition, microstructure, and ionic conductivity of Li6.5La3Zr1.5Ta0.5O12 by using an Al-free crucible and intentionally adding various amounts of γ-Al2O3. It was found that the densification of Li6.5La3Zr1.5Ta0.5O12 occurred via liquid-phase sintering, with evidence of morphology change among different compositions. Among all of the compositions, samples with 0.05 mol of Al per unit formula of garnet oxide (i.e., 0.3 wt% Al2O3) exhibited the optimal microstructure and the highest total ionic conductivity of 5 10-4 S cm-1 at room temperature.

  15. Americium and plutonium in phosphates of trigonal structure (NZP type) Am1/3[Zr2(PO4)3] and Pu1/4[Zr2(PO4)3

    International Nuclear Information System (INIS)

    Bykov, D.M.; Orlova, A.I.; Tomilin, S.V.; Lizin, A.A.; Lukinykh, A.N.

    2006-01-01

    Am 1/3 [Zr 2 (PO 4 ) 3 ] and Pu 1/4 [Zr 2 (PO 4 ) 3 ] phosphates are synthesized and are investigated by X-ray diffraction method. Compounds have triclinic lattices and lattice parameters are determined. Possibility of actinide inclusion into hollows of framework of NZP type is shown for the first time. It is proposed that inclusion of Pu and Am highly-charged cations into framework hollows decreases crystal structure symmetry up to primitive trigonal one. Rate of Pu leaching from ceramics on Pu 1/4 [Zr 2 (PO 4 ) 3 ] basis are measured [ru

  16. Dynamic compaction of Al2O3-ZrO2 compositions

    International Nuclear Information System (INIS)

    Tunaboylu, B.; McKittrick, J.; Nutt, S.R.

    1994-01-01

    Shock compaction of Al 2 O 3 -ZrO 2 binary and ternary powder compositions resulted in dense, one-piece samples without visible cracks for pressures ≤12.6 GPa. Dynamic pressures were achieved by using a 6.5-m-long two-state gas gun. It is believed that plastic deformation by dislocation slip of α-Al 2 O 3 partially accommodates the tensile stresses created during the release of shock pressures. A fine and narrow particle size distribution is necessary to achieve high bulk densities, but the bulk structural integrity was not strongly related to the distribution. A high-pressure phase of ZrO 2 , which was formed from the monoclinic polymorph, was found at and above shock pressure of 6.3 GPa. No evidence of the orthorhombic cotunnite structure was observed. Compaction of glassy and submicrocrystalline rapidly solidified starting materials showed good structural integrity, although the bulk density was relatively low. It is not clear what the densification/bonding mechanism is in these materials, although it appears not to be plastic deformation. Microstructural analysis showed that fine and uniform microstructures are retained after compaction at appropriate dynamic pressures for all compositions, with some interparticle cohesion present

  17. Effect of ZrB{sub 2} particles on the microstructure and mechanical properties of hybrid (ZrB{sub 2} + Al{sub 3}Zr)/AA5052 insitu composites

    Energy Technology Data Exchange (ETDEWEB)

    Gautam, Gaurav, E-mail: gauravgautamm1988@gmail.com; Mohan, Anita, E-mail: amohan.app@iitbhu.ac.in

    2015-11-15

    Present study outlines the effect of ZrB{sub 2} particles variation on the morphology and mechanical properties of (ZrB{sub 2}+Al{sub 3}Zr)/AA5052Al alloy composites. Composites with varying amount of ZrB{sub 2} particles have been produced by direct melt reaction (DMR) technique. These composites have been characterized by X-ray diffractometer (XRD) and energy-dispersive spectroscopy (EDS) to confirm the presence of ZrB{sub 2} and Al{sub 3}Zr particles. Optical microscopy (OM) and scanning-electron microscopy (SEM) have been used to understand the morphology. To see the effect of ZrB{sub 2} variation on mechanical properties, hardness and tensile properties have been evaluated. The XRD and EDS results confirm the successful formation of ZrB{sub 2} particles in matrix of AA5052Al alloy. SEM and TEM studies exhibit that ZrB{sub 2} particles are mostly in hexagonal and some rectangular shape while Al{sub 3}Zr particles are in polyhedron and rectangular shapes. Most of ZrB{sub 2} particles are within a size range of 10–190 nm. Interface region is free of any impurity. OM studies show grain refinement of AA5052Al alloy matrix with formation of second phase ZrB{sub 2} particles. Tensile results indicate that the UTS and YS improve up to 3 vol.% of ZrB{sub 2} but beyond this composition a decreasing trend is observed. The strength coefficient increases with increase in ZrB{sub 2} particles up to 3 vol.% in the Al{sub 3}Zr/Al alloy composites, whereas strain hardening decreases. While beyond 3 vol.% ZrB{sub 2} particles in the Al{sub 3}Zr/Al alloy composite, opposite trend is observed in strength coefficient and strain hardening. Percentage elongation also improves with 1vol.% ZrB{sub 2}, but further addition of ZrB{sub 2} shows an adverse effect. However, a continuous increasing trend has been observed in bulk hardness. Fracture studies show facets of Al{sub 3}Zr particles and dimples of matrix, but with inclusion of ZrB{sub 2} dimple size decreases. Increase in Zr

  18. Al{sub 2}O{sub 3} reinforced nanoparticle ZrO{sub 2} (3at%?Y{sub 2}O{sub 3}); Al{sub 2}O{sub 3} reforcado com nanoparticulas de ZrO{sub 2}(3%mol Y{sub 2}O{sub 3})

    Energy Technology Data Exchange (ETDEWEB)

    Cossu, C.M.F.A.; Alves, M.F.R.P.; Campos, L.Q.B.; Magnago, R.O.; Santos, C., E-mail: caio.cossu@usp.br [Universidade do Estado do Rio de Janeiro (UERJ), Resende, RJ (Brazil). Faculdade de Tecnologia; Simba, B.G. [Universidade Estadual Paulista Julio de Mesquita Filho (UNESP), Guaratingueta, SP (Brazil). Faculdade de Engenharia

    2016-07-01

    This work developed a composite Al{sub 2}O{sub 3}-based reinforced with nanoparticles of ZrO{sub 2} (Y{sub 2}O{sub 3}), to evaluate the effect of the content of ZrO{sub 2} nanoparticles (Y{sub 2}O{sub 3}) on the mechanical properties. Mixtures containing a matrix of Al{sub 2}O{sub 3} with fractions in weight of 3%, 5%, 10% and 15%, ZrO{sub 2} (Y{sub 2}O{sub 3}), and were mixed in mortar mill. Mixtures received 5% polymeric binder (PVA); and after adding the binder, the material was pressed uniaxially to 50MPa, and then sintered at a temperature of 1600 ° C - 2h. The sintered products were characterized by X-ray diffraction, scanning electron microscopy (SEM), relative density, hardness and fracture toughness. The results of X-ray diffraction showed that Al{sub 2}O{sub 3} and tetragonal ZrO{sub 2} as crystal phases found after sintering. Furthermore, the relative green density of 55% was predominant in the compact; and after sintering, varied depending on the ZrO{sub 2} content, reaching 97% in sintered compositions with 3% ZrO{sub 2} nanoparticles (Y{sub 2O}3). The hardness of the samples showed values of 1670HV and the maximum toughness of 3.2 MPa × m{sup 1/2}, directly influenced by the presence of nanoparticles ZrO{sub 2} uniformly dispersed in the matrix Al{sub 2}O{sub 3}, which results in at least two main mechanisms tenacifiers: transformation of tetragonal-monoclinic phase of zirconia, and compressive residual strain between the two phases present, Al{sub 2}O{sub 3} and tetragonal ZrO{sub 2}. (author)

  19. Effect of titanium and calcium oxide additions on Zr2O2 polymorphism during Al2O3+Zr2O2 mixture fusion

    International Nuclear Information System (INIS)

    Gladkov, V.E.; Zhekhanova, N.B.; Fotiev, A.A.; Viktorov, V.V.; Ivashinnikov, V.T.; Zubov, A.S.

    1985-01-01

    The effect of titanium and calcium containing additions introduced into the Al 2 O 3 +ZrO 2 melt on the phase composition and temperature ranges of ZrO 2 polymorphous transformation in the material is investigated. It is shown that introducing sponge titanium into the 70Al 2 O 3 +30ZrO 2 prepared composition melt (mass. %) with its subsequent intensive cooling one can conserve upto room temperatures 50-70% of ZrO 2 metastable tetragonal modification and therefore reduce the volume changes causing metal cracking. Calcium oxide doping stabilizes the ZrO 2 cubic modification and reduces α-Al 2 O 3 content due to formation of aluminates

  20. Effects of Al content on structure and mechanical properties of hot-rolled ZrTiAlV alloys

    International Nuclear Information System (INIS)

    Liang, S.X.; Yin, L.X.; Che, H.W.; Jing, R.; Zhou, Y.K.; Ma, M.Z.; Liu, R.P.

    2013-01-01

    Highlights: • Phase structure is greatly dependent on the Al content. • Intermetallic compound will precipitates while Al content is over 6.9 wt%. • Equiaxed α-phase grains present in the hot-rolled alloy with 6.9 wt% Al. • Alloys with Al content from 3.3 wt% to 5.6 wt% have good mechanical properties. - Abstract: Zirconium alloys show attractive properties for astronautic applications where the most important factors are anti-irradiation, corrosion resistance, anti-oxidant, very good strength-to-weight ratio. The effects of Al content (2.2–6.9 wt%) on structure and mechanical properties of the hot-rolled ZrTiAlV alloy samples were investigated in this study. Each sample of the hot-rolled ZrTiAlV alloys with Al contents from 2.2 wt% to 5.6 wt% is composed of the α phase and β phase, meanwhile, the relative content of the α phase increased with the Al content. However, the (ZrTi) 3 Al intermetallic compound was observed as the Al content increased to 6.9 wt%. Changes of phase compositions and structure with Al content distinctly affected mechanical properties of ZrTiAlV alloys. Yield strength of the alloy with 2.2 wt% Al is below 200 MPa. As Al content increased to 5.6 wt%, the yield strength, tensile strength and elongation of the examined alloy are 1088 MPa, 1256 MPa and 8%, respectively. As Al content further increased to 6.9 wt%, a rapid decrease in ductility was observed as soon as the (ZrTi) 3 Al intermetallic compound precipitated. Results show that the ZrTiAlV alloys with Al contents between 3.3 wt% and 5.6 wt% have excellent mechanical properties

  1. GdCuMg with ZrNiAl-type structure. An 82.2 K ferromagnet

    Energy Technology Data Exchange (ETDEWEB)

    Stein, Sebastian; Heletta, Lukas; Poettgen, Rainer [Muenster Univ. (Germany). Inst. fuer Anorganische und Analytische Chemie

    2017-08-01

    GdCuMg has been synthesized by induction-melting of the elements in a sealed niobium ampoule followed by annealing in a muffle furnace. The sample was studied by powder and single crystal X-ray diffraction: ZrNiAl type, P anti 62m (a=749.2(4), c=403.3(1) pm), wR2=0.0242, 315 F{sup 2} values and 15 variables. Temperature dependent magnetic susceptibility measurements have revealed an experimental magnetic moment of 8.54(1) μ{sub B} per Gd atom. GdCuMg orders ferromagnetically below T{sub C}=82.2(5) K and based on the magnetization isotherms it can be classified as a soft ferromagnet.

  2. Structural stability of ternary C22–Zr6X2Co (X=Al, Ga, Sn, As, Sb, Bi, Te) and C22–Zr6Sn2T′ (T′=Fe, Co, Ni, Cu) compounds

    International Nuclear Information System (INIS)

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

    2013-01-01

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

  3. Laser-joined Al{sub 2}O{sub 3} and ZrO{sub 2} ceramics for high-temperature applications

    Energy Technology Data Exchange (ETDEWEB)

    Boerner, Floriana-Dana, E-mail: floriana.boerner@tu-dresden.d [Dresden University of Technology (TU Dresden), Institute of Power Engineering, Chair of Hydrogen Technology and Nuclear Power Engineering, George-Baehr-Str. 3, D-01062 Dresden (Germany); Lippmann, Wolfgang, E-mail: wolfgang.lippmann@tu-dresden.d [Dresden University of Technology (TU Dresden), Institute of Power Engineering, Chair of Hydrogen Technology and Nuclear Power Engineering, George-Baehr-Str. 3, D-01062 Dresden (Germany); Hurtado, Antonio, E-mail: antonio.hurtado@tu-dresden.d [Dresden University of Technology (TU Dresden), Institute of Power Engineering, Chair of Hydrogen Technology and Nuclear Power Engineering, George-Baehr-Str. 3, D-01062 Dresden (Germany)

    2010-10-01

    A laser process is presented that has been specially developed for joining oxide ceramics such as zirconium oxide (ZrO{sub 2}) and aluminium oxide (Al{sub 2}O{sub 3}). It details, by way of example, the design of the laser process applied for to producing both Al{sub 2}O{sub 3}-Al{sub 2}O{sub 3} and ZrO{sub 2}-ZrO{sub 2} joints using siliceous glasses as fillers. The heat source used was a continuous wave diode laser with a wavelength range of 808-1010 nm. Glasses of the SiO{sub 2}-Al{sub 2}O{sub 3}-B{sub 2}O{sub 3}-MeO system were developed as high-temperature resistant brazing fillers whose expansion coefficients, in particular, were optimally adapted to those of the ceramics to be joined. Specially designed measuring devices help to determine both the temperature-dependent emission coefficients and the synchronously determined proportions of reflection and transmission. The glass-ceramic joints produced are free from gas inclusions and macroscopic defects and exhibit a homogenous structure. The average strength values achieved were 158 MPa for the Al{sub 2}O{sub 3} system and 190 MPa for the ZrO{sub 2} system, respectively.

  4. Structural and catalytic characterization of mechanical mixtures of Pt/WOx-ZrO2 and Al2O3

    International Nuclear Information System (INIS)

    Contreras, J.L.; Fuentes, G.A.; Navarrete, J.; Vazquez, A.; Zeifert, B.; Salmones, J.; Nuno, L.

    2010-01-01

    The effect of the Bronsted/Lewis acid ratio on isomerization of n-heptane using Al 2 O 3 as a source of Lewis acidity and WOx/ZrO 2 as a source of Bronsted and Lewis acidity was studied and controlled using mechanical mixtures of these solids. These mixtures were characterized by surface area, infrared spectroscopy of pyridine, X-ray diffraction and Raman spectroscopy. It was found that the presence of W=O stretching mode which was consistent with the presence of oxotungstate species which were the precursors of the acid sites. It was found out that as the oxotungstate structures increased, the selectivity to n-heptane isomers increased while the hydrocracking and dehydrocyclization selectivity decreased. The presence of Bronsted acidity of the WOx/ZrO 2 domains, the increase of Knudsen diffusivity and the loss of Pt metallic area by strong interaction of the Pt with the WOx/ZrO 2 explain this catalytic behavior.

  5. Properties of slip-cast transformation-toughened β''-Al2O3/ZrO2 composites

    International Nuclear Information System (INIS)

    Green, D.J.; Metcalf, M.G.

    1984-01-01

    The aim of this study was to fabricate β''-Al 2 O 3 /ZrO 2 composites by an alternative procedure than the dry-pressing route chosen by Lange et al. or Viswanathan et al. and to determine the amount of ZrO 2 that can be used to maximize the fracture toughness without significantly affecting the ionic resistivity. The fabrication technique chosen was that of slip casting, as this approach should allow the ZrO 2 phase to be well dispersed without the detrimental presence of agglomerates, which can act as failure origins in ceramics. Slip casting is a well-established ceramic fabrication technique and is versatile in being able to produce rather complex shapes. It has been used previously to fabricate β-Al 2 O 3 . In the present study, it was decided to perform the slip casting using organic media as water reacts with β''-Al 2 O 3 and leaches out the sodium by ion exchange and can significantly influence the ionic conductivity. It was important, therefore, to identify suitable organic media that could be used to control the dispersion of the β''-Al 2 O 3 and ZrO 2 powders and identify the important processing parameters that would give rise to a fine-grained microstructure in which the ZrO 2 was well dispersed and retained in its tetragonal form

  6. Compressive strain-dependent bending strength property of Al2O3-ZrO2 (1.5 mol% Y2O3) composites performance by HIP

    International Nuclear Information System (INIS)

    Reyes-Rojas, A.; Esparza-Ponce, H.; De la Torre, S.D.; Torres-Moye, E.

    2009-01-01

    Nanometric powders and sintered ceramics of Al 2 O 3 -ZrO 2 (1.5 mol% Y 2 O 3 ) prepared by hot isostatic pressing HIP have been studied. A detailed crystallographic study has been performed through X-ray diffraction, Williamson-Hall method, Rietveld method and high-resolution electron microscopy HREM analysis. The crystallographic structure data, such as domain size, lattice parameters, wt% phase, and micro-strain direction have been obtained using Rietveld refinement and Williamson-Hall methods. The results revealed that the compressive strain (ε) increased from 0.56 to 1.18 (10 -3 ) as the t-ZrO 2 content increased too. The HREM interface study conducted along the [0 0 0 1]Al 2 O 3 ||[0 0 1]ZrO 2 zone axis revealed a micro-strain lattice distortion accumulated at the grain boundary due to the ZrO 2 martensitic phase transformation on cooling, t-ZrO 2 grains coalescence and to the grain growth of α-Al 2 O 3 which cause elongated tetragonal crystals. Micro-strain lattice distortion is adjusted by the shear displacements of the planes (1 1 0) and (11-bar0) along [1-bar10] and [1-bar1-bar0] crystallographic directions, respectively; these planes are arrested by the (101-bar0) alumina plane. In this case, semi-coherent interfaces were observed along the grain boundary. It is verified that the bending strength increased in connection with the strain accumulation and amount of tetragonal structure

  7. Hydrogenation of FeCoZr-Al2O3 nanocomposites studied by Moessbauer spectroscopy and magnetometry

    International Nuclear Information System (INIS)

    Saad, A.; Kasiuk, J.; Fedotova, J.; Szilagyi, E.; Przewoznik, J.; Kapusta, Cz.; Marszalek, M.

    2009-01-01

    Hydrogenation effects on crystalline and magnetic structure of nanocomposites (FeCoZr) x (Al 2 O 3 ) 100-x , 38 ≤ x ≤ 63 at.% are studied by 57 Fe Moessbauer spectroscopy and magnetometry. Variations of local structure, blocking temperature and mean FeCoZr nanoparticles' volume are discussed with respect to (i) composition and (ii) two competing processes-H 2 incorporation and annealing-occurred during treatment in H 2 plasma.

  8. Design of high-temperature high-strength Al-Ti-V-Zr alloys

    International Nuclear Information System (INIS)

    Lee, H.M.

    1990-01-01

    This paper reports that it seems plausible to develop high-strength Al-base alloys useful up to 698K in view of the behavior of nickel base superalloys which resist degradation of mechanical properties to 75 pct of their absolute melting temperature. For high temperature Al alloys, the dispersed hardening phase must not undergo phase transformation to an undesirable phase during long time exposure at the temperature of interest. An additional factor to be considered is the stability of the hardening phase with respect to Ostwald ripening. This coarsening resistance is necessary so that the required strength level can be maintained after the long-time service at high temperatures. The equilibrium crystal structures of Al 3 Ti, Al 3 V and Al 3 Zr are tetragonal D0 22 , D0 22 and D0 23 , respectively. At the temperatures of interest, around 698K, vanadium and titanium are mutually substitutable in the form of Al 3 (Ti, V). Much of titanium and vanadium can be substituted for zirconium in the D0 23 - type Al 3 Zr compound, creating Al 3 (Ti, Zr) and Al 3 (V, Zr), respectively. In particular, it has been reported that fcc L1 2 -structured Al 3 M dispersoids form in the rapidly solidified Al-V-Zr and Al-Ti-Zr systems and both L1 2 and D0 23 -structured Al 3 M phases showed slow coarsening kinetics

  9. X-ray study of rapidly cooled ribbons of Al-Cr-Zr and Al-Ni-Y-Cr-Zr alloys

    International Nuclear Information System (INIS)

    Betsofen, S.Ya.; Osintsev, O.E.; Lutsenko, A.N.; Konkevich, V.Yu.

    2002-01-01

    One investigated into phase composition, lattice spacing and structure of rapidly cooled 25-200 μm gauge strips made of Al-4,1Cr-3,2Zr and Al-1,5Cr-1,5Zr-4Ni-3Y alloys, wt. %, produced by melt spinning to a water-cooled copper disk. In Al-4,1Cr-3,2Zr alloy one detected intermetallic phases: Al 3 Zr and two Al 86 Cr 14 composition icosahedral phases apart from aluminium solid solution with 4.040-4.043 A lattice spacing. In Al-1,5Cr-1,5Zr-4Ni-3Y alloy one identified two Al 86 Cr 14 icosahedral phases and two AlNiY and Al 3 Y yttrium-containing ones, lattice spacing of aluminium solid solution was equal to 4.052-4.053 A [ru

  10. Novel Ni-Ce-Zr/Al2O3 Cellular Structure for the Oxidative Dehydrogenation of Ethane

    Directory of Open Access Journals (Sweden)

    Juan Pablo Bortolozzi

    2017-11-01

    Full Text Available A novel γ-alumina-supported Ni-Ce-Zr catalyst with cellular structure was developed for oxidative dehydrogenation of ethane (ODHE. First, powdered samples were synthesized to study the effect of both the total metal content and the Ce/Zr ratio on the physicochemical properties and performance of these catalysts. All synthesized powdered samples were highly active and selective for ODHE with a maximum ethylene productivity of 6.94 µmolethylene gact cat−1 s−1. According to the results, cerium addition increased the most reducible nickel species population, which would benefit ethane conversion, whereas zirconium incorporation would enhance ethylene selectivity through the generation of higher amounts of the least reducible nickel species. Therefore, the modification of active site properties by addition of both promoters synergistically increases the productivity of the Ni-based catalysts. The most efficient formulation, in terms of ethylene productivity per active phase amount, contained 15 wt% of the mixed oxide with Ni0.85Ce0.075Zr0.075 composition. This formulation was selected to synthesize a Ni-Ce-Zr/Al2O3 structured body by deposition of the active phase onto a homemade γ-alumina monolith. The structured support was manufactured by extrusion of boehmite-containing dough. The main properties of the Ni0.85Ce0.075Zr0.075 powder were successfully preserved after the shaping procedure. In addition, the catalytic performance of the monolithic sample was comparable in terms of ethylene productivity to that of the powdered counterpart.

  11. Precipitation structures and mechanical properties of Al-Li-Zr alloy containing V

    International Nuclear Information System (INIS)

    Ying, J.K.; Ohashi, T.

    1999-01-01

    It is known that Al-Li alloys possess high elastic modulus and low density, and the metastable δ' (Al 3 Li) precipitate in these alloys affords considerable strengthening effect. However, with the strengthening resulting from the precipitation of δ' which is coherent with the matrix, these alloys suffer from low ductility and fracture toughness. It seems that the loss of ductility is the slip localization which occurs as a result of slip planes during deformation in connection with the specific hardening mechanism. As a result it indicates typical intergranular fracture. On the one hand, zirconium is used in many aluminum alloys to inhibit recrystallization during alloy processing. When zirconium is present in the alloy grain refinement occurs, which consequently, is considered as a factor that reduces the slip distance, and lowers the stress concentration across grain boundaries and at grain boundary triple points. Nevertheless, if only zirconium is added in Al-Li alloy it still shows intergranular fracture. By Zedaris et al., equilibrium phase Al 3 (Zr,V) in Al-Zr alloy containing V reduces the lattice mismatch along the c-axis with Al and, the L1 2 -structure metastable precipitates Al 3 (Zr,V) in Al-Zr-V alloys are stable at elevated temperature. Therefore, it is interesting to elucidate the effect of V in Al-Li-Zr alloy at the precipitation structures and mechanical properties of these alloys

  12. Field ion microscopy and 3-D atom probe analysis of Al3Zr particles in 7050 Al alloy

    International Nuclear Information System (INIS)

    Sha, G.; Cerezo, A.

    2004-01-01

    Full text: For high strength 7xxx series Al alloys, Zr is an important trace alloy element which is often added to optimise properties, having effects such as refining grain size, inhibiting recrystallization, and improving stress corrosion cracking resistance and quench sensitivity. In addition, it has been reported recently that Zr addition also has a significant influence on early stage ageing behaviour of a 7xxx series Al alloy. Zr equilibrium solubility in solid Al is extremely low. After solution or ageing treatment, most Zr is present as small spherical Ai 3 Zr dispersoids approximately 20 nm in diameter, distributed at grain boundaries as well as within the Al matrix. The crystallographic nature of intermetallic phase Al 3 Zr has been well studied in the literatures. So far, no direct measurement of the chemistry of the Al 3 Zr particles in 7xxx series Al alloys has been published. It is unclear if there is significant Zn, Mg or Cu included in the particles. In this research, 3DAP has been employed for the first time to investigate ionisation behaviour of Al 3 Zr particles and determine the chemistry of the particles in 7050 Al alloy. Using field ion microscopy, the local evaporation radius of the Al 3 Zr particle has been measured to be equivalent to 36 nm for a 10 kV tip, less than the equivalent tip radius for the Al matrix of ∼68 nm. Using the matrix Al evaporation field (19 V/nm) as a reference, this allows the evaporation field of Al 3 Zr to be calculated as 35 V/nm, the same as the field calculated for evaporation of Al as Al 2+ (35 V/nm), and that of Zr as Zr 3+ (35 V/nm). This result is consistent with Al 2+ and Zr 3+ being the main species observed in the mass spectrum during analysis of Al 3 Zr particles. Using 3DAP, the chemical compositions of Al 3 Zr particles are determined to be 64.8∼67.7 at% Al, 23.6∼24.8 at% Zr, 6.9∼9.1 at% Zn, 0.4∼0.7 at% Cu, 0.5∼1.2 at% Mg, with a (Al+Zn)/Zr ratio close to 3. Choice of specimen temperature of

  13. Epitaxial thin-film growth of Ruddlesden-Popper-type Ba3Zr2O7 from a BaZrO3 target by pulsed laser deposition

    International Nuclear Information System (INIS)

    Butt, Shariqa Hassan; Rafique, M.S.; Siraj, K.; Latif, A.; Afzal, Amina; Awan, M.S.; Bashir, Shazia; Iqbal, Nida

    2016-01-01

    Ruddlesden-Popper Ba 3 Zr 2 O 7 thin films have been synthesized via pulsed laser deposition (PLD) technique. The optimization of deposition parameters in PLD enables the formation of thin film of metastable Ba 3 Zr 2 O 7 phase from BaZrO 3 target. In order to see the post-annealing effects on the structural and optical properties, the deposited Ba 3 Zr 2 O 7 thin films were annealed at 500, 600 and 800 C. X-ray diffraction (XRD) reveals the formation of Ba 3 Zr 2 O 7 phase with tetragonal structure. The changes in the surface of the deposited films were analysed by FE-SEM and AFM. The thin film post-annealed at 500 C exhibited the best structural, optical and surface properties. Furthermore, the chemical states and chemical composition of the films were determined by X-ray photoelectron spectroscopy (XPS) near the surface. The XPS results show that Ba, Zr and O exist mainly in the form of Ba 3 Zr 2 O 7 Ruddlesden-Popper-type perovskite structure. (orig.)

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

    Energy Technology Data Exchange (ETDEWEB)

    Colinet, Catherine, E-mail: ccolinet@simap.grenoble-inp.fr [Science et Ingénierie des Matériaux et Procédés, Grenoble INP, UJF, CNRS, 38402 Saint Martin d’Hères, Cedex (France); Crivello, Jean-Claude [ICMPE-CMTR, CNRS UMR-7182, 2-8 rue Henri Dunant, 94320 Thiais (France); Tedenac, Jean-Claude [Institut de Chimie Moléculaire et des Matériaux I.C.G., UMR-CNRS 5253, Université Montpellier II, Place E. Bataillon, 34095 Montpellier Cedex 5 (France)

    2013-09-15

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

  15. Preparation of Cu/La{sub 2}O{sub 3}-ZrO{sub 2}-Al{sub 2}O{sub 3} catalyst and its catalytic properties for selective reduction of NO

    Energy Technology Data Exchange (ETDEWEB)

    Xi-kun Guo; Ping-ping Xie; Shu-dong Lin [Shantou University, Shantou (China). Department of Chemistry

    2008-12-15

    An La{sub 2}O{sub 3}-ZrO{sub 2}-Al{sub 2}O{sub 3} composite support was prepared by co-precipitation with the mixed aqueous solution of La(NO{sub 3}{sub 3}, Al(NO{sub 3){sub 3}, and ZrOCl{sub 2} dropping into the precipitant of (NH{sub 4})2CO{sub 3} aqueous solution. The Cu/La{sub 2}O{sub 3}-ZrO{sub 2}-Al{sub 2}O{sub 3} catalyst was prepared by the impregnation of La{sub 2}O{sub 3}-ZrO{sub 2}-Al{sub 2}O{sub 3} with active component Cu{sup 2+} aqueous solution. The effects of the catalyst on the selective catalytic reduction of NO with propylene in excess oxygen were investigated. The relationships between the preparation method, structure and properties of the Cu/La{sub 2}O{sub 3}-ZrO{sub 2}-Al{sub 2}O{sub 3} catalyst were also explored by means of scanning electron microscopy (SEM), X-ray diffraction (XRD), surface area measurements (BET), pyridine absorption infrared spectrum (Py-IR), thermal gravimetry (TG), and temperature-programmed reduction (TPR). The results indicate that the support {gamma}-Al{sub 2}O{sub 3} prepared by Al(NO{sub 3})3 dropping into (NH{sub 4}{sub 2} CO{sub 3} can remarkably enlarge the surface area; the addition of La{sub 2}O{sub 3} contributes mainly to the enhancement of the thermal stability; and the introduction of ZrO{sub 2} can increase the amount of Lewis and Broenstead acid. Consequently, the catalyst Cu/La{sub 2}O{sub 3}-ZrO{sub 2}-Al{sub 2}O{sub 3} has excellent activity for the selective reduction of NO with propylene in excess oxygen. NO conversion is up to 88.9% at 300{sup o}C and 81.9% even at the presence of 10% volume fraction of water vapor. 15 refs., 8 figs., 1 tab.

  16. Phase equilibria of Al3(Ti,V,Zr) intermetallic system

    International Nuclear Information System (INIS)

    Park, S.I.; Han, S.Z.; Choi, S.K.; Lee, H.M.

    1996-01-01

    Trialuminides such as DO 22 -structured Al 3 Ti are promising candidates as potential materials for elevated temperature applications because of their attractive high temperature strength and excellent oxidation resistance along with their low density. However, in the tetragonal structure, slip systems are restricted due to low symmetry and the primary deformation mode is twinning. And, therefore, monolithic trialuminide compounds have been very impractical to be used as structural materials. When transition elements such as Ti, V and Zr which constitute trialuminides are alloyed in aluminum, they have low solubilities and low diffusion coefficients in the Al matrix. If precipitated as trialuminide intermetallics, they maintain a small lattice mismatch with the Al matrix, which reduces the interfacial energy between matrix and precipitates. As a result, these precipitates would have a large coarsening resistance in the matrix. As most of the previous works have been concentrated on the microstructural stability and mechanical properties, thermochemical properties will be treated in this work. In this study, phase equilibria and diagrams of Al 3 (Ti,V,Zr) systems will be experimentally determined and then thermodynamically analyzed with a hope to extend to the Al-Al 3 (Ti,V,Zr) composite system. This approach will then be used as a guide for alloy design of Al-Al 3 (Ti,V,Zr) composite system

  17. Low silicon U(Al,Si)3 stabilization by Zr addition

    International Nuclear Information System (INIS)

    Pizarro, L.M.; Alonso, P.R.; Rubiolo, G.H.

    2009-01-01

    Previous knowledge states that (U,Zr)Al 3 and U(Al,Si) 3 phases with Zr and Si content higher than 6 at.% (7.7 wt%) and 4 at.% (1.4 wt%), respectively, does not partially transform to UAl 4 at 600 o C. In this work, four alloys within the quaternary system U-Al-Si-Zr were made with a fixed nominal 0.18 at.% (0.1 wt%) Si content in order to assess the synergetic effect of both Zr and Si alloying elements to the thermodynamic stability of the (U,Zr)(Al,Si) 3 phase. Heat treatments at 600 deg. C were undertaken and samples were analyzed by means of XRD, EPMA and EDS techniques. A remarkable conclusion is that addition of 0.3 at.% Si in the (U,Zr)(Al,Si) 3 phase reduces in 2.7 at.% the necessary Zr content to inhibit its transformation to U(Al,Si) 4 .

  18. Disordering and amorphization of Zr3Al by 3.8 MeV Zr3+ ion bombardment

    International Nuclear Information System (INIS)

    Chen, F.C.; Ardell, A.J.

    1991-01-01

    The ordered intermetallic compound Zr 3 Al was irradiated with 3. 8 MeV Zr 3+ ions at various fluences up to 5 x 10 12 tons/mm 2 at a temperature of 250 degrees C and the irradiation- induced microstructures were investigated by transmission electron microscopy. Disordering began at the lowest dose, 0.0033 dpa, and complete loss of chemical long-range order occurred at a dose of 0.33 dpa. The onset of amorphization was also observed at this dose. Electron diffraction patterns from irradiated samples showed satellite reflections along in thin foils in [100] orientation and streaking along in foils oriented [011]. These diffraction effects are attributed to the presence of irradiation-induced microstructural defects that, when imaged in dark field, resemble rows of dislocation loops. A model of these arrays of loops, which are suggested to have Burgers vectors of the Frank type, is proposed. The model accounts for the contrast effects observed in the images and the streaking and satellites seen in the diffraction patterns. At the highest dose, 1.6 dpa, a new phase, Zr 5 Al 3 , appeared unexpectedly, most likely as a consequence of irradiation-induced solute segregation

  19. Structural and catalytic characterization of mechanical mixtures of Pt/WOx-ZrO{sub 2} and Al{sub 2}O{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Contreras, J.L., E-mail: jlcl@correo.azc.uam.m [Universidad Autonoma Metropolitana-Azcapotzalco, CBI, Dpto. Energia, Av. Sn. Pablo 180, Col. Reynosa, C.P. 02200, Mexico, DF (Mexico); Fuentes, G.A. [Universidad Autonoma Metropolitana-Iztapalapa, CBI, Depto. de IPH C.P. 09340, Mexico, DF (Mexico); Navarrete, J.; Vazquez, A. [Instituto Mexicano del Petroleo, IBP, Ger. de Catalizadores, Eje Central Lazaro Cardenas No. 152, C.P. 07300, Mexico, DF (Mexico); Zeifert, B.; Salmones, J. [Instituto Politecnico Nacional Mexico, ESIQIE, Laboratorio de Catalisis y Materiales, C.P. 07738, Mexico, DF (Mexico); Nuno, L. [Universidad Autonoma Metropolitana-Azcapotzalco, CBI, Dpto. Energia, Av. Sn. Pablo 180, Col. Reynosa, C.P. 02200, Mexico, DF (Mexico)

    2010-04-16

    The effect of the Bronsted/Lewis acid ratio on isomerization of n-heptane using Al{sub 2}O{sub 3} as a source of Lewis acidity and WOx/ZrO{sub 2} as a source of Bronsted and Lewis acidity was studied and controlled using mechanical mixtures of these solids. These mixtures were characterized by surface area, infrared spectroscopy of pyridine, X-ray diffraction and Raman spectroscopy. It was found that the presence of W=O stretching mode which was consistent with the presence of oxotungstate species which were the precursors of the acid sites. It was found out that as the oxotungstate structures increased, the selectivity to n-heptane isomers increased while the hydrocracking and dehydrocyclization selectivity decreased. The presence of Bronsted acidity of the WOx/ZrO{sub 2} domains, the increase of Knudsen diffusivity and the loss of Pt metallic area by strong interaction of the Pt with the WOx/ZrO{sub 2} explain this catalytic behavior.

  20. Development of an elevated temperature aluminum alloy containing Al3X-type dispersed phases

    International Nuclear Information System (INIS)

    Zedalis, M.S.

    1985-01-01

    The extents of solid solubility in the equilibrium, tetragonal Al 3 X-type dispersed phases (X represents binary and ternary combinations of Hf, Ti, V, and Zr) were examined using powder x-ray diffraction methods. Minimum lattice disregistry (delta) with the Al(ss) matrix was achieved by maximizing the amount of Ti or V added to the Al 3 Hf and/or Al 3 Zr phases without forming a co-intermetallic compound exhibiting a DO 22 crystal structure. In comparison to Al 3 Zr, with a (delta) equal to 2.88%, the addition of V to Al 3 Zr in the ratio 7:1, i.e., Al 3 (v/sub 0.875/Zr/sub 0.125/), results in a decrease in (delta) by approximately 17%. Electron diffraction revealed that the addition of V to the metastable cubic (L1 2 ) Al 3 Zr phase also resulted in a reduction in the lattice disregistry across the precipitate/matrix boundary. In comparison with the cubic Al 3 Zr phase, with a (delta) of approximately 1.0%, the Al 3 (V/sub 0.875/Zr/sub 0.125/) phase exhibits a mismatch of approximately -0.14%. The cubic Al 3 (V/sub 0.875/Zr/sub 0.125/) phase was observed by TEM to be substantially more stable, i.e., resist transformation to the equilibrium tetragonal phase, when compared to the cubic Al 3 Zr phase. It is proposed that a reduction in lattice disregistry results in a decrease in the strain energy component of the system's total free energy. A systematic decrease in the coarsening rate with a reduction in the lattice disregistry for the cubic Al 3 Zr, Al 3 (V/sub 0.725/Zr/sub 0.275/) and Al 3 (V/sub 0.875/Zr/sub 0.125/) and tetragonal Al 3 Zr and Al 3 (V/sub 0.875/Zr/sub 0.125/) phases is proposed to be representative of a decrease in the interfacial energy across the precipitate/matrix boundary

  1. ZrCu2P2 and HfCu2P2 phosphides and their crystal structure

    International Nuclear Information System (INIS)

    Lomnitskaya, Ya.F.

    1986-01-01

    Isostructural ZrCu 2 P 2 and HfCu 2 P 2 compounds are prepared for the first time. X-ray diffraction analysis (of powder, DRON-2.0 diffractometer, FeKsub(α) radiation) was used to study crystal structure of HfCu 2 P 2 phosphide belonging to the CaAl 2 Si 2 structural type (sp. group P anti 3 m 1, R=0.095). Lattice parameters the compounds are as follows: for ZrCu 2 P 2 a=0.3810(1), c=0.6184(5); for HfCu 2 P 2 a=0.3799(1), c=0.6160(2) (nm). Atomic parameters in the HfCu 2 P 2 structure and interatomic distances are determined

  2. Communication: a relationship between hardness and flow stress of ordered Zr3Al polycrystals

    International Nuclear Information System (INIS)

    Schulson, E.M.; Roy, J.A.

    1977-01-01

    The purpose of this note is to describe a relationship between hardness and flow stress for the ordered L1$sub 2$ phase Zr$sub 3$Al, a possible structural material for use in nuclear power reactors. Experimental data obtained with the Zr-8.9% Al alloy lead to the conclusion that the hardness of polycrystalline Zr$sub 3$Al obeys an expression of the Hall-Petch form. When combined with a similar expression for flow stress, established previously, a simple relationship is obtained for flow stress in terms of hardness of well annealed material. Hardness measurements thus provide a rapid and inexpensive assessment of the strength of Zr$sub 3$Al. 8 refs

  3. Atomic structure and formation of CuZrAl bulk metallic glasses and composites

    International Nuclear Information System (INIS)

    Kaban, I.; Jóvári, P.; Escher, B.; Tran, D.T.; Svensson, G.; Webb, M.A.; Regier, T.Z.; Kokotin, V.; Beuneu, B.; Gemming, T.; Eckert, J.

    2015-01-01

    Graphical abstract: Partial radial distribution functions for Cu 47.5 Zr 47.5 Al 5 metallic glass and relevant crystal structures. - Abstract: Cu 47.5 Zr 47.5 Al 5 metallic glass is studied experimentally by high-energy X-ray diffraction, neutron diffraction with isotopic substitution, electron diffraction and X-ray absorption spectroscopy. The atomic structure of the glass is modeled by reverse Monte-Carlo and molecular dynamics simulations. RMC modeling of seven experimental datasets enabled reliable separation of all partial pair distribution functions for Cu 47.5 Zr 47.5 Al 5 metallic glass. A peculiar structural feature of the ternary alloy is formation of the strong Al–Zr bonds, which are supposed to determine its high viscosity and enhanced bulk glass formation. Analysis of the local atomic order in Cu 47.5 Zr 47.5 Al 5 glass and Cu 10 Zr 7 , CuZr 2 and CuZr B2 crystalline structures elucidates their similarities and differences explaining the phase formation sequence by devitrification of the glass.

  4. Forming of composites Al2O3-ZrO2 by direct coagulation casting method

    International Nuclear Information System (INIS)

    Tomaszewska-Grzeda, A.; Szafran, M.

    2003-01-01

    The role of enzymes in the DCC process in the decomposition of an appropriately selected substance which results in slow liberation over the whole volume of molecules changing the pH or also in the synthesis of salts modifying the double electric layer. The results of using the urease-urea system and the properties of ceramic casting slips, green samples and after sintering with aluminium oxide and Al 2 O 3 -nZrO 2 composites are presented in the paper. The obtained results of studies show a considerable probability of obtaining in the future of Al 2 O 3 -nZrO 2 composites of good strength parameters resulting from their high degree of thickening, providing that a deagglomeration method of nZrO 2 in the above presented processes will be elaborated. (author)

  5. Local atomic structure of Zr-Cu and Zr-Cu-Al amorphous alloys investigated by EXAFS method

    International Nuclear Information System (INIS)

    Antonowicz, J.; Pietnoczka, A.; Zalewski, W.; Bacewicz, R.; Stoica, M.; Georgarakis, K.; Yavari, A.R.

    2011-01-01

    Research highlights: → Coordination number, interatomic distances and mean square atomic displacement in Zr-Cu and Zr-Cu-Al glasses. → Icosahedral symmetry in local atomic structure. → Deviation from random mixing behavior resulting from Al addition. - Abstract: We report on extended X-ray absorption fine structure (EXAFS) study of rapidly quenched Zr-Cu and Zr-Cu-Al glassy alloys. The local atomic order around Zr and Cu atoms was investigated. From the EXAFS data fitting the values of coordination number, interatomic distances and mean square atomic displacement were obtained for wide range of compositions. It was found that icosahedral symmetry rather than that of corresponding crystalline analogs dominates in the local atomic structure of Zr-Cu and Zr-Cu-Al amorphous alloys. Judging from bonding preferences we conclude that addition of Al as an alloying element results in considerable deviation from random mixing behavior observed in binary Zr-Cu alloys.

  6. Microwave combustion synthesis of in situ Al{sub 2}O{sub 3} and Al{sub 3}Zr reinforced aluminum matrix composites

    Energy Technology Data Exchange (ETDEWEB)

    Zhu, Heguo, E-mail: zhg1200@sina.com [College of Materials Science and Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Key Laboratory of Advanced Micro-Nano Materials and Technology, Jiangsu Province Higher Education Institutions, 210094 (China); Synergetic Center for Advanced Materials Research, Jiangsu Province Higher Education Institutions, 210094 (China); Hua, Bo; Cui, Tao; Huang, Jiewen; Li, Jianliang [College of Materials Science and Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Xie, Zonghan, E-mail: zonghan.xie@adelaide.edu.au [School of Mechanical & Electrical Engineering, Wuhan Institute of Technology, Wuhan 430073 (China); School of Mechanical Engineering, University of Adelaide, SA 5005 (Australia)

    2015-08-15

    Al{sub 2}O{sub 3} and Al{sub 3}Zr reinforced aluminum matrix composites were fabricated from Al and ZrO{sub 2} powders by SiC assisted microwave combustion synthesis. The microstructure and reaction pathways were analyzed by using differential scanning calorimetry (DSC), X-ray diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM) and energy dispersive spectroscopy (EDS). The results showed that the heating rate during microwave synthesis was very high and the entire process took several minutes and that the ignition temperature of the reaction was much lower than that of conventional methods. In addition, the resulting microstructure was found to be finer than that prepared by the conventional methods and no cracks can be seen in the Al{sub 3}Zr reinforcements. As such, the newly developed composites have potential for safety-critical applications where catastrophic failure is not tolerated.

  7. Hydrogenation of FeCoZr-Al{sub 2}O{sub 3} nanocomposites studied by Moessbauer spectroscopy and magnetometry

    Energy Technology Data Exchange (ETDEWEB)

    Saad, A. [Al-Balqa Applied University, Appl. Science Department (Jordan); Kasiuk, J.; Fedotova, J., E-mail: Julia@hep.by [NC PHEP BSU (Belarus); Szilagyi, E. [KFKI Research Institute for Particle and Nuclear Physics (Hungary); Przewoznik, J.; Kapusta, Cz. [AGH University of Science and Technology, Faculty of Physics and Applied Computer Science (Poland); Marszalek, M. [Niewodniczanski Institute of Nuclear Physics PAN (Poland)

    2009-02-15

    Hydrogenation effects on crystalline and magnetic structure of nanocomposites (FeCoZr){sub x}(Al{sub 2}O{sub 3}){sub 100-x}, 38 {<=} x {<=} 63 at.% are studied by {sup 57}Fe Moessbauer spectroscopy and magnetometry. Variations of local structure, blocking temperature and mean FeCoZr nanoparticles' volume are discussed with respect to (i) composition and (ii) two competing processes-H{sub 2} incorporation and annealing-occurred during treatment in H{sub 2} plasma.

  8. Band gap tuning of amorphous Al oxides by Zr alloying

    DEFF Research Database (Denmark)

    Canulescu, Stela; Jones, N. C.; Borca, C. N.

    2016-01-01

    minimum changes non-linearly as well.Fitting of the energy band gap values resulted in a bowing parameter of 2 eV. The band gap bowing of themixed oxides is assigned to the presence of the Zr d-electron states localized below the conduction bandminimum of anodized Al2O3.......The optical band gap and electronic structure of amorphous Al-Zr mixed oxides, with Zr content ranging from4.8 to 21.9% were determined using vacuum ultraviolet (VUV) and X-ray absorption spectroscopy (XAS). Thelight scattering by the nano-porous structure of alumina at low wavelengths...... was estimated based on the Miescattering theory. The dependence of the optical band gap of the Al-Zr mixed oxides on Zr content deviatesfrom linearity and decreases from 7.3 eV for pure anodized Al2O3 to 6.45 eV for Al-Zr mixed oxide with Zrcontent of 21.9%. With increasing Zr content, the conduction band...

  9. Study of dielectric property on ZrO2 and Al doped ZrO2 nanoparticles

    International Nuclear Information System (INIS)

    Catherine Siriya Pushpa, K.; Mangayarkarasi, K.; Ravichandran, A.T.; Xavier, A. Robert; Nagabushana, B.M.

    2014-01-01

    A solution combustion process was used to synthesize ZrO 2 and Al doped ZrO 2 nanoparticles by using Zirconium nitrate and aluminium nitrate as the oxidizer and glycine as fuel. The prepared samples were characterized by several techniques such as X-ray Diffraction (XRD), Scanning Electron Microscopy (SEM), UV-visible spectroscopy (UV-vis). The dielectric values of the pelletized samples were examined at room temperature as the function of frequency. XRD shows the structure of the prepared and doped samples. The SEM shows the surface morphology of the pure and doped ZrO 2 nanoparticles. The dielectric property enhances with increase of Al concentration, which is useful in dielectric gates. (author)

  10. Synthesizing (ZrAl3 + AlN)/Mg-Al composites by a 'matrix exchange' method

    Science.gov (United States)

    Gao, Tong; Li, Zengqiang; Hu, Kaiqi; Han, Mengxia; Liu, Xiangfa

    2018-06-01

    A method named 'matrix exchange' to synthesize ZrAl3 and AlN reinforced Mg-Al composite was developed in this paper. By inserting Al-10ZrN master alloy into Mg matrix and reheating the cooled ingot to 550 °C, Al and Mg atoms diffuse to the opposite side. As a result, liquid melt occurs once the interface areas reach to proper compositions. Then dissolved Al atoms react with ZrN, leading to the in-situ formation of ZrAl3 and AlN particles, while the Al matrix is finally replaced by Mg. This study provides a new insight for preparing Mg composites.

  11. Zr3NiSb7: a new antimony-enriched ZrSb2 derivative

    Directory of Open Access Journals (Sweden)

    V. Romaka

    2008-08-01

    Full Text Available Single crystals of trizirconium nickel heptaantimonide were synthesized from the constituent elements by arc-melting. The compound crystallizes in a unique structure type and belongs to the family of two-layer structures. All crystallographically unique atoms (3 × Zr, 1 × Ni and 7 × Sb are located at sites with m symmetry. The structure contains `Zr2Ni2Sb5' and `Zr4Sb9' fragments and might be described as a new ZrSb2 derivative with a high Sb content.

  12. Band gap tuning of amorphous Al oxides by Zr alloying

    Energy Technology Data Exchange (ETDEWEB)

    Canulescu, S., E-mail: stec@fotonik.dtu.dk; Schou, J. [Department of Photonics Engineering, Technical University of Denmark, 4000 Roskilde (Denmark); Jones, N. C.; Hoffmann, S. V. [ISA, Department of Physics and Astronomy, Aarhus University, 8000 Aarhus (Denmark); Borca, C. N.; Piamonteze, C. [Swiss Light Source, Paul Scherrer Institut, 5232 Villigen PSI (Switzerland); Rechendorff, K.; Nielsen, L. P.; Almtoft, K. P. [Danish Technological Institute, Kongsvang Alle 29, 8000 Aarhus (Denmark); Gudla, V. C.; Bordo, K.; Ambat, R. [Department of Mechanical Engineering, Technical University of Denmark, 2800 Kgs-Lyngby (Denmark)

    2016-08-29

    The optical band gap and electronic structure of amorphous Al-Zr mixed oxides with Zr content ranging from 4.8 to 21.9% were determined using vacuum ultraviolet and X-ray absorption spectroscopy. The light scattering by the nano-porous structure of alumina at low wavelengths was estimated based on the Mie scattering theory. The dependence of the optical band gap of the Al-Zr mixed oxides on the Zr content deviates from linearity and decreases from 7.3 eV for pure anodized Al{sub 2}O{sub 3} to 6.45 eV for Al-Zr mixed oxides with a Zr content of 21.9%. With increasing Zr content, the conduction band minimum changes non-linearly as well. Fitting of the energy band gap values resulted in a bowing parameter of ∼2 eV. The band gap bowing of the mixed oxides is assigned to the presence of the Zr d-electron states localized below the conduction band minimum of anodized Al{sub 2}O{sub 3}.

  13. Refractories in the Al2O3-ZrO2-SiO2 system

    International Nuclear Information System (INIS)

    Banerjee, S.P.; Bhadra, A.K.; Sircar, N.R.

    1978-01-01

    The effect of addition of ZrO 2 in different proportions in the refractories of the Al 2 O 3 -SiO 2 system was studied. The investigation was confined to two broad ranges of compositions incorporating zirconia (15-30 percent and 80-85 percent) in the Al 2 O 3 -ZrO 2 -SiO 2 system. The overall attainment of properties is dependent upon the mode of fabrication and firing, and bears a relationship with the phase assemblages and the relative proportion thereof. Of the different characteristics, the trend of dissociation of zircon has been found to be specially significant vis-a-vis the temperature of firing and thermal shock resistance. Reassociation of the dissociated products has been ascribed to bring forth improved resistance to thermal spalling. The different products developed during this investigation are considered to be very promising which find useful applications in view of the properties attained by them. (auth.)

  14. Development and characterization of nickel catalysts supported in CeO2-ZrO2-Al2O3, CeO2-La2O3-Al2O3 e ZrO2-La2O3-Al2O3 matrixes evaluated for methane reforming reactions

    International Nuclear Information System (INIS)

    Abreu, Amanda Jordão de

    2012-01-01

    Nowadays, the methane reforming is large interest industrial for the take advantage of these gas in production the hydrogen and synthesis gas (syngas). Among in the reactions of methane stand of the reactions steam reforming and carbon dioxide reforming of methane. The main catalysts uses in the methane reforming is Ni/Al 2 O 3 . However, the supported-nickel catalyst is susceptible to the deactivation or the destruction by coke deposition. The carbon dissolves in the nickel crystallite and its diffuses through the nickel, leading for formation of the carbon whiskers, which results in fragmentation of the catalyst. Modification of such catalysts, like incorporation of suitable promoters, is desirable to achieve reduction of the methane hydrogenolysis and/or promotion of the carbon gasification. Catalysts 5%Ni/Al 2 O 3 supported on solid solutions formed by ZrO 2 -CeO 2 , La 2 O 3 and CeO 2 -ZrO 2 -La 2 O 3 were prepared, characterized and evaluated in reactions steam and carbon dioxide reforming and partial oxidation of methane with objective the value effect loading solution solid in support. The supports were prepared by co-precipitation method and catalysts were prepared by impregnation method and calcined at 500 deg C. The supports and catalysts were characterized by Nitrogen Adsorption, method -rays diffraction (XRD), X-rays dispersive spectroscopy (XDS), spectroscopy in the region of the ultraviolet and the visible (UV-vis NIR) to and temperature programmed reduction (TPR), Raman Spectroscopy, X-ray absorption spectroscopy and Thermogravimetric Analysis. After all the catalytic reactions check which the addition of solid solution is beneficial for Ni/Al 2 O 3 catalysts and the best catalysts are Ni/CeO 2 -La 2 O 3 -Al 2 O 3 . (author)

  15. Compressive strain-dependent bending strength property of Al{sub 2}O{sub 3}-ZrO{sub 2} (1.5 mol% Y{sub 2}O{sub 3}) composites performance by HIP

    Energy Technology Data Exchange (ETDEWEB)

    Reyes-Rojas, A. [Centro de Investigacion en Materiales Avanzados S.C. (CIMAV), Miguel de Cervantes 120, Complejo Industrial Chihuahua, Cd. de Chihuahua, Chihuahua (Mexico)], E-mail: armando_reyesmx@yahoo.com.mx; Esparza-Ponce, H. [Centro de Investigacion en Materiales Avanzados S.C. (CIMAV), Miguel de Cervantes 120, Complejo Industrial Chihuahua, Cd. de Chihuahua, Chihuahua (Mexico); De la Torre, S.D. [Centro de Investigacion e Innovacion Tecnologica (CIITEC)-IPN, D.F. Mexico (Mexico); Torres-Moye, E. [Centro de Investigacion en Materiales Avanzados S.C. (CIMAV), Miguel de Cervantes 120, Complejo Industrial Chihuahua, Cd. de Chihuahua, Chihuahua (Mexico)

    2009-04-15

    Nanometric powders and sintered ceramics of Al{sub 2}O{sub 3}-ZrO{sub 2} (1.5 mol% Y{sub 2}O{sub 3}) prepared by hot isostatic pressing HIP have been studied. A detailed crystallographic study has been performed through X-ray diffraction, Williamson-Hall method, Rietveld method and high-resolution electron microscopy HREM analysis. The crystallographic structure data, such as domain size, lattice parameters, wt% phase, and micro-strain direction have been obtained using Rietveld refinement and Williamson-Hall methods. The results revealed that the compressive strain ({epsilon}) increased from 0.56 to 1.18 (10{sup -3}) as the t-ZrO{sub 2} content increased too. The HREM interface study conducted along the [0 0 0 1]Al{sub 2}O{sub 3}||[0 0 1]ZrO{sub 2} zone axis revealed a micro-strain lattice distortion accumulated at the grain boundary due to the ZrO{sub 2} martensitic phase transformation on cooling, t-ZrO{sub 2} grains coalescence and to the grain growth of {alpha}-Al{sub 2}O{sub 3} which cause elongated tetragonal crystals. Micro-strain lattice distortion is adjusted by the shear displacements of the planes (1 1 0) and (11-bar0) along [1-bar10] and [1-bar1-bar0] crystallographic directions, respectively; these planes are arrested by the (101-bar0) alumina plane. In this case, semi-coherent interfaces were observed along the grain boundary. It is verified that the bending strength increased in connection with the strain accumulation and amount of tetragonal structure.

  16. In situ formation of CA6 platelets in Al2O3 and Al2O3/ZrO2 matrices

    OpenAIRE

    Belmonte , M.; SÁnchez-Herencia , A.; Moreno , R.; Miranzo , P.; Moya , J.; Tomsia , A.

    1993-01-01

    Al2O3 and Al2O3/ZrO2 compacts containing CaO as a dopant have been sintered under different conditions and atmospheres: air, high vacuum (> 10-6torr). SEM observations have been made on the polished surfaces of sintered and also of annealed samples. Only after the annealing treatment in air at temperatures ranging from 1400° to 1 500°C, a massive formation of CA6 platelets was detected in samples sintered in low oxygen partial pressure atmospheres.ln order to clarify the mechanism of formatio...

  17. First-principles characterization of a heteroceramic interface: ZrO2(001) deposited on an alpha-Al2O3(1(1)over-bar02) substrate

    DEFF Research Database (Denmark)

    Christensen, Asbjørn; Carter, Emily A.

    2000-01-01

    We have studied an alumina/zirconia interface using the all-electron projector augmented wave formalism within density functional theory. We present the electronic, structural, and energetic properties of the ZrO2(001)/(alpha -Al2O3(1 (1) over bar 02) interface as well as of the free alpha -Al2O3......(1 (1) over bar 02) and ZrO2(001) surfaces. We find that the generalized gradient correction significantly lowers the oxide surface energies, compared to values obtained by the local density approximation. The monoclinic-tetragonal transition in ZrO2(001) thin films is discussed as well as strain...... effects involved in the interface formation. The stoichiometric alumina/zirconia interface is found to be weakly bonded, regardless of the film thickness, and the ZrO2(001)/alpha -Al2O3(1 (1) over bar 02) interface has a rather epitaxial character, due to a low lattice mismatch of similar to4%. The impact...

  18. Epitaxial thin-film growth of Ruddlesden-Popper-type Ba{sub 3}Zr{sub 2}O{sub 7} from a BaZrO{sub 3} target by pulsed laser deposition

    Energy Technology Data Exchange (ETDEWEB)

    Butt, Shariqa Hassan; Rafique, M.S.; Siraj, K.; Latif, A.; Afzal, Amina [University of Engineering and Technology, Laser and Optronics Centre, Department of Physics, Lahore (Pakistan); Awan, M.S. [Ibn-e-Sina Institute of Science and Technology (ISIT), Islamabad (Pakistan); Bashir, Shazia [Government College University, Centre for Advanced Studies in Physics, Lahore (Pakistan); Iqbal, Nida [Universiti Teknologi Malaysia, Medical Devices and Technology Group (MEDITEG), Faculty of Biosciences and Medical Engineering, Johor Bahru, Johor (Malaysia)

    2016-07-15

    Ruddlesden-Popper Ba{sub 3}Zr{sub 2}O{sub 7} thin films have been synthesized via pulsed laser deposition (PLD) technique. The optimization of deposition parameters in PLD enables the formation of thin film of metastable Ba{sub 3}Zr{sub 2}O{sub 7} phase from BaZrO{sub 3} target. In order to see the post-annealing effects on the structural and optical properties, the deposited Ba{sub 3}Zr{sub 2}O{sub 7} thin films were annealed at 500, 600 and 800 C. X-ray diffraction (XRD) reveals the formation of Ba{sub 3}Zr{sub 2}O{sub 7} phase with tetragonal structure. The changes in the surface of the deposited films were analysed by FE-SEM and AFM. The thin film post-annealed at 500 C exhibited the best structural, optical and surface properties. Furthermore, the chemical states and chemical composition of the films were determined by X-ray photoelectron spectroscopy (XPS) near the surface. The XPS results show that Ba, Zr and O exist mainly in the form of Ba{sub 3}Zr{sub 2}O{sub 7} Ruddlesden-Popper-type perovskite structure. (orig.)

  19. Electronic structure and phase stability during martensitic transformation in Al-doped ZrCu intermetallics

    International Nuclear Information System (INIS)

    Qiu Feng; Shen Ping; Liu Tao; Lin Qiaoli; Jiang Qichuan

    2010-01-01

    Martensitic transformation, phase stability and electronic structure of Al-doped ZrCu intermetallics were investigated by experiments and first-principles calculations using the pseudopotentials plane wave method. The formation energy calculations indicate that the stability of the ZrCu phase increases with the increasing Al content. Al plays a decisive role in controlling the formation and microstructures of the martensite phases in Zr-Cu-Al alloys. The total energy difference between ZrCu (B2) austenite and ZrCu martensite plays an important role in the martensitic transformation. The phase stability is dependent on its electronic structure. The densities of states (DOS) of the intermetallics were discussed in detail.

  20. The corrosion behaviour of Zr3Al-based alloys

    International Nuclear Information System (INIS)

    Murphy, E.V.; Wieler, R.

    1977-07-01

    The corrosion resistance of several zirconium-aluminum alloys with aluminum contents ranging from 7.6 to 9.6 wt% was examined in 300 deg C and 325 deg C water, 350 deg C and 400 deg C steam and in air and wet CO 2 at 325 deg C and 400 deg C. In the transformed alloys there are three phases present, αZr, Zr 2 Al and Zr 3 Al of which the αZr phase is the least corrosion resistant. The most important factor controlling the corrosion behaviour of these alloys was found to be the size, distribution and amount of the αZr phase in the transformed alloys, which in turn was dependent upon the microstructural scale of the untransformed alloys

  1. Effect of the Size of Al3(Sc,Zr) Precipitates on the Structure of Multi-Directionally Isothermally Forged Al-Mg-Sc-Zr Alloy

    Science.gov (United States)

    Sitdikov, O. Sh.; Avtokratova, E. V.; Mukhametdinova, O. E.; Garipova, R. N.; Markushev, M. V.

    2017-12-01

    The effect of Al3(Sc,Zr) dispersoids on the evolution of the cast Al-Mg-Sc-Zr alloy structure under multi-directional isothermal forging (MIF) has been investigated. The alloy, which has an equiaxed grain structure with a grain size of 25 μm and contains dispersoids 5-10 and 20-50 nm in size after onestage (at 360°C for 6 h) and two-stage (360°C for 6 h + 520°C for 1 h) annealing, respectively, was deformed at 325°C ( 0.65 T m) up to cumulative strains of e = 8.4. In the initial stages of MIF, new fine (sub)grains surrounded by low-angle and high-angle boundaries (HABs) were formed near the initial grain boundaries. With increasing strain, the volume fraction and misorientation of these crystallites increased, which led to the replacement of a coarse-grained structure with a fine-grained one with a grain size of 1.5-2.0 μm. Dynamic recrystallization occurred in accordance to a continuous mechanism and was controlled by the interaction of lattice dislocations and/or (sub)grain boundaries with dispersoids that effectively inhibited the migration of boundaries, as well as the rearrangement of lattice dislocations and their annihilation. The particle size and the density of their distribution significantly affected the parameters of the evolved structure; in an alloy with smaller particles, a structure with a smaller grain size and a larger HAB fraction developed.

  2. Effects of Al addition on atomic structure of Cu-Zr metallic glass

    Science.gov (United States)

    Li, Feng; Zhang, Huajian; Liu, Xiongjun; Dong, Yuecheng; Yu, Chunyan; Lu, Zhaoping

    2018-02-01

    The atomic structures of Cu52Zr48 and Cu45Zr48Al7 metallic glasses (MGs) have been studied by molecular dynamic simulations. The results reveal that the molar volume of the Cu45Zr48Al7 MG is smaller than that of the Cu52Zr48 MG, although the size of the Al atom is larger than that of the Cu atom, implying an enhanced atomic packing density achieved by introducing Al into the ternary MG. Bond shortening in unlike atomic pairs Zr-Al and Cu-Al is observed in the Cu45Zr48Al7 MG, which is attributed to strong interactions between Al and (Zr, Cu) atoms. Meanwhile, the atomic packing efficiency is enhanced by the minor addition of Al. Compared with the Cu52Zr48 binary MG, the potential energy of the ternary MG decreases and the glass transition temperature increases. Structural analyses indicate that more Cu- and Al-centered full icosahedral clusters emerge in the Cu45Zr48Al7 MG as some Cu atoms are substituted by Al. Furthermore, the addition of Al leads to more icosahedral medium-range orders in the ternary MG. The increase of full icosahedral clusters and the enhancement of the packing density are responsible for the improved glass-forming ability of Cu45Zr48Al7.

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

    International Nuclear Information System (INIS)

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

    2007-01-01

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

  4. Influence of small additions of Sc and Zr on structure and mechanical properties of Al-Zn-Mg-Cu alloy

    International Nuclear Information System (INIS)

    Kajgorodova, L.I.; Sel'nikhina, E.I.; Tkachenko, E.A.; Senatorova, O.G.

    1996-01-01

    A study was made into Sc and Zr addition effects on grain structure formation, supersaturated solid solution decomposition and mechanical properties of Al-7%Zn-2%Mg-1.2%Cu alloy. It is shown that grain structure is determined by volume fraction and distribution character of disperse particles of Al 3 Sc and Al 3 (Sc 1-x Zr x ). The reason for additives influence on decomposition kinetics during natural and artificial ageing are revealed. The structural factors responsible for the enhancement of mechanical properties on alloying are discussed. 17 refs.; 5 figs.; 2 tabs

  5. Hydrothermal-precipitation preparation of CdS@(Er3+:Y3Al5O12/ZrO2) coated composite and sonocatalytic degradation of caffeine.

    Science.gov (United States)

    Huang, Yingying; Wang, Guowei; Zhang, Hongbo; Li, Guanshu; Fang, Dawei; Wang, Jun; Song, Youtao

    2017-07-01

    Here, we reported a novel method to dispose caffeine by means of ultrasound irradiation combinated with CdS@(Er 3+ :Y 3 Al 5 O 12 /ZrO 2 ) coated composite as sonocatalyst. The CdS@(Er 3+ :Y 3 Al 5 O 12 /ZrO 2 ) was synthesized via hydrothermal-precipitation method and then characterized by X-ray diffractometer (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM), energy dispersive X-ray analysis (EDX) and UV-vis diffuse reflectance spectra (DRS). After that, the sonocatalytic degradation of caffeine in aqueous solution was conducted adopting CdS@(Er 3+ :Y 3 Al 5 O 12 /ZrO 2 ) and CdS@ZrO 2 coated composites as sonocatalysts. In addition, some influencing factors such as CdS and ZrO 2 molar proportion, caffeine concentration, ultrasonic irradiation time, sonocatalyst dosage and addition of several inorganic oxidants on sonocatalytic degradation of caffeine were investigated by using UV-vis spectra and gas chromatograph. The experimental results showed that the presence of Er 3+ :Y 3 Al 5 O 12 could effectively improve the sonocatalytic degradation activity of CdS@ZrO 2 . To a certain extent some inorganic oxidants can also enhance sonocatalytic degradation of caffeine in the presence of CdS@(Er 3+ :Y 3 Al 5 O 12 /ZrO 2 ). The best sonocatalytic degradation ratio (94.00%) of caffeine could be obtained when the conditions of 5.00mg/L caffeine, 1.00g/L prepared CdS@(Er 3+ :Y 3 Al 5 O 12 /ZrO 2 ), 10.00mmol/LK 2 S 2 O 8 , 180min ultrasonic irradiation (40kHz frequency and 50W output power), 100mL total volume and 25-28°C temperature were adopted. It seems that the method of sonocatalytic degradation caused by CdS@(Er 3+ :Y 3 Al 5 O 12 /ZrO 2 ) displayspotentialadvantages in disposing caffeine. Copyright © 2017 Elsevier B.V. All rights reserved.

  6. Structural study of Zr-based metallic glasses

    International Nuclear Information System (INIS)

    Matsubara, E.; Ichitsubo, T.; Saida, J.; Kohara, S.; Ohsumi, H.

    2007-01-01

    Structures of Zr 70 Ni 20 Al 10 , Zr 70 Cu 20 Al 10 , Zr 70 Cu 30 and Zr 70 Ni 30 amorphous alloys were analyzed by high-energy X-ray diffraction. The relatively stable Zr 2 Cu amorphous alloy shows a local atom arrangement different from the Zr 2 Cu crystalline phase. By contrast, the less stable Zr 70 Ni 30 amorphous alloy has a structure similar to Zr 2 Ni. In the Zr 70 Cu 20 Al 10 metallic glass, Zr-Al nearest neighbor pairs are introduced in the amorphous structure. In the Zr 70 Ni 20 Al 10 metallic glass, the strong correlation between Zr-Ni pairs is drastically modified by the formation of Zr-Al pairs. The presence of Zr-Al pairs in the ternary alloys suppresses the crystallization and stabilizes the glassy state

  7. Microstructure and mechanical properties investigation of in situ TiB2 and ZrB2 reinforced Al-4Cu composites

    Science.gov (United States)

    Lutfi Anis, Ahmad; Ramli, Rosmamuhammadani; Darham, Widyani; Zakaria, Azlan; Talari, Mahesh Kumar

    2016-02-01

    Conventional Al-Cu alloys exhibit coarse grain structure leading to inferior mechanical properties in as-cast condition. Expensive thermo-mechanical treatments are needed to improve microstructure and corresponding mechanical properties. In situ Al-based composites were developed to improve mechanical properties by dispersion strengthening and grain refinement obtained by the presence of particulates in the melt during solidification. In this work Al-4Cu - 3TiB2 and Al-4Cu-3ZrB2 in situ composites were prepared by liquid casting method. XRD, electron microscopy and mechanical tests were performed on suitably sectioned and metallographically prepared surfaces to investigate the phase distribution, hardness and tensile properties. It was found that the reinforcement particles were segregated along the grain boundaries of Al dendrites. Tensile fracture morphology for both Al-4Cu - 3TiB2 and Al-4Cu-3ZrB2 were analyzed and compared to determine the fracture propagation mechanism in the composites. Al-4Cu-3ZrB2 in situ composites displayed higher strength and hardness compared to Al-4Cu-3TiB2 which could be ascribed to the stronger interfacial bonding between the Al dendrites and ZrB2 particulates as evidenced from fractographs.

  8. High-Temperature Tensile and Tribological Behavior of Hybrid (ZrB2+Al3Zr)/AA5052 In Situ Composite

    Science.gov (United States)

    Gautam, G.; Kumar, N.; Mohan, A.; Gautam, R. K.; Mohan, S.

    2016-09-01

    During service life, components such as piston, cylinder blocks, brakes, and discs/drums, have to work under high-temperature conditions. In order to have appropriate material for such applications high-temperature studies are important. Hybrid (ZrB2+Al3Zr)/AA5052 in situ composite has been investigated from ambient to 523 K (250 °C) at an interval of 50 deg. (ZrB2+Al3Zr)/AA5052 in situ composite has been fabricated by the direct melt reaction of AA5052 alloy with zirconium and boron salts. Microstructure studies show refinement in the grain size of base alloy on in situ formation of reinforcement particles. Al3Zr particles are observed in rectangular and polyhedron shapes. It is observed from the tensile studies that ultimate tensile strength, yield strength, and percentage elongation decrease with increase in test temperature. Similar kind of behavior is also observed for flow curve properties. The tensile results have also been correlated with fractography. Wear and friction results indicate that the wear rate increases with increase in normal load, whereas coefficient of friction shows decreasing trend. With increasing test temperature, wear rate exhibits a typical phenomenon. After an initial increase, wear rate follows a decreasing trend up to 423 K (150 °C), and finally a rapid increase is observed, whereas coefficient of friction increases continuously with increase in test temperature. The mechanisms responsible for the variation of wear and friction with different temperatures have been discussed in detail with the help of worn surfaces studies under scanning electron microscope (SEM) & 3D-profilometer and debris analysis by XRD.

  9. Mechanical properties and bio-tribological behaviors of novel beta-Zr-type Zr-Al-Fe-Nb alloys for biomedical applications.

    Science.gov (United States)

    Hua, Nengbin; Chen, Wenzhe; Zhang, Lei; Li, Guanghui; Liao, Zhenlong; Lin, Yan

    2017-07-01

    The present study prepares novel Zr 70+x Al 5 Fe 15-x Nb 10 (x=0, 5) alloys by arc-melting for potential biomedical application. The mechanical properties and bio-tribological behaviors of the Zr-based alloys are evaluated and compared with biomedical pure Zr. The as-prepared alloys exhibit a microstructure containing a micrometer-sized dendritic beta-Zr phase dispersed in a Zr 2 Fe-typed matrix. It is found that increasing the content of Zr is favorable for the mechanical compatibility with a combination of low Young's modulus, large plasticity, and high compressive strength. The wear resistance of the Zr-Al-Fe-Nb alloys in air and phosphate buffer saline (PBS) solution is superior to that of pure Zr. The wear mechanism of Zr-based alloys sliding in air is controlled by oxidation and abrasive wear whereas that sliding in PBS is controlled by synergistic effects of the abrasive and corrosive wear. Electrochemical measurements demonstrate that the Zr-based alloys are corrosion resistant in PBS. Their bio-corrosion resistance is improved with the increase in Zr content, which is attributed to the enrichment in Zr and decrease in Al concentration in the surface passive film of alloys. The Zr 75 Al 5 Fe 10 Nb 10 exhibits the best corrosion resistance in PBS, which contributes to its superior wear resistance in a simulated body environment. The combination of good mechanical properties, corrosion resistance, and biotribological behaviors of the Zr-Al-Fe-Nb alloys offers them potential advantages in biomedical applications. Copyright © 2017 Elsevier B.V. All rights reserved.

  10. Structural study of Zr-based metallic glasses

    Energy Technology Data Exchange (ETDEWEB)

    Matsubara, E. [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan)]. E-mail: e.matsubara@materials.mbox.media.kyoto-u.ac.jp; Ichitsubo, T. [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan); Saida, J. [Center of Interdisciplinary Research, Tohoku University, Sendai 980-8578 (Japan); Kohara, S. [JASRI, SPring-8, Sayo-gun, Hyogo 679-5198 (Japan); Ohsumi, H. [JASRI, SPring-8, Sayo-gun, Hyogo 679-5198 (Japan)

    2007-05-31

    Structures of Zr{sub 70}Ni{sub 20}Al{sub 10}, Zr{sub 70}Cu{sub 20}Al{sub 10}, Zr{sub 70}Cu{sub 30} and Zr{sub 70}Ni{sub 30} amorphous alloys were analyzed by high-energy X-ray diffraction. The relatively stable Zr{sub 2}Cu amorphous alloy shows a local atom arrangement different from the Zr{sub 2}Cu crystalline phase. By contrast, the less stable Zr{sub 70}Ni{sub 30} amorphous alloy has a structure similar to Zr{sub 2}Ni. In the Zr{sub 70}Cu{sub 20}Al{sub 10} metallic glass, Zr-Al nearest neighbor pairs are introduced in the amorphous structure. In the Zr{sub 70}Ni{sub 20}Al{sub 10} metallic glass, the strong correlation between Zr-Ni pairs is drastically modified by the formation of Zr-Al pairs. The presence of Zr-Al pairs in the ternary alloys suppresses the crystallization and stabilizes the glassy state.

  11. Superplastic forming of rapid solidification processed Al-4Li-0.2Zr

    International Nuclear Information System (INIS)

    Meschter, P.J.; Lederich, R.J.; Sastry, S.M.L.

    1987-01-01

    Aluminum-4 wt pct lithium alloys are attractive as structural materials because they are 13 to 14 pct less dense and have 25 pct larger elastic moduli than high-strength 2XXX-and 7XXX-series aluminum alloys. These low-density alloys can be produced only by rapid solidification processing (RSP). Successful RSP of Al-4Li-0.2Zr, Al-4Li-1Mg-0.2Zr, and Al-4Li-1Cu-0.2Zr alloys with strengths similar to that of 7075-T76 has recently been demonstrated. Net-shaped processing techniques such as superplastic forming are capable of producing complex structural elements while minimizing usage of expensive material; thus, these techniques are particularly applicable to Al-Li alloys. The purpose of this study was to determine the conditions of strain rate and temperature under which RSP Al-4Li alloys could be superplastically formed

  12. Influence of boron vacancies on phase stability, bonding and structure of MB2 (M  =  Ti, Zr, Hf, V, Nb, Ta, Cr, Mo, W) with AlB2 type structure

    International Nuclear Information System (INIS)

    Dahlqvist, Martin; Rosen, Johanna; Jansson, Ulf

    2015-01-01

    Transition metal diborides in hexagonal AlB 2 type structure typically form stable MB 2 phases for group IV elements (M  =  Ti, Zr, Hf). For group V (M  =  V, Nb, Ta) and group VI (M  =  Cr, Mo, W) the stability is reduced and an alternative hexagonal rhombohedral MB 2 structure becomes more stable. In this work we investigate the effect of vacancies on the B-site in hexagonal MB 2 and its influence on the phase stability and the structure for TiB 2 , ZrB 2 , HfB 2 , VB 2 , NbB 2 , TaB 2 , CrB 2 , MoB 2 , and WB 2 using first-principles calculations. Selected phases are also analyzed with respect to electronic and bonding properties. We identify trends showing that MB 2 with M from group V and IV are stabilized when introducing B-vacancies, consistent with a decrease in the number of states at the Fermi level and by strengthening of the B–M interaction. The stabilization upon vacancy formation also increases when going from M in period 4 to period 6. For TiB 2 , ZrB 2 , and HfB 2 , introduction of B-vacancies have a destabilizing effect due to occupation of B–B antibonding orbitals close to the Fermi level and an increase in states at the Fermi level. (paper)

  13. Correlative characterization of primary Al{sub 3}(Sc,Zr) phase in an Al–Zn–Mg based alloy

    Energy Technology Data Exchange (ETDEWEB)

    Li, J.H., E-mail: jie-hua.li@hotmail.com [Institute of Casting Research, Montanuniversität Leoben, A-8700 Leoben (Austria); Wiessner, M. [Materials Center Leoben Forschung GmbH, A-8700 Leoben (Austria); Albu, M. [Institute for Electron Microscopy and Nanoanalysis, Graz University of Technology, Center for Electron Microscopy (Austria); Wurster, S. [Department of Materials Physics, Montanuniversität Leoben, Erich Schmid Institute of Materials Science of the Austrian Academy of Sciences, A-8700 Leoben (Austria); Sartory, B. [Materials Center Leoben Forschung GmbH, A-8700 Leoben (Austria); Hofer, F. [Institute for Electron Microscopy and Nanoanalysis, Graz University of Technology, Center for Electron Microscopy (Austria); Schumacher, P. [Institute of Casting Research, Montanuniversität Leoben, A-8700 Leoben (Austria); Austrian Foundry Research Institute, A-8700 Leoben (Austria)

    2015-04-15

    Three-dimensional electron backscatter diffraction, focused ion beam, transmission electron microscopy and energy filtered transmission electron microscopy were employed to investigate the structural information of primary Al{sub 3}(Sc,Zr) phase, i.e. size, shape, element distribution and orientation relationship with the α-Al matrix. It was found that (i) most primary Al{sub 3}(Sc,Zr) phases have a cubic three-dimensional morphology, with a size of about 6–10 μm, (ii) most primary Al{sub 3}(Sc,Zr) phases are located within the α-Al matrix, and exhibit a cube to cube orientation relationship with the α-Al matrix, and (iii) a layer by layer growth was observed within primary Al{sub 3}(Sc,Zr) phases. Al, Cu, Si and Fe are enriched in the α-Al matrix between the layers of cellular eutectic Al{sub 3}(Sc,Zr) phase, while Sc, Ti and Zr are enriched in small Al{sub 3}(Sc,Zr) phases. A peritectic reaction and subsequent eutectic reaction between Al{sub 3}Sc and Al was proposed to interpret the observed layer by layer growth. This paper demonstrates that the presence of impurities (Fe, Si, Cu, Ti) in the diffusion field surrounding the growing Al{sub 3}(Sc,Zr) particle enhances the heterogeneous nucleation of Al{sub 3}(Sc,Zr) phases. - Highlights: • Most fine cubic primary Al{sub 3}(Sc,Zr) phases were observed within the α-Al matrix. • A layer by layer growth within primary Al{sub 3}(Sc,Zr) phase was observed. • A peritectic and subsequent eutectic reaction between Al{sub 3}Sc and Al was proposed. • Impurities in diffusion fields enhance heterogeneous nucleation of Al{sub 3}(Sc,Zr)

  14. Sequential evolution of different phases in metastable Gd(2-x)Ce(x)Zr(2-x)Al(x)O7 (0.0 ≤ x ≤ 2.0) system: crucial role of reaction conditions.

    Science.gov (United States)

    Shukla, Rakesh; Sayed, Farheen N; Phapale, Suhas; Mishra, Ratikant; Tyagi, Avesh K

    2013-07-15

    The Gd(2-x)Ce(x)Zr(2-x)Al(x)O7 (0.0 ≤ x ≤ 2.0) series was synthesized by the gel combustion method. This system exhibited the presence of a fluorite-type phase, along with a narrow biphasic region, depending upon the Ce/Gd content in the sample. Thermal stability of these new compounds under oxidizing and reducing conditions has been investigated. The products obtained on decomposition of Gd(2-x)Ce(x)Zr(2-x)Al(x)O7 in oxidizing and reducing conditions were found to be entirely different. It was observed that in air the fluorite-type solid solutions of Gd(2-x)Ce(x)Zr(2-x)Al(x)O7 composition undergo phase separation into perovskite GdAlO3 and fluorite-type solid solutions of Gd-Ce-Zr-O or Ce-Zr-Al-O depending upon the extent of Ce and Al substitution. On the other hand, Gd(2-x)Ce(x)Zr(2-x)Al(x)O7 samples on heating under reducing conditions show a phase separation to CeAlO3 perovskite and a defect-fluorite of Gd2Zr2O7. The extent of metastability for a typical composition of Gd(1.2)Ce(0.8)Zr(1.2)Al(0.8)O7 (nano), Gd(1.2)Ce(0.8)Zr(1.2)Al(0.8)O(6.6) (heated under reduced conditions), Gd(1.2)Ce(0.8)Zr(1.2)Al(0.8)O7 (heated in air at 1200 °C) has been experimentally determined employing a high temperature Calvet calorimeter. On the basis of thermodynamic stability data, it could be inferred that the formation of a more stable compound in the presence of two competing cations (i.e., Gd(3+) and Ce(3+)) is guided by the crystallographic stability.

  15. Structural and Electrochemical Consequences of Al and Ga Cosubstitution in Li7La3Zr2O12 Solid Electrolytes.

    Science.gov (United States)

    Rettenwander, Daniel; Redhammer, Günther; Preishuber-Pflügl, Florian; Cheng, Lei; Miara, Lincoln; Wagner, Reinhard; Welzl, Andreas; Suard, Emmanuelle; Doeff, Marca M; Wilkening, Martin; Fleig, Jürgen; Amthauer, Georg

    2016-04-12

    Several "Beyond Li-Ion Battery" concepts such as all solid-state batteries and hybrid liquid/solid systems envision the use of a solid electrolyte to protect Li-metal anodes. These configurations are very attractive due to the possibility of exceptionally high energy densities and high (dis)charge rates, but they are far from being realized practically due to a number of issues including high interfacial resistance and difficulties associated with fabrication. One of the most promising solid electrolyte systems for these applications is Al or Ga stabilized Li 7 La 3 Zr 2 O 12 (LLZO) based on high ionic conductivities and apparent stability against reduction by Li metal. Nevertheless, the fabrication of dense LLZO membranes with high ionic conductivity and low interfacial resistances remains challenging; it definitely requires a better understanding of the structural and electrochemical properties. In this study, the phase transition from garnet ( Ia 3̅ d , No. 230) to "non-garnet" ( I 4̅3 d , No. 220) space group as a function of composition and the different sintering behavior of Ga and Al stabilized LLZO are identified as important factors in determining the electrochemical properties. The phase transition was located at an Al:Ga substitution ratio of 0.05:0.15 and is accompanied by a significant lowering of the activation energy for Li-ion transport to 0.26 eV. The phase transition combined with microstructural changes concomitant with an increase of the Ga/Al ratio continuously improves the Li-ion conductivity from 2.6 × 10 -4 S cm -1 to 1.2 × 10 -3 S cm -1 , which is close to the calculated maximum for garnet-type materials. The increase in Ga content is also associated with better densification and smaller grains and is accompanied by a change in the area specific resistance (ASR) from 78 to 24 Ω cm 2 , the lowest reported value for LLZO so far. These results illustrate that understanding the structure-properties relationships in this class of materials

  16. Óxidos Mistos de Al2O3/ZrO2 como Inibidores de Corrosão do Aço SAE 1020

    Directory of Open Access Journals (Sweden)

    Marcelo Rodrigues da Silva

    2014-01-01

    Full Text Available This paper describes the use of Al2O3/ZrO2 mixed oxides synthesized by sol-gel process with different amounts of ZrO2 (5%, 10%, 15% and 20% by mass in the Al2O3 matrix and different temperatures of calcination, such as interesting inhibitor materials of corrosive processes of SAE 1020 steel. The materials were characterized by Infrared Spectroscopy Fourier Transform (FTIR and X-Ray Diffraction (XRD techniques. FTIR spectra show the typical Al-O and Zr-O bonds vibrations in the mixed oxides. The XRD patterns of the samples calcined at 800 °C and 1000 °C shows the ZrO2 tetragonal and γ-Al2O3 face-centered cubic (FCC phases. The corrosion tests showed that the SAE 1020 steel covered with mixed oxides have an anodic passive region, thereby inhibiting the corrosive processes on the metal surface. Furthermore, the found values for steel coated with mixed oxide synthesized indicate a decrease in corrosion potentials (Ecor and corrosion current (icor. With respect to different samples of mixed oxides, the sample with 20 % of ZrO2 in the Al2O3 matrix proved to be the best inhibitor of steel corrosion, with the lowest values of corrosion potential and corrosion current, - 1.32 V and 0.31 μA cm-2, respectively.

  17. Microstructure and thermal stability of Cu/Zr0.3Al0.7N/Zr0.2Al0.8N/Al34O60N6 cermet-based solar selective absorbing coatings

    Science.gov (United States)

    Meng, Jian-ping; Guo, Rui-rui; Li, Hu; Zhao, Lu-ming; Liu, Xiao-peng; Li, Zhou

    2018-05-01

    Solar selective absorbing coatings play a valuable role in photo-thermal conversion for high efficiency concentrating solar power systems (CSP). In this paper, a novel Cu/Zr0.3Al0.7N/Zr0.2Al0.8N/Al34O60N6 cermet-based solar selective absorbing coating was successfully deposited by ion beam assisted deposition. The optical properties, microstructure and element distribution in depth were investigated by spectroscopic ellipsometry, UV-vis-NIR spectrophotometer, transmission electron microscope (TEM) and Auger electron spectroscopy (AES), respectively. A high absorptance of 0.953 and a low thermal emittance of 0.079 at 400 °C are obtained by the integral computation according to the whole reflectance from 300 nm to 28,800 nm. After annealing treatment at 400 °C (in vacuum) for 192 h, the deposited coating exhibits the high thermal stability. Whereas, the photothermal conversion efficiency decreases from 12.10 to 6.86 due to the emittance increase after annealing at 600 °C for 192 h. Meanwhile, the nitrogen atom in the Zr0.3Al0.7N sub-layer diffuses toward the adjacent sub-layer due to the spinodal decomposition of metastable c-ZrAlN and the phase transition from c-AlN to h-AlN, which leads to the composition of the Zr0.3Al0.7N sub-layer deviates the initial design. This phenomenon has a guide effect for the thermal-stability improvement of cermet coatings. Additionally, a serious diffusion between copper and silicon substrate also contributes to the emittance increase.

  18. Tuning of the acid–base properties of primary Me{sub 2}O{sub 3} (Me = Al, Ga, In) and binary (ZrO{sub 2}–Me{sub 2}O{sub 3}) (Me = B, Al, Ga, In) oxides by adding WO{sub 3}: A calorimetric study

    Energy Technology Data Exchange (ETDEWEB)

    Kourieh, Reem; Bennici, Simona; Auroux, Aline, E-mail: aline.auroux@ircelyon.univ-lyon1.fr

    2013-09-10

    Highlights: • Preparation of WO{sub 3}/Me{sub 2}O{sub 3} and WO{sub 3}/(ZrO{sub 2}–Me{sub 2}O{sub 3}) catalysts (Me{sub 2}O{sub 3} = group III oxides). • Acid–base properties were estimated by adsorption microcalorimetry of NH{sub 3} and SO{sub 2}. • The tuning of acid–base properties of amphoteric oxides was achieved by adding WO{sub 3}. • Pyridine adsorption showed that acidity is due to the presence of Lewis acid sites. - Abstract: In this work two series of samples were prepared by impregnation of Me (Me = Al, Ga, In) hydroxides and Zr–Me (Me = B, Al, Ga, In) mixed hydroxides with an ammonium metatungstate hydrate solution followed by calcination at 400 °C. The obtained WO{sub 3}/Me{sub 2}O{sub 3} and WO{sub 3}/(ZrO{sub 2}–Me{sub 2}O{sub 3}) samples have been characterized in terms of their structural, textural, and surface properties, including the acid features, by a variety of techniques (BET, XRD, TG) and microcalorimetry. The acid–base properties were estimated by the adsorption of NH{sub 3} and SO{sub 2} as probe molecules, respectively. The prepared mixed oxide samples showed very different properties in terms of surface area and X-ray diffractograms. All obtained samples showed a specific acidic–basic character influenced by the relative amounts of each oxide, the most acidic samples being WO{sub 3}/ZrO{sub 2} and WO{sub 3}/Al{sub 2}O{sub 3} and WO{sub 3}/(Al{sub 2}O{sub 3}–ZrO{sub 2})

  19. The effect of ZrO2 grinding media on the attrition milling of FeAl with Y2O3

    International Nuclear Information System (INIS)

    Gedevanishvili, S.; Deevi, S.C.

    2004-01-01

    Attrition milling of water and gas atomized FeAl was carried out with Y 2 O 3 , where ZrO 2 was used as a grinding media in place of stainless steel balls to avoid contamination with Cr and C. Consolidation of the milled powders produced complex FeAl phases containing Zr which doubled the hardness and significantly improved the creep resistance as compared to that of unmilled and consolidated FeAl

  20. Amorphization of Zr3Al by hydrogenation and subsequent electron irradiation

    International Nuclear Information System (INIS)

    Meng, W.J.; Koike, J.; Okamoto, P.R.; Rehn, L.E.

    1988-12-01

    1-MeV electron irradiation of hydrogenated Zr 3 Al (Zr 3 AlH/sub 0.96/) at 10K is studied. A more than 20 fold reduction in the critical dose required for complete amorphization is observed for the hydrogenated specimen as compared to the un-hydrogenated Zr 3 Al under identical irradiation conditions. 11 refs., 4 figs

  1. (Nbx, Zr1-x)4AlC3 MAX Phase Solid Solutions: Processing, Mechanical Properties, and Density Functional Theory Calculations.

    Science.gov (United States)

    Lapauw, Thomas; Tytko, Darius; Vanmeensel, Kim; Huang, Shuigen; Choi, Pyuck-Pa; Raabe, Dierk; Caspi, El'ad N; Ozeri, Offir; To Baben, Moritz; Schneider, Jochen M; Lambrinou, Konstantina; Vleugels, Jozef

    2016-06-06

    The solubility of zirconium (Zr) in the Nb4AlC3 host lattice was investigated by combining the experimental synthesis of (Nbx, Zr1-x)4AlC3 solid solutions with density functional theory calculations. High-purity solid solutions were prepared by reactive hot pressing of NbH0.89, ZrH2, Al, and C starting powder mixtures. The crystal structure of the produced solid solutions was determined using X-ray and neutron diffraction. The limited Zr solubility (maximum of 18.5% of the Nb content in the host lattice) in Nb4AlC3 observed experimentally is consistent with the calculated minimum in the energy of mixing. The lattice parameters and microstructure were evaluated over the entire solubility range, while the chemical composition of (Nb0.85, Zr0.15)4AlC3 was mapped using atom probe tomography. The hardness, Young's modulus, and fracture toughness at room temperature as well as the high-temperature flexural strength and E-modulus of (Nb0.85, Zr0.15)4AlC3 were investigated and compared to those of pure Nb4AlC3. Quite remarkably, an appreciable increase in fracture toughness was observed from 6.6 ± 0.1 MPa/m(1/2) for pure Nb4AlC3 to 10.1 ± 0.3 MPa/m(1/2) for the (Nb0.85, Zr0.15)4AlC3 solid solution.

  2. Fractography of STIR casted Al-ZrO2 composites

    International Nuclear Information System (INIS)

    Baghchesara, M. A.; Abdizadeh, H.; Baharvandi, H. R.

    2009-01-01

    In this study, Al-ZrO 2 composites were produced by Vortex method using ZrO 2 powder with 1 micron average diameter as reinforce particles and Al-356 as the matrix metal. The melt composites were stirred for 13 minutes, then casted into a metallic mold. Different samples of 5, 10 and 15 volume percent of ZrO 2 , in different casting temperatures of 750, 850 and 950 d eg C were produced. The latter 2 casting temperatures are not a common practice but were chosen to enhance fluidity. Effects of volume percent of ZrO 2 particles and casting temperature on tensile strength, microstructure, and fracture surfaces of Al-ZrO 2 composites have been investigated. The highest tensile strength was achieved in the specimen containing 15 vol. % ZrO 2 produced at 750 d eg C which shows an increase of 60% in comparison to the Al-356 non-reinforced alloy. Microscopic investigations of fracture surfaces revealed that fracture in a brittle manner with little or no necking happening. By increasing ZrO 2 content and casting temperature, the composites fracture goes in a more severely brittle manner.

  3. A high performance transparent resistive switching memory made from ZrO_2/AlON bilayer structure

    International Nuclear Information System (INIS)

    Tsai, Tsung-Ling; Chang, Hsiang-Yu; Tseng, Tseung-Yuen; Lou, Jesse Jen-Chung

    2016-01-01

    In this study, the switching properties of an indium tin oxide (ITO)/zirconium oxide (ZrO_2)/ITO single layer device and those of a device with an aluminum oxynitride (AlON) layer were investigated. The devices with highly transparent characteristics were fabricated. Compared with the ITO/ZrO_2/ITO single layer device, the ITO/ZrO_2/AlON/ITO bilayer device exhibited a larger ON/OFF ratio, higher endurance performance, and superior retention properties by using a simple two-step forming process. These substantial improvements in the resistive switching properties were attributed to the minimized influence of oxygen migration through the ITO top electrode (TE), which can be realized by forming an asymmetrical conductive filament with the weakest part at the ZrO_2/AlON interface. Therefore, in the ITO/ZrO_2/AlON/ITO bilayer device, the regions where conductive filament formation and rupture occur can be effectively moved from the TE interface to the interior of the device.

  4. Phase equilibria of the Al-Pr-Zr ternary system at 773 K

    International Nuclear Information System (INIS)

    She, Jia; Zhan, Yongzhong; Li, Chunliu; Du, Yong; Xu, Honghui; He, Yuehui

    2010-01-01

    The phase equilibria of the Al-Pr-Zr ternary system at 773 K have been investigated mainly by means of X-ray powder diffraction (XRD), scanning electron microscopy (SEM) and differential thermal analysis (DTA). The 14 binary compounds, i.e. AlZr 3 , AlZr 2 , Al 2 Zr 3 , Al 3 Zr 4 , AlZr, Al 3 Zr 2 , Al 2 Zr, Al 3 Zr, α-Al 11 Pr 3 , Al 3 Pr, Al 2 Pr, β-AlPr, AlPr 2 and β-AlPr 3 were confirmed. No binary compound was found in the Pr-Zr binary system. The result shows that the isothermal section of the Al-Pr-Zr ternary system at 773 K consists of 17 single-phase regions, 31 two-phase regions and 15 three-phase regions. All the intermediate compounds phases in this system have not a remarkable solid solution at 773 K. No ternary compound is found in this work.

  5. The first-principles calculations for the elastic properties of Zr2Al under compression

    International Nuclear Information System (INIS)

    Yuan Xiaoli; Wei Dongqing; Chen Xiangrong; Zhang Qingming; Gong Zizheng

    2011-01-01

    Graphical abstract: The calculated elastic constants C ij as a function of pressure P. Display Omitted Research highlights: → It is found that the five independent elastic constants increase monotonically with pressure. C 11 and C 33 vary rapidly as pressure increases, C 13 and C 12 becomes moderate. However, C 44 increases comparatively slowly with pressure. Figure shows excellent satisfaction of the calculated elastic constants of Zr 2 Al to these equations and hence in our calculation, the Zr 2 Al is mechanically stable at pressure up to 100 GPa. - Abstract: The first-principles calculations were applied to investigate the structural, elastic constants of Zr 2 Al alloy with increasing pressure. These properties are based on the plane wave pseudopotential density functional theory (DFT) method within the generalized gradient approximation (GGA) for exchange and correlation. The result of the heat of formation of Zr 2 Al crystal investigated is in excellent consistent with results from other study. The anisotropy, the shear modulus, and Young's modulus for the ideal polycrystalline Zr 2 Al are also studied. It is found that (higher) pressure can significantly improve the ductility of Zr 2 Al. Moreover, the elastic constants of Zr 2 Al increase monotonically and the anisotropies decrease with the increasing pressure. Finally, it is observed that Zr d electrons are mainly contributed to the density of states at the Fermi level.

  6. Effect of Nb aggregates on Zr2Fe

    International Nuclear Information System (INIS)

    Ramos, Cinthia P.

    2001-01-01

    The binary Zr-Fe phase diagram revision, performed by Arias et al., accepted the intermetallic Zr 2 Fe crystalline structure as tetragonal and determined that the presence of a third element like oxygen, nitrogen or carbon, stabilizes a cubic phase. Nevitt et al. studying Ti, Zr and Hf alloys with transition metals as second or third element and ternary systems with oxygen as third element, systematized the occurrence of phases with a cubic Ti 2 Ni type crystalline structure. From previous studies in the Zr-Nb-Fe system, it is an agreed fact that Nb presence in the Zr 2 Fe intermetallic stabilizes a cubic Ti 2 Ni type phase. The purpose of the present work is to determine the stability range of the Zr 2 Fe intermetallic with Nb contents, the existence range of the ternary cubic Ti 2 Ni type phase (designated Λ) and the corresponding two-phase region. We analyze as cast and heat treated (800 C degrees) Zr-Nb-Fe alloys with 35 atomic % Fe and Nb contents between 0.5 and 15 atomic %. The determination and characterization of the phases is made by optical and scanning electron microscopy, X-ray diffraction microprobe analysis and Moessbauer Spectroscopy. Joining these techniques together it is found, among many other things, that the Zr 2 Fe phase would accept up to around 0.5 atomic % Nb in solution and that the two-phase region Zr 2 Fe+Λ would be stable in the (0.5 - 3.5) Nb atomic % range. It is proposed as well a 800 C degrees section of the ternary (Zr-Nb-Fe) in the studied region. (author) [es

  7. Tuning of magnetic properties and structure of granular FeCoZr-Al{sub 2}O{sub 3} nanocomposites by oxygen incorporation

    Energy Technology Data Exchange (ETDEWEB)

    Saad, A. [Al-Balqa Applied University, Applied Science Department, Salt (Jordan); Fedotova, J. [NC PHEP Belarusian State University, 153 M.Bogdanovich str., 220040 Minsk (Belarus)], E-mail: Julia@hep.by; Nechaj, J. [NC PHEP Belarusian State University, 153 M.Bogdanovich str., 220040 Minsk (Belarus); Szilagyi, E. [KFKI Research Institute for Particle and Nuclear Physics, H-1525 Budapest, P.O. Box 49 (Hungary); Marszalek, M. [Niewodniczanski Institute of Nuclear Physics PAN, 31-342 Cracow (Poland)

    2009-03-05

    Effect of oxygen incorporation on the magnetic properties and structure of (FeCoZr){sub x}(Al{sub 2}O{sub 3}){sub 1-x} (17% < x < 65%) nanocomposites sputtered in pure Ar and mixed Ar + O ambient was investigated using Backscattering spectrometry, SQUID-magnetometry, atomic force microscopy/magnetic force microscopy (AFM/MFM) and Moessbauer spectroscopy. The basic differences in the magnetic state of both series were extracted by comparing their coercivity fields, magnetization, MFM magnetic contrast and discussed with regard to the formation of complex FeCo-oxides.

  8. Strength-toughness relations in sintered and isostatically hot-pressed ZrO2-toughened Al2O3

    International Nuclear Information System (INIS)

    Hori, S.; Yoshimura, M.; Somiya, S.

    1986-01-01

    The fracture toughness of fine-grained undoped ZrO 2 -toughened Al 2 O 3 (ZTA) was essentially unchanged by post-sintering hot isostatic pressing and increased monotonically with ZrO 2 additions up to 25 wt%. The strength of ZTA with 5 to 15 wt% tetragonal ZrO 2 , which depended monotonically on the amount of ZrO 2 present before hot isostatic pressing, was increased by pressing but became almost constant between 5 and 15 wt% ZrO 2 addition. The strength appeared to be controlled by pores before pressing and by surface flaws after pressing; the size of flaws after pressing increased with ZrO 2 content. The strength of ZTA containing mostly monoclinic ZrO 2 (20 to 25 wt%) remained almost constant despite the noticeable density increase upon hot isostatic pressing because the strength was controlled by preexisting microcracks whose extent did not change on postsintering pressing. These strength-toughness relations in sintered and isostatically hot-pressed ZTA are explained on the basis of R-curve behavior. The importance of the contribution of microcracks to the toughness of ZTA is emphasized

  9. Study of directionally solidified eutectic Al2O3-ZrO2(3%Y2O3 doped with TiO2

    Directory of Open Access Journals (Sweden)

    Peña, J. I.

    2007-06-01

    Full Text Available An study of directionally grown samples of the eutectic composition in the Al2O3-ZrO2 (3 mol% Y2O3 system, with small TiO2 additions (1 wt%, is presented. The microstructural changes induced by this addition are analysed using SEM (EDX techniques. The mechanical changes, when TiO2 is added, are studied by measuring the flexural strength by three point bending. Also, the toughness is determined by Vickers indentation method. When slow growth rates (10 mm/h are used, interpenetratred and homogeneous microstructure is obtained, independently of the TiO2 doping. When growth rates are higher (300 and 1000 mm/h the structure changes and the phases are organized in form of colonies or cells, which have smaller size when TiO2 is present. This size reduction is accompanied with an increase of the toughness.Este trabajo presenta un estudio de muestras crecidas direccionalmente del sistema Al2O3-ZrO2 (3 mol% Y2O3 en su composición eutéctica con pequeñas adiciones de óxido de titanio (1% de TiO2 en peso. Se analizan los cambios microestructurales inducidos por esta adición mediante SEM (EDX y se estudian los cambios en su comportamiento mecánico medido por flexión en tres puntos, así como la tenacidad de fractura mediante indentación Vickers. Con velocidades lentas de solidificación (10 mm/h se obtiene en ambos casos una microestructura homogénea e interpenetrada, mientras que a velocidades mayores, 300 y 1000 mm/h, se forma una estructura en las que las fases se organizan en forma de colonias o células, siendo éstas de menor tamaño en las muestras dopadas. Esta disminución en el tamaño viene acompañada de un aumento de la tenacidad de fractura medida por indentación.

  10. Structure-property relationships of mullite-SiC-Al{sub 2}O{sub 3}–ZrO{sub 2} composites developed during carbothermal reduction of aluminosilicate minerals

    Energy Technology Data Exchange (ETDEWEB)

    Seifollahzadeh, P., E-mail: Pseifollahzadeh.mat@stu.yazd.ac.ir; Kalantar, M.; Ghasemi, S.S.

    2015-10-25

    Evolution of SiC and ZrO{sub 2} in the matrix of Al{sub 2}O{sub 3} or mullite have been reported to enhance a higher toughness, good thermal shock resistance (lowering thermal expansion and improving thermal conductivity) and improved creep resistance of composite materials. In this study, the structure-property relationships of mullite-Al{sub 2}O{sub 3} matrix composites have been investigated in conjunction with the evolution of reinforcing phases such as SiC–ZrO{sub 2} by an economical heat treatment process called carbothermal reduction of inorganic minerals (Kaolinite, Andalusite, Zircon). The influence of starting materials in relation with the variation in molar ratio of C/SiO{sub 2} on the phase composition, microstructures, physical and mechanical properties have been studied. Light microscopy has been supplemented with scanning electron microscopy, XRD analysis, differential thermal and thermal gravity analysis to follow the structure-property relationships. The experimental results show that with increasing of C/SiO{sub 2} ratio in starting materials, very fine SiC whiskers have been formed in the microstructures. Moreover, the densification and strength are considerable higher for ZrO{sub 2} + SiC containing composites in comparison to that of only SiC added ones. Furthermore, it has been found that the appropriate ratio of C/SiO{sub 2} with the associated firing temperature to develop a higher densification and SiC crystallization have been related to the 3.5, 1550 °C for kaolinite, 3.5, 1450 °C for zircon and 5.5, 1600 °C for andalusite containing composite samples, respectively. - Highlights: • In-situ formation of SiC whiskers in matrix of alumina + mullite composites. • Advantage of availability, abundance and economical for starting materials. • Lack of environmental problems in comparable of utilization of whiskers directly. • A mixture of coke and alumina as a protective layer instead of inert atmosphere. • Fabrication of advanced

  11. Development of the Ni/Al{sub 2}O{sub 3}/ZrO{sub 2} catalyst to steam reforming of the natural gas process; Desenvolvimento do catalisador Ni/Al2O3/ZrO2 para o processo de reforma do gas natural

    Energy Technology Data Exchange (ETDEWEB)

    Neiva, Laedna Souto; Ramalho, Melanea A.F.; Costa, Ana Cristina Figueiredo de Melo; Gama, Lucianna [Universidade Federal de Campina Grande (UFCG), PB (Brazil); Andrade, Heloysa M.C. [Universidade Federal da Bahia (UFBA), Salvador, BA (Brazil); Kiminami, Ruth Herta G.A. [Universidade Federal de Sao Carlos (UFSCAR), SP (Brazil)

    2008-07-01

    The aim of this work is to develop catalyst of the type Ni/{alpha}-Al{sub 2}O{sub 3} modified with 0.005 mol of ZrO{sub 2} and structural, morphologic and catalytic characterizations, aiming employ in the reforming process of the natural gas. The catalytic supports were obtained by synthesis method for combustion reaction according to the concepts of the propellants chemistry. The active species of the catalyst (nickel) was deposited over the support by humid impregnation method. The catalytic supports were characterized by XRD, morphologic analysis by SEM and TEM, textural analysis by BET method before and after of the impregnation with nickel and were done catalytic tests in laboratory. The catalytic supports shows structure without any secondary phase with crystallinity elevated degree and crystal size varying between 5.7 and 7.0 nm. The catalytic test shows that these catalysts promoted a conversion percentile considerable of the natural gas in syngas. (author)

  12. Phase equilibria of the Al-Pr-Zr ternary system at 773 K

    Energy Technology Data Exchange (ETDEWEB)

    She, Jia [Laboratory of Nonferrous Metal Materials and New Processing Technology, Ministry of Education, Guangxi University, Nanning, Guangxi 530004 (China); Zhan, Yongzhong, E-mail: zyzmatres@yahoo.com.c [Laboratory of Nonferrous Metal Materials and New Processing Technology, Ministry of Education, Guangxi University, Nanning, Guangxi 530004 (China); Li, Chunliu [Laboratory of Nonferrous Metal Materials and New Processing Technology, Ministry of Education, Guangxi University, Nanning, Guangxi 530004 (China); Du, Yong; Xu, Honghui; He, Yuehui [State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083 (China)

    2010-07-30

    The phase equilibria of the Al-Pr-Zr ternary system at 773 K have been investigated mainly by means of X-ray powder diffraction (XRD), scanning electron microscopy (SEM) and differential thermal analysis (DTA). The 14 binary compounds, i.e. AlZr{sub 3}, AlZr{sub 2}, Al{sub 2}Zr{sub 3}, Al{sub 3}Zr{sub 4}, AlZr, Al{sub 3}Zr{sub 2}, Al{sub 2}Zr, Al{sub 3}Zr, {alpha}-Al{sub 11}Pr{sub 3}, Al{sub 3}Pr, Al{sub 2}Pr, {beta}-AlPr, AlPr{sub 2} and {beta}-AlPr{sub 3} were confirmed. No binary compound was found in the Pr-Zr binary system. The result shows that the isothermal section of the Al-Pr-Zr ternary system at 773 K consists of 17 single-phase regions, 31 two-phase regions and 15 three-phase regions. All the intermediate compounds phases in this system have not a remarkable solid solution at 773 K. No ternary compound is found in this work.

  13. In situ formation of CA6 platelets in Al2O3 and Al2O3/ZrO2 matrices

    International Nuclear Information System (INIS)

    Belmonte, M.; Sanchez-Herencia, A.J.; Moreno, R.; Miranzo, P.; Moya, J.S.; Tomsia, A.P.

    1993-01-01

    Al 2 O 3 and Al 2 O 3 /ZrO 2 compacts containing CaO as a dopant have been sintered under different conditions and atmospheres: air, high vacuum (> 10 -6 torr). SEM observations have been made on the polished surfaces of sintered and also of annealed samples. Only after the annealing treatment in air at temperatures ranging from 1400 to 1500 C, a massive formation of CA 6 platelets was detected in samples sintered in low oxygen partial pressure atmospheres. In order to clarify the mechanism of formation of this secondary phase at the grain boundaries, CaO has been introduced in the form of either plaster of Paris (to reproduce a possible contamination provided by the molds in slip casting) or CaCO 3 . The obtained results indicate the important role of the firing atmosphere on the precipitation of secondary phases at grain boundary. (orig.)

  14. Physical properties of core-concrete systems: Al{sub 2}O{sub 3}-ZrO{sub 2} molten materials measured by aerodynamic levitation

    Energy Technology Data Exchange (ETDEWEB)

    Ohishi, Yuji, E-mail: ohishi@see.eng.osaka-u.ac.jp [Graduate School of Engineering, Osaka University (Japan); Kargl, F. [Institute of Materials Physics in Space, German Aerospace Center (Germany); Nakamori, F.; Muta, Hiroaki; Kurosaki, Ken [Graduate School of Engineering, Osaka University (Japan); Yamanaka, Shinsuke [Graduate School of Engineering, Osaka University (Japan); Research Institute of Nuclear Engineering, University of Fukui (Japan)

    2017-04-15

    During a molten core–concrete interaction, molten oxides consisting of molten core materials (UO{sub 2} and ZrO{sub 2}) and concrete (Al{sub 2}O{sub 3}, SiO{sub 2}, CaO) are formed. Reliable data on the physical properties of the molten oxides will allow us to accurately predict the progression of a nuclear reactor core meltdown accident. In this study, the viscosities and densities of molten (ZrO{sub 2}){sub x}(Al{sub 2}O{sub 3}){sub 1-x} (x = 0.356 and 0.172) were measured using an aerodynamic levitation technique. The densities of two small samples were estimated from their masses and their volumes (calculated from recorded images of the molten samples). The droplets were forced to oscillate using speakers, and their viscosities were evaluated from the damping behaviors of their oscillations. The results showed that the viscosity of molten (ZrO{sub 2}){sub x}(Al{sub 2}O{sub 3}){sub 1-x} compared to that of pure molten Al{sub 2}O{sub 3} is 25% lower for x = 0.172, while it is unexpectedly 20% higher for x = 0.356. - Highlights: •The physical properties of molten (ZrO{sub 2}){sub x}(Al{sub 2}O{sub 3}){sub 1-x} (x = 0.356 and 0.172) have been evaluated. •The measurement was conducted using an aerodynamic levitation technique. •The density and viscosity were measured.

  15. Potentiodynamic polarization studies of bulk amorphous alloy Zr57Cu15.4Ni12.6Al10Nb5 and Zr59Cu20Ni8Al10Ti3 in aqueous HNO3 media

    International Nuclear Information System (INIS)

    Sharma, Poonam; Dhawan, Anil; Jayraj, J.; Kamachi Mudali, U.

    2013-01-01

    The potentiodynamic polarization studies were carried out on Zr based bulk amorphous alloy Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 and Zr 59 Cu 20 Ni 8 Al 10 Ti 3 in solutions of 1 M, 6 M and 11.5 M HNO 3 aqueous media at room temperature. As received specimens of Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 (5 mm diameter rod) and Zr 59 Cu 20 Ni 8 Al 10 Ti 3 (3 mm diameter rod) were polished with SiC paper before testing them for potentiodynamic polarization studies. The amorphous nature of the specimens was checked by X-ray diffraction. The bulk amorphous alloy Zr 59 Cu 20 Ni 8 Al 10 Ti 3 shows the better corrosion resistance than Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 alloy in the aqueous HNO 3 media as the value of the corrosion current density (I corr ) for Zr 57 Cu 15.4 Ni 12.6 Al 10 Nb 5 alloy were found to be more than Zr 59 Cu 20 Ni 8 Al 10 Ti 3 alloy in aqueous HNO 3 media. The improved corrosion resistance of Zr 59 Cu 20 Ni 8 Al 10 Ti 3 alloy is possibly due to the presence of Ti and formation of TiO 2 during anodic oxidation. Both Zr based bulk amorphous alloys shows wider passive range at lower concentration of nitric acid and the passive region gets narrowed down with the increase in concentration. A comparison of data obtained from both the Zr-based bulk amorphous alloys is made and results are discussed in the paper. (author)

  16. Highly active sulfided CoMo catalysts supported on (ZrO{sub 2}–TiO{sub 2})/Al{sub 2}O{sub 3} ternary oxides

    Energy Technology Data Exchange (ETDEWEB)

    Escobar, José, E-mail: jeaguila@imp.mx [Instituto Mexicano del Petróleo, Eje Central Lázaro Cárdenas 152, Col. San Bartolo Atepehuacan, Gustavo A. Madero, México, D.F. 07730 (Mexico); De Los Reyes, José A., E-mail: jarh@xanum.uam.mx [Area de Ing. Química, UAM – Iztapalapa, San Rafael Atlixco 186, Col. Vicentina, Iztapalapa, México, D.F. 09340 (Mexico); Ulín, Carlos A. [Area de Ing. Química, UAM – Iztapalapa, San Rafael Atlixco 186, Col. Vicentina, Iztapalapa, México, D.F. 09340 (Mexico); Barrera, María C., E-mail: mcbdgavilan@gmail.com [Facultad de Ciencias Químicas, Universidad Veracruzana, Av. Universidad km. 7.5, Col. Santa Isabel, Coatzacoalcos, Veracruz, México, D.F. 96538 (Mexico)

    2013-12-16

    (ZrO{sub 2}–TiO{sub 2})/Al{sub 2}O{sub 3} ternary oxide at 20 mol% Al{sub 2}O{sub 3} (80% ZrO{sub 2}–TiO{sub 2}, in turn at 40–60 mol ratio) prepared by controlled co-precipitation (by urea thermal decomposition) of zirconium (ZrOCl{sub 2}·8H{sub 2}O) and titanium (TiCl{sub 4}) chlorides over a ground alumina substrate constitutes a promising material to be used as carrier of sulfided hydrodesulfurization (HDS) catalysts. After calcining (at 500 °C), the ternary oxide presented textural properties (S{sub g} = 387 m{sup 2} g{sup −1}, V{sub p} = 0.74 ml g{sup −1}, mean pore diameter = 7.6 nm) suitable to its utilization as carrier of catalysts applied in the oil-derived middle distillates HDS. As determined by temperature programmed-reduction and Raman and UV–vis spectroscopies ZrO{sub 2}–TiO{sub 2} deposition over alumina substrate resulted in decreased proportion of Mo{sup 6+} species in tetrahedral coordination on the oxidic impregnated material. As those species constitute hardly reducible precursors, their diminished concentration could be reflected in enhanced amount of Mo species susceptible of activation by sulfiding (H{sub 2}S/H{sub 2} at 400 °C) over our ternary carrier. Limiting the concentration of zirconia-titania (at 40–60 mol ratio) to 20 mol% in the mixed oxides support allowed the preparation of highly active promoted (by cobalt, at Co/(Co + Mo) = 0.3) MoS{sub 2} phase (at 2.8 atoms/nm{sup 2}), that formulation showing excellent properties in hydrodesulfurization (HDS) of both dibenzothiophene and highly-refractory 4,6-dimethyl-dibenzothiophene. Due to alike yields to various HDS products over CoMo/(ZrO{sub 2}–TiO{sub 2})/Al{sub 2}O{sub 3} and the corresponding Al{sub 2}O{sub 3}-supported formulation, presence of similar actives sites over those catalysts was strongly suggested. It seemed that enhanced concentration of octahedral Mo{sup 6+} over the oxidic impregnated precursor with (ZrO{sub 2}–TiO{sub 2})/Al{sub 2}O{sub 3

  17. Resistive switching in ZrO2 based metal-oxide-metal structures

    International Nuclear Information System (INIS)

    Kaerkkaenen, Irina

    2014-01-01

    The goal of this work is a deeper understanding of the influence of the (i) metal-oxide-metal (MOM) layer stacks configuration, (ii) the oxide films microstructure, (iii) and their defect structure on the appearance of different switching modes, i.e. unipolar (UP) and bipolar (BP). The first part deals with the fabrication of ZrO 2 thin films by an industrial compatible atomic layer deposition (ALD) process, the chemical, structural and morphological characterization of the films, the growth of ZrO 2 /TiO 2 bilayers, the integration of the layers into metal-oxide-metal (MOM) devices and the electrical characterization with focus on the RS behavior. In the second part the effect of the device structure, in particular the thickness of the electrochemical active electrode (EAE) and the ZrO 2 film morphology, on the RS switching polarity of Pt/ZrO 2 /(EAE) cells is discussed. ZrO 2 films and ZrO 2 /TiO 2 bilayers were grown by ALD and were carefully structurally and electrically characterized. The ZrO 2 films grown from Zr[N(CH 3 )C 2 H 5 ] 4 (TEMA-Zr) at 240 C were polycrystalline with a mixture of cubic/tetragonal phases. ALD/H 2 O-ZrO 2 films exhibited a random oriented polycrystalline structure, whereas the ALD/O 3 -ZrO 2 films consisted of preferably oriented cubic shaped grains. Pt/ZrO 2 /Ti/Pt structures with a Ti top electrode (TE) thickness of 5 to 20 nm showed unipolar type RS behavior, while by increasing the Ti TE thickness a gradual change of switching polarity from unipolar to bipolar with a completely bipolar type RS behavior for a Ti TE thickness of 40 nm is found. The switching in Pt/ZrO 2 /TiO 2 /Ti/Pt devices was unipolar, comparable to Pt/ZrO 2 /Ti/Pt cells. In contrast, bilayers with the reverse structure, Pt/TiO 2 /ZrO 2 /Ti/Pt, showed non-switching behavior. The effect of the cells stack structure on the polarity of the RS behavior was studied in detail for 20 nm thick ZrO 2 films grown by an ozone based ALD process and integrated into Pt/ZrO 2

  18. Interfacial phenomena in the reactions of Al-B, Al-Ti-B, and Al-Zr-B alloys with KF-AlF3 and NaF-AlF3 melts

    International Nuclear Information System (INIS)

    Lee, M.S.; Terry, B.S.; Grieveson, P.

    1993-01-01

    The interfacial phenomena occurring during the contacting of liquid Al-B, Al-Ti-B, and Al-Zr-B melts with KF-AlF 3 liquid fluxes have been investigated by optical examination of quenched metal drops previously immersed in the liquid fluxes. Reactions in the Al-B/KF-AlF 3 system involve the formation of metastable AlB 12 at the metal/flux interface. At high KBF 4 levels in the flux, the AlB 12 is dispersed in the flux and also at low KBF 4 levels in the metal. Reactions in the Al-Ti-B/KF-AlF 3 system involve the formation of TiB 2 , which may be dispersed in either the metal or the flux depending upon the composition of the flux. The results obtained for the Al-Ti-B/NaF-AlF 3 and Al-Zr-B/KF-AlF 3 systems were similar to those observed for the Al-Ti-B/KF-AlF 3 system

  19. Al2TiO5-ZrTiO4-ZrO2 composites

    International Nuclear Information System (INIS)

    Parker, F.J.

    1990-01-01

    The characterization and properties of ceramic composites containing the phases Al 2 TiO 5 , ZrTiO 4 , and ZrO 2 are described. The low thermal expansions are apparently due to a combination of microcracking by the titanate phases and a contractive phase transformation by the ZrO 2 . The crystal chemistry and microstructure of the product are processing dependent. Although the composites represent a complex microcracking system, the low thermal expansions and high-temperature stability make them potential candidates for commercial application requiring thermal shock resistance

  20. Development of AL_2O_3 - ZrO_2 ceramic composite reinforced with rare earth oxides (Y_2O)3) for inert coating of storage and transport systems of crude petroleum

    International Nuclear Information System (INIS)

    Silva, J.C.; Yadava, Y.P.; Sanguinetti Ferreira, R.A.; Albuquerque, L.T.

    2014-01-01

    The advancement of the oil sector has generated the need for the use of materials resistant to aggressive environments to oil. Although ceramics have high melting point and high hardness is, on the other hand, more fragile and less tough, which can cause damage to the metal structure. The Al_2O_3 based ceramics reinforced with rare earth oxide can improve tenaciousness and makes the ceramic material more resistant. This article aims to present the production of composite Al_2O_3 - Y_2O_3 stabilized ZrO_2 by uniaxial pressing, following sintering (1200-1350 deg C). Structural and microstructural characterizations as XRD (X-Ray Diffraction) and SEM (Scanning Electron Microscopy) and mechanical tests as Vickers hardness, % absorption and % linear shrinkage were conducted to evaluate the feasibility of using the composite and ceramic coating for storage and transportation of oil tanks. The results indicate that the proportions of 5%, 10% and 30% ZrO_2 make it suitable as a good composite suitable coating. (author)

  1. Structure and properties of Al-Mg-Li-Zr system alloys

    International Nuclear Information System (INIS)

    Fridlyander, I.N.; Dolzhanskij, Yu.M.; Sandler, V.S.; Tyurin, .V.; Nikol'skaya, T.I.

    1977-01-01

    Studied were the structure and mechanical properties of the Al-Mg-Li-Zr alloy system (including 01420 alloy) containing 1.6-5.3%Li and 1.0-8.8%Mg). Electron microscopic studies of 01420 alloy conducted after heating at 450 deg C for 4 hours revealed non-uniformly distributed precipitations of a metastable phase ZrAl 3 , having spherical and needle-like configurations. These precipitations, together with zirconium contained in the solid solution, retard recrystallization. The introduction of 0.1-0.2% Zr decreases the limiting solubility of magnesium and lithium in the aluminium solid solution and leads to the formation of disperse equilibrium (S and, possibly, γ) phases with the size of 0.1-0.5 mcm. These phases were observed in the alloys containing (>=) 4% Mg and 1.9-3.5% Li. The method of planned experiment was used to study the principles governing the variation of the mechanical properties of the alloys subjected to water hardening and after aging at 170 deg C for 16 hours. It was established that the strength properties of the hardened alloys become higher, and the relative elongation decreases with the content of lithium and especially magnesium. It would be more proper to assess strengthening in the course of aging according to variation in the yield point and hardness. The effect of aging determined by the yield point depends on the content of lithium and is practically independent of the concentration of magnesium

  2. Precipitation in cold-rolled Al-Sc-Zr and Al-Mn-Sc-Zr alloys prepared by powder metallurgy

    KAUST Repository

    Vlach, Martin

    2013-12-01

    The effects of cold-rolling on thermal, mechanical and electrical properties, microstructure and recrystallization behaviour of the AlScZr and AlMnScZr alloys prepared by powder metallurgy were studied. The powder was produced by atomising in argon with 1% oxygen and then consolidated by hot extrusion at 350 C. The electrical resistometry and microhardness together with differential scanning calorimetry measurements were compared with microstructure development observed by transmission and scanning electron microscopy, X-ray diffraction and electron backscatter diffraction. Fine (sub)grain structure developed and fine coherent Al3Sc and/or Al3(Sc,Zr) particles precipitated during extrusion at 350 C in the alloys studied. Additional precipitation of the Al3Sc and/or Al3(Sc,Zr) particles and/or their coarsening was slightly facilitated by the previous cold rolling. The presence of Sc,Zr-containing particles has a significant antirecrystallization effect that prevents recrystallization at temperatures minimally up to 420 C. The precipitation of the Al6Mn- and/or Al 6(Mn,Fe) particles of a size ~ 1.0 μm at subgrain boundaries has also an essential antirecrystallization effect and totally suppresses recrystallization during 32 h long annealing at 550 C. The texture development of the alloys seems to be affected by high solid solution strengthening by Mn. The precipitation of the Mn-containing alloy is highly enhanced by a cold rolling. The apparent activation energy of the Al3Sc particles formation and/or coarsening and that of the Al6Mn and/or Al 6(Mn,Fe) particle precipitation in the powder and in the compacted alloys were determined. The cold deformation has no effect on the apparent activation energy values of the Al3Sc-phase and the Al 6Mn-phase precipitation. © 2013 Elsevier Inc.

  3. Precipitation in cold-rolled Al-Sc-Zr and Al-Mn-Sc-Zr alloys prepared by powder metallurgy

    KAUST Repository

    Vlach, Martin; Stulí ková , Ivana; Smola, Bohumil; Kekule, Tomá š; Kudrnová , Hana; Daniš, Stanislav; Gemma, Ryota; Očená šek, Vladivoj; Má lek, Jaroslav; Tanprayoon, Dhritti; Neubert, Volkmar

    2013-01-01

    The effects of cold-rolling on thermal, mechanical and electrical properties, microstructure and recrystallization behaviour of the AlScZr and AlMnScZr alloys prepared by powder metallurgy were studied. The powder was produced by atomising in argon with 1% oxygen and then consolidated by hot extrusion at 350 C. The electrical resistometry and microhardness together with differential scanning calorimetry measurements were compared with microstructure development observed by transmission and scanning electron microscopy, X-ray diffraction and electron backscatter diffraction. Fine (sub)grain structure developed and fine coherent Al3Sc and/or Al3(Sc,Zr) particles precipitated during extrusion at 350 C in the alloys studied. Additional precipitation of the Al3Sc and/or Al3(Sc,Zr) particles and/or their coarsening was slightly facilitated by the previous cold rolling. The presence of Sc,Zr-containing particles has a significant antirecrystallization effect that prevents recrystallization at temperatures minimally up to 420 C. The precipitation of the Al6Mn- and/or Al 6(Mn,Fe) particles of a size ~ 1.0 μm at subgrain boundaries has also an essential antirecrystallization effect and totally suppresses recrystallization during 32 h long annealing at 550 C. The texture development of the alloys seems to be affected by high solid solution strengthening by Mn. The precipitation of the Mn-containing alloy is highly enhanced by a cold rolling. The apparent activation energy of the Al3Sc particles formation and/or coarsening and that of the Al6Mn and/or Al 6(Mn,Fe) particle precipitation in the powder and in the compacted alloys were determined. The cold deformation has no effect on the apparent activation energy values of the Al3Sc-phase and the Al 6Mn-phase precipitation. © 2013 Elsevier Inc.

  4. A high performance transparent resistive switching memory made from ZrO{sub 2}/AlON bilayer structure

    Energy Technology Data Exchange (ETDEWEB)

    Tsai, Tsung-Ling; Chang, Hsiang-Yu; Tseng, Tseung-Yuen, E-mail: tseng@cc.nctu.edu.tw [Department of Electronics Engineering and Institute of Electronics, National Chiao Tung University, Hsinchu 30010, Taiwan (China); Lou, Jesse Jen-Chung [Department of Energy Information Engineering, School of Software and Microelectronics, Peking University, Wuxi 214125 (China)

    2016-04-11

    In this study, the switching properties of an indium tin oxide (ITO)/zirconium oxide (ZrO{sub 2})/ITO single layer device and those of a device with an aluminum oxynitride (AlON) layer were investigated. The devices with highly transparent characteristics were fabricated. Compared with the ITO/ZrO{sub 2}/ITO single layer device, the ITO/ZrO{sub 2}/AlON/ITO bilayer device exhibited a larger ON/OFF ratio, higher endurance performance, and superior retention properties by using a simple two-step forming process. These substantial improvements in the resistive switching properties were attributed to the minimized influence of oxygen migration through the ITO top electrode (TE), which can be realized by forming an asymmetrical conductive filament with the weakest part at the ZrO{sub 2}/AlON interface. Therefore, in the ITO/ZrO{sub 2}/AlON/ITO bilayer device, the regions where conductive filament formation and rupture occur can be effectively moved from the TE interface to the interior of the device.

  5. Structural and magnetic properties of UCo1/3T2/3Al solid solutions (T = Ru, Pt, Rh)

    International Nuclear Information System (INIS)

    Andreev, A. V.; Bordallo, H. N.; Chang, S.; Nakotte, H.; Schultz, A. J.; Sechovsky, V.; Torikachvili, M. S.

    1999-01-01

    We report on neutron diffraction studies of UCo 1/3 T 2/3 Al (T = Ru, Pt, Rh). All three solid solutions form in the hexagonal ZrNiAl structure. The Ru-containing compound is found to be chemically ordered, while the Pt-containing compound is nearly disordered and the Rh-containing compound is purely disordered. All three compounds exhibit long-range magnetic order with rather small U moments

  6. Can reduced size of metals induce hydrogen absorption: ZrAl2 case

    International Nuclear Information System (INIS)

    Jacob, I.; Deledda, S.; Bereznitsky, M.; Yeheskel, O.; Filipek, S.M.; Mogilyanski, D.; Kimmel, G.; Hauback, B.C.

    2011-01-01

    Research highlights: → 15 nm particles of ZrAl 2 and Zr(Al 0.5 Co 0.5 ) 2 are obtained by attrition and cryomilling. → ZrAl 2 nanoparticles remain inert to hydrogen absorption up to pressure of ∼2 GPa. → Zr(Al 0.5 Co 0.5 ) 2 nanoparticles exhibit reduced hydrogen absorption as compared to the corresponding bulk compounds. - Abstract: The hydrogen absorption ability of the non-absorbing Al-rich ZrAl 2 compound was examined after reducing its particles-size to the nanometer regime. The hydrogen abstinence of bulk ZrAl 2 has been previously related to its excessive elastic shear stiffening. The particle size of ZrAl 2 was reduced by attrition milling and cryomilling. The minimal average particle size was estimated from powder X-ray diffraction analysis to be in the range of 10-20 nm. The hydrogen absorption of the milled compounds was measured in different hydrogenation systems at hydrogen pressures between ∼6 MPa and ∼2 GPa. In all the cases the hydrogen absorption was negligible. In addition, there was a reduction of the hydrogen absorption capacity of nanosized Zr(Al 0.5 Co 0.5 ) 2 as compared to the corresponding bulk compound at the same conditions. We suggest, in view of our and other results, that no significant improvement of the thermodynamics (unlike the kinetics) of the hydrogen absorption can be achieved via the nanoparticle avenue.

  7. Spark plasma sintering and mechanical properties of $ZrO_{2} (Y_{2}O_{3})-Al_{2}O_{3}$ composites

    CERN Document Server

    Jin Sheng H; Dalla Torre, S; Miyamoto, H; Miyamoto, K

    2000-01-01

    Spark plasma sintering (SPS) was conducted on nanocrystalline ZrO/sub 2/(Y/sub 2/O/sub 3/)-20 mol% Al/sub 2/O/sub 3/ powder at a heat rate of 600 degrees C/min with a short holding time. Full density was obtained at sintering temperatures >1300 degrees C. Considerable grain growth occurred relative to the initial powder particles, but smaller grain size and higher density can be obtained as compared to hot-pressing. High flexural strength and fracture toughness were also achieved for the SPS-resulted composite. (8 refs).

  8. Internal Friction of Li7La3Zr2O12 Based Lithium Ionic Conductors

    Directory of Open Access Journals (Sweden)

    Wang X.P.

    2016-03-01

    Full Text Available The diffusion mechanisms of lithium ions in tetragonal phase as well as in Al and Nb stabilized cubic Li7La3Zr2O12 compounds were investigated by low-frequency internal friction technique. In the cubic Li7La3Zr2O12 phase, a remarkable relaxation-type internal friction peak PC with a peak height up to 0.12 was observed in the temperature range from 15°C to 60°C. In the tetragonal phase however, the height of the PT peak dropped to 0.01. The obvious difference of the relaxation strength between the cubic and tetragonal phases is due to the different distribution of lithium ions in lattice, ordered in the tetragonal phase and disordered in the cubic phase. Based on the crystalline structure of the cubic garnet-type Li7La3Zr2O12 compound, it is suggested that the high internal friction peak in the cubic phase may be attributed to two diffusion processes of lithium ions: 96h↔96h and 96h↔24d.

  9. Development of AL{sub 2}O{sub 3} - ZrO{sub 2} ceramic composite reinforced with rare earth oxides (Y{sub 2}O)3) for inert coating of storage and transport systems of crude petroleum; Desenvolvimento de composito ceramico Al{sub 2}O{sub 3} - ZrO{sub 2} reforcada com oxido de terra rara para sistema de armazenamento e transporte de petroleo cru

    Energy Technology Data Exchange (ETDEWEB)

    Silva, J.C.; Yadava, Y.P.; Sanguinetti Ferreira, R.A.; Albuquerque, L.T., E-mail: juliana.carvalhosilva@ufpe.br [Universidade Federal de Pernambuco (UFPE), Jaboatao de Guararapes, PE (Brazil). Centro de Tecnologia. Departamento de Engenharia Mecanica

    2014-07-01

    The advancement of the oil sector has generated the need for the use of materials resistant to aggressive environments to oil. Although ceramics have high melting point and high hardness is, on the other hand, more fragile and less tough, which can cause damage to the metal structure. The Al{sub 2}O{sub 3} based ceramics reinforced with rare earth oxide can improve tenaciousness and makes the ceramic material more resistant. This article aims to present the production of composite Al{sub 2}O{sub 3} - Y{sub 2}O{sub 3} stabilized ZrO{sub 2} by uniaxial pressing, following sintering (1200-1350 deg C). Structural and microstructural characterizations as XRD (X-Ray Diffraction) and SEM (Scanning Electron Microscopy) and mechanical tests as Vickers hardness, % absorption and % linear shrinkage were conducted to evaluate the feasibility of using the composite and ceramic coating for storage and transportation of oil tanks. The results indicate that the proportions of 5%, 10% and 30% ZrO{sub 2} make it suitable as a good composite suitable coating. (author)

  10. Phase transitions in complex oxide systems based on Al2O3 and ZrO2

    International Nuclear Information System (INIS)

    Gorski, L.

    1999-01-01

    Different compositions of materials based on Al 2 O 3 and ZrO 2 and protective coatings sprayed from them working in the high temperature region are studied. There are especially thermal barrier coatings of increasing resistance to thermal shocks and conditions of corrosion and erosion caused by the hot gases and liquids. Such conditions are encountered in many technical branches among others in jet and Diesel engines. These coatings are deposited by the plasma spraying process and their resistance to thermal shocks is studied on special experimental arrangement in the conditions near to coatings applications. Both above processes are characterized by a short time temperature action with subsequent high cooling rate, which may cause phase transitions other than in the conditions of thermodynamical equilibrium. These transitions are studied by X-ray diffraction analysis methods. The microstructure changes accompanied to phase transitions are determined by light microscopy and scanning electron microscopy methods. The cases of coating degradation caused by thermal shocks have been observed. The highest resistance to thermal fatigue conditions (up to thermal shocks) show coatings based on Al 2 O 3 containing aluminium titanate and coatings based on ZrO 2 stabilised by 7-8% of Y 2 O 3 . (author)

  11. Air Plasma-Sprayed La2Zr2O7-SrZrO3 Composite Thermal Barrier Coating Subjected to CaO-MgO-Al2O3-SiO2 (CMAS)

    Science.gov (United States)

    Cai, Lili; Ma, Wen; Ma, Bole; Guo, Feng; Chen, Weidong; Dong, Hongying; Shuang, Yingchai

    2017-08-01

    La2Zr2O7-SrZrO3 composite thermal barrier coatings (TBCs) were prepared by air plasma spray (APS). The La2Zr2O7-SrZrO3 composite TBCs covered with calcium-magnesium-aluminum-silicate (CMAS) powder, as well as the powder mixture of CMAS and spray-dried La2Zr2O7-SrZrO3 composite powder, were heat-treated at 1250 °C in air for 1, 4, 8, and 12 h. The phase constituents and microstructures of the reaction products were characterized by x-ray diffraction, scanning electron microscopy, and energy-dispersive spectroscopy. Experimental results showed that the La2Zr2O7-SrZrO3 composite TBCs had higher CMAS resistance than 8YSZ coating. A dense new layer developed between CMAS and La2Zr2O7-SrZrO3 composite TBCs during interaction, and this new layer consisted mostly of apatite (Ca2La8(SiO4)6O2) and c-ZrO2. The newly developed layer effectively protected the La2Zr2O7-SrZrO3 composite TBCs from further CMAS attack.

  12. Development and characterization of nickel catalysts supported in CeO{sub 2}-ZrO{sub 2}-Al{sub 2}O{sub 3}, CeO{sub 2}-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3} e ZrO{sub 2}-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3} matrixes evaluated for methane reforming reactions; Desenvolvimento e caracterização de catalisadores de níquel suportados em matrizes CeO{sub 2}-ZrO{sub 2}-Al{sub 2}O{sub 3}, CeO{sub 2}-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3} e ZrO{sub 2}-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3} avaliados para as reações de reforma do metano

    Energy Technology Data Exchange (ETDEWEB)

    Abreu, Amanda Jordão de

    2012-07-01

    Nowadays, the methane reforming is large interest industrial for the take advantage of these gas in production the hydrogen and synthesis gas (syngas). Among in the reactions of methane stand of the reactions steam reforming and carbon dioxide reforming of methane. The main catalysts uses in the methane reforming is Ni/Al{sub 2}O{sub 3}. However, the supported-nickel catalyst is susceptible to the deactivation or the destruction by coke deposition. The carbon dissolves in the nickel crystallite and its diffuses through the nickel, leading for formation of the carbon whiskers, which results in fragmentation of the catalyst. Modification of such catalysts, like incorporation of suitable promoters, is desirable to achieve reduction of the methane hydrogenolysis and/or promotion of the carbon gasification. Catalysts 5%Ni/Al{sub 2}O{sub 3} supported on solid solutions formed by ZrO{sub 2}-CeO{sub 2}, La{sub 2}O{sub 3} and CeO{sub 2}-ZrO{sub 2}-La{sub 2}O{sub 3} were prepared, characterized and evaluated in reactions steam and carbon dioxide reforming and partial oxidation of methane with objective the value effect loading solution solid in support. The supports were prepared by co-precipitation method and catalysts were prepared by impregnation method and calcined at 500 deg C. The supports and catalysts were characterized by Nitrogen Adsorption, method -rays diffraction (XRD), X-rays dispersive spectroscopy (XDS), spectroscopy in the region of the ultraviolet and the visible (UV-vis NIR) to and temperature programmed reduction (TPR), Raman Spectroscopy, X-ray absorption spectroscopy and Thermogravimetric Analysis. After all the catalytic reactions check which the addition of solid solution is beneficial for Ni/Al{sub 2}O{sub 3} catalysts and the best catalysts are Ni/CeO{sub 2}-La{sub 2}O{sub 3}-Al{sub 2}O{sub 3}. (author)

  13. Dual-Layer Oxidation-Protective Plasma-Sprayed SiC-ZrB2/Al2O3-Carbon Nanotube Coating on Graphite

    Science.gov (United States)

    Ariharan, S.; Sengupta, Pradyut; Nisar, Ambreen; Agnihotri, Ankur; Balaji, N.; Aruna, S. T.; Balani, Kantesh

    2017-02-01

    Graphite is used in high-temperature gas-cooled reactors because of its outstanding irradiation performance and corrosion resistance. To restrict its high-temperature (>873 K) oxidation, atmospheric-plasma-sprayed SiC-ZrB2-Al2O3-carbon nanotube (CNT) dual-layer coating was deposited on graphite substrate in this work. The effect of each layer was isolated by processing each component of the coating via spark plasma sintering followed by isothermal kinetic studies. Based on isothermal analysis and the presence of high residual thermal stress in the oxide scale, degradation appeared to be more severe in composites reinforced with CNTs. To avoid the complexity of analysis of composites, the high-temperature activation energy for oxidation was calculated for the single-phase materials only, yielding values of 11.8, 20.5, 43.5, and 4.5 kJ/mol for graphite, SiC, ZrB2, and CNT, respectively, with increased thermal stability for ZrB2 and SiC. These results were then used to evaluate the oxidation rate for the composites analytically. This study has broad implications for wider use of dual-layer (SiC-ZrB2/Al2O3) coatings for protecting graphite crucibles even at temperatures above 1073 K.

  14. Indides RE{sub 3}T{sub 2}In{sub 4} (RE = Y, Gd-Tm, Lu; T = Ni, Ru, Rh) with a ZrNiAl superstructure

    Energy Technology Data Exchange (ETDEWEB)

    Heying, Birgit; Niehaus, Oliver; Rodewald, Ute C.; Poettgen, Rainer [Univ. Muenster (Germany). Inst. fuer Anorganische und Analytische Chemie

    2016-07-01

    Three series of rare earth-transition metal-indides RE{sub 3}T{sub 2}In{sub 4} (RE=Y, Gd-Tm, Lu; T=Ni, Ru, Rh) were synthesized from arc-melted RE{sub 3}T{sub 2} precursor compounds and indium tear shot in sealed niobium ampoules using different annealing sequences. The new indides crystallize with the hexagonal Lu{sub 3}Co{sub 2}In{sub 4}-type structure, space group P anti 6. All samples were characterized on the basis of Guinier powder patterns and six structures were refined from single crystal X-ray diffractometer data. The RE{sub 3}T{sub 2}In{sub 4} structures are derived from the ZrNiAl type through RE/In ordering, paralleled by a symmetry reduction from P anti 62m to P anti 6. This induces twinning for some of the investigated crystals. The main crystal chemical motifs of the RE{sub 3}T{sub 2}In{sub 4} structures are trigonal prisms of rare earth, respectively indium atoms that are filled by the transition metals.

  15. Electronic structure of ZrX2 (X = Se, Te)

    Science.gov (United States)

    Shkvarin, A. S.; Merentsov, A. I.; Shkvarina, E. G.; Yarmoshenko, Yu. M.; Píš, I.; Nappini, S.; Titov, A. N.

    2018-03-01

    The electronic structure of the ZrX2 (X = Se, Te) compounds has been studied using photoelectron, resonant photoelectron and X-ray absorption spectroscopy, theoretical calculations of the X-ray absorption spectra, and density of electronic states. It was found that the absorption spectra and valence band spectra are influenced by the chalcogen type. The results of the multiplet calculation of the Zr4+ atom show that the change in the splitting in the crystal field, which is described by the 10Dq parameter, is due to the change in the ratio of covalent and ionic contributions to the chemical bond. The resonance band near the Fermi level in the valence band spectra is observed for ZrTe2 in the Zr 3p-4d resonant excitation mode. The extent of photon energy indicates the charge localization on the Zr atom. Similar resonance band for ZrSe2 is absent; it indicates the presence of a gap at the Fermi level.

  16. Resistive switching in ZrO{sub 2} based metal-oxide-metal structures

    Energy Technology Data Exchange (ETDEWEB)

    Kaerkkaenen, Irina

    2014-07-01

    The goal of this work is a deeper understanding of the influence of the (i) metal-oxide-metal (MOM) layer stacks configuration, (ii) the oxide films microstructure, (iii) and their defect structure on the appearance of different switching modes, i.e. unipolar (UP) and bipolar (BP). The first part deals with the fabrication of ZrO{sub 2} thin films by an industrial compatible atomic layer deposition (ALD) process, the chemical, structural and morphological characterization of the films, the growth of ZrO{sub 2}/TiO{sub 2} bilayers, the integration of the layers into metal-oxide-metal (MOM) devices and the electrical characterization with focus on the RS behavior. In the second part the effect of the device structure, in particular the thickness of the electrochemical active electrode (EAE) and the ZrO{sub 2} film morphology, on the RS switching polarity of Pt/ZrO{sub 2}/(EAE) cells is discussed. ZrO{sub 2} films and ZrO{sub 2}/TiO{sub 2} bilayers were grown by ALD and were carefully structurally and electrically characterized. The ZrO{sub 2} films grown from Zr[N(CH{sub 3})C{sub 2}H{sub 5}]{sub 4} (TEMA-Zr) at 240 C were polycrystalline with a mixture of cubic/tetragonal phases. ALD/H{sub 2}O-ZrO{sub 2} films exhibited a random oriented polycrystalline structure, whereas the ALD/O{sub 3}-ZrO{sub 2} films consisted of preferably oriented cubic shaped grains. Pt/ZrO{sub 2}/Ti/Pt structures with a Ti top electrode (TE) thickness of 5 to 20 nm showed unipolar type RS behavior, while by increasing the Ti TE thickness a gradual change of switching polarity from unipolar to bipolar with a completely bipolar type RS behavior for a Ti TE thickness of 40 nm is found. The switching in Pt/ZrO{sub 2}/TiO{sub 2}/Ti/Pt devices was unipolar, comparable to Pt/ZrO{sub 2}/Ti/Pt cells. In contrast, bilayers with the reverse structure, Pt/TiO{sub 2}/ZrO{sub 2}/Ti/Pt, showed non-switching behavior. The effect of the cells stack structure on the polarity of the RS behavior was studied in

  17. Influence of Al{sub 2}O{sub 3} addition on microstructure and mechanical properties of 3YSZ-Al{sub 2}O{sub 3} composites

    Energy Technology Data Exchange (ETDEWEB)

    Abden, Md. Jaynul [International Islamic Univ., Chittagong (Bangladesh). Dept. of Electrical and Electronic Engineering; Afroze, Jannatul Dil [Noakhali Science and Technology Univ. (Bangladesh). Faculty of Science and Engineering; Gafur, Md. Abdul [Bangladesh Council of Scientific and Industrial Research, Dhaka (Bangladesh). Pilot Plant and Process Development Centre; Chowdhury, Faruque-Uz-Zaman [Chittagong University of Engineering and Technology (Bangladesh). Dept. of Physics

    2015-07-01

    The effect of the amount of Al{sub 2}O{sub 3} content on microstructure, tetragonal phase stability and mechanical properties of 3YSZ-Al{sub 2}O{sub 3} composites are investigated in this study. The ceramic composites are obtained by means of uniaxial compacting at 210 MPa and green compacts are sintered at 1550 C for 3 h in air. The monoclinic zirconia (m-ZrO{sub 2}) phase has completely been transformed into tetragonal zirconia (t-ZrO{sub 2}) phase with corresponding higher Al{sub 2}O{sub 3} content. The t-ZrO{sub 2} grains induce transgranular fracture mode that has contribution in improvement of fracture toughness. The maximum flexural strength of 340 MPa, Vickers hardness value of 14.31 GPa and fracture toughness of 5.1 MPa x m{sup 1/2} in the composition containing 40 wt.-% Al{sub 2}O{sub 3} is attributed to the microstructure with t-ZrO{sub 2} grains as inter- and intragranular particles in the Al{sub 2}O{sub 3} grains, which makes it suitable for dental applications.

  18. Electronic structures, elastic properties, and minimum thermal conductivities of cermet M{sub 3}AlN

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Jin [Faculty of Materials and Energy, Southwest University, Chongqing 400715 (China); Key Laboratory of Liquid–Solid Structural Evolution and Processing of Materials, Ministry of Education, Shandong University, Jinan 250061 (China); Chen, ZhiQian, E-mail: chen_zq@swu.edu.cn [Faculty of Materials and Energy, Southwest University, Chongqing 400715 (China); Li, ChunMei; Li, Feng; Nie, ChaoYin [Faculty of Materials and Energy, Southwest University, Chongqing 400715 (China)

    2014-08-15

    The electronic structures and elastic anisotropies of cubic Ti{sub 3}AlN, Zr{sub 3}AlN, and Hf{sub 3}AlN are investigated by pseudopotential plane-wave method based on density functional theory. At the Fermi level, the electronic structures of these compounds are successive with no energy gap between conduct and valence bands, and exhibit metallicity in ground states. In valence band of each partial density of states, the different orbital electrons indicate interaction of corresponding atoms. In addition, the anisotropy of Hf{sub 3}AlN is found to be significantly different from that of Ti{sub 3}AlN and Zr{sub 3}AlN, which involve the differences in the bonding strength. It is notable that Hf{sub 3}AlN is a desired thermal barrier material with the lowest thermal conductivity at high temperature among the three compounds. - Graphical abstract: 1.Young's moduli of anti-perovskite Ti{sub 3}AlN, Zr{sub 3}AlN, and Hf{sub 3}AlN in full space. 2.Electron density differences on crystal planes (1 0 0), (2 0 0), and (1 1 0) of anti-perovskite Zr{sub 3}AlN. - Highlights: • We calculated three anti-perovskite cermets with first-principles theory. • We illustrated 3D Young modulus and found the anomalous anisotropy. • We explained the anomaly and calculated the minimum thermal conductivities.

  19. Structure and defect studies of In2O3:Zn,Zr for higher stability TCO

    Science.gov (United States)

    Herwadkar, Aditi; Kim, Kwiseon

    2010-03-01

    The defects structures among the transparent conducting oxides (TCO) plays a major role in determining stability of the oxide over a temperature range and in tuning electrical and optical properties for the different TCO applications In2O3 crystallizes in the cubic bixbyite structure. The structure can be derived from the related fluorite structure by removing one fourth of the anions and allowing for small shifts of the ionic positions. In2O3 has two non-equivalent six-fold coordinated cation sites. For one of the sites, the cation is bounded by two structural vacancy along the body diagonal and for the other non-equivalent site the vacancies lie along the face diagonal. These vacancies are actually empty oxygen vacancy positions. Indium is in +3 charge state. ZnO on the other hand crystallizes to form wurtzite structure with four-fold coordination for Zn and is in +2 charge state where as the crystal structure of ZrO is rulite with Zr in +4 charge state and is four fold coordinated. Co-doping of Zn and Zr with each substituting the In atom satisfies the octet rule and is lower in energy then the individual substitutions with overall neutrality. The formation enthalpy as a function of pair (Zn, Zr) shows a minimum at experimental composition of In2(Zn,Zr)3O24. We in this work present the electronic structure optimization and study the defect states in this material.

  20. Quaternary chalcogenides of the IVa metals with layered structures: preparation and crystal structures of TlCuTIVQ3 (T=Zr, Hf; Q=S, Se) and their relation to the Re3B structure type

    International Nuclear Information System (INIS)

    Klepp, K.O.; Gurtner, D.

    1996-01-01

    The new compounds TlCuT IV Q 3 (T = Zr, Hf; Q = S, Se) were prepared by reacting intimate mixtures of Tl 2 S or TlSe with stoichiometric amounts of the corresponding Group IV metal, Cu and the corresponding chalcogen at 870 . The four compounds are isostructural and crystallize in Cmcm, Z = 4 with a 3.726(4) A, b = 13.987(9) A, c = 9.783(4) A for TlCuZrS 3 ; a = 3.847(1) A, b 14.381(6) A, c = 10.150(1) A for TlCuZrSe 3 ; a = 3.694(1) A, b = 14.030(3) A, c = 9.750(3) A for TlCuHfS 3 ; and a = 3.831(1) A, b = 14.409(9) A, c = 10.124(2) A for TlCuHfSe 3 . Their crystal structures were determined from single crystal diffractometer data (Mo Kα radiation, ambient temperature) and refined to conventional R values of 0.016, 0.040, 0.019 and 0.031 respectively. An outstanding feature of their crystal structures is the formation of infinite anionic layers, 2 ∞ -[CuT IV Q 3 ] - parallel to (010), which are separated by Tl + cations. These layers are built up by edge sharing TQ 6 octahedra and distorted CuQ 4 tetrahedra. Average T-Q distances are anti d(Zr-S) = 2.586(1) A, anti d(Zr-Se) = 2.707(1) A, anti d(Hf-S) = 2.569(2) A and anti d(Hf-Se) = 2.694(1) A. Cu-chalcogen distances are anti d(Cu-S) = 2.318(2) A and anti d(Cu-Se) = 2.432(3) A respectively. The thallium ions are in bicapped trigonal prismatic chalcogen coordinations. The atomic arrangement corresponds to that of KCuZrS 3 ; based on the thallium-chalcogen partial structure it can be regarded as a filled variant of an anti-Re 3 B structure type. (orig.)

  1. Effect of the theta-alpha-Al2O3 transformation on the oxidation behavior of beta-NiAl+Zr

    Science.gov (United States)

    Rybicki, George C.; Smialek, James L.

    1989-01-01

    Isothermal oxidation of NiAl+Zr has been performed over the temperature range of 800-1200 C and studied by TGA, XRD, and SEM. A discontinuous decrease in growth rate of two orders of magnitude was observed at 1000 C due to the formation of alpha-Al2O3 from theta-Al2O3. This transformation also resulted in a dramatic change in the surface morphology of the scales, as a whisker topography was changed into a weblike network of oxide ridges and radial transformation cracks. It is believed that the ridges are evidence for a short-circuit outward aluminum diffusion growth mechanism that has been documented in a number of O-18 tracer studies.

  2. Investigation into the use of CaZrO3 as a facecoat material in the investment casting of TiAl alloys

    International Nuclear Information System (INIS)

    Yuan, C.; Cheng, X.; Withey, P.A.

    2015-01-01

    Research was carried out to determine the interactions between the filler and stucco materials in CaZrO 3 based facecoats during shell firing as well as between the facecoat and a TiAl alloy during the casting process. A ‘flash re-melting’ technique, which gives a similar heating profile to the actual investment casting process, was used to study the phase transformations in the shell moulds. The chemical inertness of the facecoat was then investigated using a sessile drop test using a Ti–45Al–2Nb–2Mn–0.2TiB alloy. In this study, the facecoat compositions and the interaction products between metal and shells were characterized using x-ray diffraction, scanning electron microscopy (SEM) and transmission electron microscopy (TEM). A severe interaction was found between CaZrO 3 filler and Al 2 O 3 stucco, which rapidly damaged the shell surface. As well as oxygen, zirconium and silicon ions from the shell moulds were also observed to penetrate into the TiAl metal to form (Ti, Zr) 5 (Al, Si) 3 phases in the metal/shell interfacial areas. - Highlights: • To determine the interactions between CaZrO 3 filler and stucco materials during shell firing. • To study the reaction between the CaZrO 3 facecoat and TiAl alloy during casting. • The Al 2 O 3 stucco can react with CaZrO 3 filler to form (Zr, Ca)O 2 and CaAl x O y at 1650 °C. • O, Zr and Si ions from the ceramic moulds were observed to penetrate into the TiAl metal. • The reaction products include (Ti, Zr) 5 (Al, Si) 3 and ZrAl 2 phase with high Ti ions solid solution

  3. Effect of Si and Zr on the Microstructure and Properties of Al-Fe-Si-Zr Alloys

    Directory of Open Access Journals (Sweden)

    Anna Morozova

    2017-11-01

    Full Text Available The effects of Si and Zr on the microstructure, microhardness and electrical conductivity of Al-Fe-Si-Zr alloys were studied. An increase in the Zr content over 0.3 wt. % leads to the formation of primary Al3Zr inclusions and also decreases mechanical properties. Therefore, the Zr content should not be more than 0.3 wt. %, although the smaller content is insufficient for the strengthening by the secondary Al3Zr precipitates. The present results indicate that high content of Si significantly affects the hardness and electrical conductivity of the investigated alloys. However, the absence of Si led to the formation of harmful needle-shaped Al3Fe particles in the microstructure of the investigated alloys after annealing. Therefore, the optimum amount of Si was 0.25–0.50 wt. % due to the formation of the Al8Fe2Si phase with the preferable platelet morphology. The maximum microhardness and strengthening effects in Al-1% Fe-0.25% Si-0.3% Zr were observed after annealing at 400–450 °C due to the formation of nanosized coherent Al3Zr (L12 dispersoids. The effect of the increasing of the electrical conductivity can be explained by the decomposition of the solid solution. Thus, Al-1% Fe-0.25% Si-0.3% Zr alloy annealed at 450 °C has been studied in detail as the most attractive with respect to the special focus on transmission line applications.

  4. 27Al nuclear magnetic resonance of glassy and crystalline Zr(1-x)AlxO(2-x/2) materials prepared from solution precursors

    International Nuclear Information System (INIS)

    Balmer, M.L.; Eckert, H.; Das, N.; Lange, F.F.

    1996-01-01

    The local environment of the aluminum atoms in a series of metastable Zr (1-x) Al x O (2-x/2) crystalline materials (0.08 ≤ x ≤ 0.57), prepared by diffusion-limited crystallization of amorphous precursors, has been determined by 27 Al magic angle spinning nuclear magnetic resonance (MAS NMR). Results show the existence of aluminum in 4-, 5-, and 6-fold coordination in both the amorphous and crystalline states. Although the relative amounts of each type of coordination show no compositional dependence in the amorphous state, the results for the crystalline materials show a systematic decrease in the average aluminum coordination number with increasing aluminum content. Comparisons of MAS NMR results between pure Al 2 O 3 precursors and Zr (1-x) Al x O (2-x/2) crystalline materials processed under similar conditions show a profound effect of ZrO 2 on the coordination environment of the aluminum atom. Both a random distribution model and a model that assumes small-scale clustering of aluminum ions are considered to explain the trends in the type of aluminum coordination as a function of composition

  5. Can reduced size of metals induce hydrogen absorption: ZrAl{sub 2} case

    Energy Technology Data Exchange (ETDEWEB)

    Jacob, I., E-mail: izi@bgu.ac.il [Department of Nuclear Engineering, Ben-Gurion University of the Negev, Beer Sheva 84105 (Israel); Deledda, S. [Physics Department, Institute for Energy Technology, P.O. Box 40, NO-2027 Kjeller (Norway); Bereznitsky, M. [Department of Nuclear Engineering, Ben-Gurion University of the Negev, Beer Sheva 84105 (Israel); Yeheskel, O. [Nuclear Research Center - Negev, P.O. Box 9001, Beer Sheva 84190 (Israel); Filipek, S.M. [Institute of Physical Chemistry, Polish Academy of Sciences, 01-224 Warsaw (Poland); Mogilyanski, D.; Kimmel, G. [Institute for Applied Research, P.O. Box 653, Ben-Gurion University of the Negev, Beer Sheva 84105 (Israel); Hauback, B.C. [Physics Department, Institute for Energy Technology, P.O. Box 40, NO-2027 Kjeller (Norway)

    2011-09-15

    Research highlights: > 15 nm particles of ZrAl{sub 2} and Zr(Al{sub 0.5}Co{sub 0.5}){sub 2} are obtained by attrition and cryomilling. > ZrAl{sub 2} nanoparticles remain inert to hydrogen absorption up to pressure of {approx}2 GPa. > Zr(Al{sub 0.5}Co{sub 0.5}){sub 2} nanoparticles exhibit reduced hydrogen absorption as compared to the corresponding bulk compounds. - Abstract: The hydrogen absorption ability of the non-absorbing Al-rich ZrAl{sub 2} compound was examined after reducing its particles-size to the nanometer regime. The hydrogen abstinence of bulk ZrAl{sub 2} has been previously related to its excessive elastic shear stiffening. The particle size of ZrAl{sub 2} was reduced by attrition milling and cryomilling. The minimal average particle size was estimated from powder X-ray diffraction analysis to be in the range of 10-20 nm. The hydrogen absorption of the milled compounds was measured in different hydrogenation systems at hydrogen pressures between {approx}6 MPa and {approx}2 GPa. In all the cases the hydrogen absorption was negligible. In addition, there was a reduction of the hydrogen absorption capacity of nanosized Zr(Al{sub 0.5}Co{sub 0.5}){sub 2} as compared to the corresponding bulk compound at the same conditions. We suggest, in view of our and other results, that no significant improvement of the thermodynamics (unlike the kinetics) of the hydrogen absorption can be achieved via the nanoparticle avenue.

  6. Tracking the path of dislocations across ordered Al3Zr nano-precipitates in three dimensions

    International Nuclear Information System (INIS)

    Lefebvre, W.; Masquelier, N.; Houard, J.; Patte, R.; Zapolsky, H.

    2014-01-01

    Graphical abstract: -- We report on the shear–bypassing transition of chemically ordered Al 3 Zr nanoprecipitates. Observation of complex combinations of lattice translations, revealed by scanning transmission electron microscopy, is used as the signature of precipitate shearing during cold deformation. A method is proposed to build a three-dimensional atomic model of sheared particles from a set of three atomic scale projections. An estimation of the antiphase boundary energy of the Al 3 Zr structure is achieved via the comparison of experimental findings to a model of precipitation hardening

  7. High temperature steam oxidation of Al3Ti-based alloys for the oxidation-resistant surface layer on Zr fuel claddings

    International Nuclear Information System (INIS)

    Park, Jeong-Yong; Kim, Il-Hyun; Jung, Yang-Il; Kim, Hyun-Gil; Park, Dong-Jun; Choi, Byung-Kwon

    2013-01-01

    We investigated the feasibility to apply Al 3 Ti-based alloys as the surface layer for improving the oxidation resistance of Zr fuel claddings under accident conditions. Two types of Al 3 Ti-based alloys with the compositions of Al–25Ti–10Cr and Al–21Ti–23Cr in atomic percent were prepared by arc-melting followed by homogenization annealing at 1423 K for 48 h. Al–25Ti–10Cr alloy showed an L1 2 quasi-single phase microstructure with a lot of needle-shaped minor phase and pores. Al–21Ti–23Cr alloy consisted of an L1 2 matrix and Cr 2 Al as the second phase. Al 3 Ti-based alloys showed an extremely low oxidation rate in a 1473 K steam for up to 7200 s when compared to Zircaloy-4. Both alloys exhibited almost the same oxidation rate in the early stage of oxidation, but Al–25Ti–10Cr showed a little lower oxidation rate after 4000 s than Al–21Ti–23Cr. The difference in the oxidation rate between two types of Al 3 Ti-based alloys was too marginal to distinguish the oxidation behavior of each alloy. The resultant oxide exhibited almost the same characteristics in both alloys even though the microstructure was explicitly distinguished from each other. The crystal structure of the oxide formed up to 2000 s was identified as Al 2 O 3 in both alloys. The oxide morphology consisted of columnar grains whose length was almost identical to the average oxide thickness. On the basis of the results obtained, it is considered that Al 3 Ti-based alloy is one of the promising candidates for the oxidation-resistant surface layer on Zr fuel claddings

  8. The behavior of ZrO_2/20%Y_2O_3 and Al_2O_3 coatings deposited on aluminum alloys at high temperature regime

    International Nuclear Information System (INIS)

    Pintilei, G.L.; Crismaru, V.I.; Abrudeanu, M.; Munteanu, C.; Baciu, E.R.; Istrate, B.; Basescu, N.

    2015-01-01

    Highlights: • In both the ZrO_2/20%Y_2O_3 and Al_2O_3 coatings the high temperature caused a decrease of pores volume and a lower thickness of the interface between successive splats. • The NiCr bond layer in the sample with a ZrO_2/20%Y_2O_3 suffered a fragmentation due to high temperature exposure and thermal expansion which can lead to coating exfoliation. • The NiCr bond layer in the sample with an Al_2O_3 coating showed an increase of pore volume due to high temperature. - Abstract: Aluminum alloy present numerous advantages like lightness, high specific strength and diversity which recommend them to a high number of applications from different fields. In extreme environments the protection of aluminum alloys is difficult and requires a high number of requirements like high temperature resistance, thermal fatigue resistance, corrosion fatigue resistance and galvanic corrosion resistance. To obtain these characteristics coatings can be applied to the surfaces so they can enhance the mechanical and chemical properties of the parts. In this paper two coatings were considered for deposition on an AA2024 aluminum alloy, ZrO_2/20%Y_2O_3 and Al_2O_3. To obtain a better adherence of the coating to the base material an additional bond layer of NiCr is used. Both the coatings and bond layer were deposited by atmospheric plasma spraying on the samples. The samples were subjected to a temperature of 500 °C and after that slowly cooled to room temperature. The samples were analyzed by electron microscopy and X-ray diffraction to determine the morphological and phase changes that occurred during the temperature exposure. To determine the stress level in the parts due to thermal expansion a finite element analysis was performed in the same conditions as the tests.

  9. New Intermetallic Ternary Phosphide Chalcogenide AP2-xXx (A = Zr, Hf; X = S, Se) Superconductors with PbFCl-Type Crystal Structure

    Science.gov (United States)

    Kitô, Hijiri; Yanagi, Yousuke; Ishida, Shigeyuki; Oka, Kunihiko; Gotoh, Yoshito; Fujihisa, Hiroshi; Yoshida, Yoshiyuki; Iyo, Akira; Eisaki, Hiroshi

    2014-07-01

    We have synthesized a series of intermetallic ternary phosphide chalcogenide superconductors, AP2-xXx (A = Zr, Hf; X = S, Se), using the high-pressure synthesis technique. These materials have a PbFCl-type crystal structure (space group P4/nmm) when x is greater than 0.3. The superconducting transition temperature Tc changes systematically with x, yielding dome-like phase diagrams. The maximum Tc is achieved at approximately x = 0.7, at which point the Tc is 6.3 K for ZrP2-xSex (x = 0.75), 5.5 K for HfP2-xSex (x = 0.7), 5.0 K for ZrP2-xSx (x = 0.675), and 4.6 K for Hfp2-xSx (x = 0.5). They are typical type-II superconductors and the upper and lower critical fields are estimated to be 2.92 T at 0 K and 0.021 T at 2 K for ZrP2-xSex (x = 0.75), respectively.

  10. Cast Aluminum Alloys for High Temperature Applications Using Nanoparticles Al2O3 and Al3-X Compounds (X = Ti, V, Zr)

    Science.gov (United States)

    Lee, Jonathan A.

    2009-01-01

    In this paper, the effect of nanoparticles Al2O3 and Al3-X compounds (X = Ti, V, Zr) on the improvement of mechanical properties of aluminum alloys for elevated temperature applications is presented. These nanoparticles were selected based on their low cost, chemical stability and low diffusions rates in aluminum at high temperatures. The strengthening mechanism at high temperature for aluminum alloy is based on the mechanical blocking of dislocation movements by these nanoparticles. For Al2O3 nanoparticles, the test samples were prepared from special Al2O3 preforms, which were produced using ceramic injection molding process and then pressure infiltrated by molten aluminum. In another method, Al2O3 nanoparticles can also be homogeneously mixed with fine aluminum powder and consolidated into test samples through hot pressing and sintering. With the Al3-X nanoparticles, the test samples are produced as precipitates from in-situ reactions with molten aluminum using conventional permanent mold or die casting techniques. It is found that cast aluminum alloy using nanoparticles Al3-X is the most cost effective method to produce high strength aluminum alloys for high temperature applications in comparison to nanoparticles Al2O3. Furthermore, significant mechanical properties retention in high temperature environment could be achieved with Al3-X nanoparticles, resulting in tensile strength of nearly 3 times higher than most 300- series conventional cast aluminum alloys tested at 600 F.

  11. Comparison of structural and electric properties of PbZr0.2Ti0.8O3 and CoFe2O4/PbZr0.2Ti0.8O3 films on (100)LaAlO3

    Science.gov (United States)

    Zhang, X. D.; Dho, Joonghoe; Park, Sungmin; Kwon, Hyosang; Hwang, Jihwan; Park, Gwangseo; Kwon, Daeyoung; Kim, Bongju; Jin, Yeryeong; Kim, Bog. G.; Karpinsky, D.; Kholkin, A. L.

    2011-09-01

    In this work, we investigated structural, electrical, and magnetic properties of ferroelectric PbZr0.2Ti0.8O3 (PZT) and ferrimagnetic/ferroelectric [CoFe2O4(CFO)/PZT] bilayers grown on (100)LaAlO3 (LAO) substrates supplied with bottom 50 nm thick LaNiO3 electrodes. Interestingly, structural and electrical properties of the PZT layer exhibited remarkable changes after the top-layer CFO deposition. X-ray diffraction data suggested that both the c- and a-domains exist in the PZT layer and the tetragonality of the PZT decreases upon the top-layer deposition. A variation in the electrical properties of the PZT layer upon the CFO deposition was investigated by polarization versus voltage (P-V), capacitance versus voltage (C-V), and capacitance versus frequency (C-f) measurements. The CFO deposition induced a slight decrease of the remnant polarization and more symmetric behavior of P-V loops as well as led to the improvement of fatigue behavior. The tentative origin of enhanced fatigue endurance is discussed based on the measurement results. These results were corroborated by local piezoelectric measurements. Ferrimagnetic property of the CFO/PZT bilayer was confirmed by magnetic measurement at room temperature.

  12. Investigation of electronic, magnetic and thermoelectric properties of Zr{sub 2}NiZ (Z = Al,Ga) ferromagnets

    Energy Technology Data Exchange (ETDEWEB)

    Yousuf, Saleem, E-mail: nengroosaleem17@gmail.com; Gupta, Dinesh C., E-mail: sosfizix@gmail.com

    2017-05-01

    Systematic investigation of impact of electronic structure and magnetism, on the thermoelectric properties of new Zr{sub 2}NiZ (Z = Al, Ga) Heusler alloys are determined using density functional theory calculations. Half-metallicity with ferromagnetic character is supported by their 100% spin polarizations at the Fermi level. Magnetic moment of ∼3 μ{sub B} is according to the Slater-Puling rule, enables their practical applications. Electron density plots are used to analyse the nature of bonding and chemical composition. Boltzmann's theory is conveniently employed to investigate the thermoelectric properties of these compounds. The analysis of the thermal transport properties specifies the Seebeck coefficient as 25.6 μV/K and 18.6 μV/K at room temperature for Zr{sub 2}NiAl and Zr{sub 2}NiGa, respectively. The half-metallic nature with efficient thermoelectric coefficients suggests the likelihood of these materials to have application in designing spintronic devices and imminent thermoelectric materials. - Highlights: • The compounds are half-metallic ferromagnets. • 100% spin-polarized compounds for spintronics. • Increasing Seebeck coefficient over a wide temperature range. • Zr{sub 2}NiAl is efficient thermoelectric material than Zr{sub 2}NiGa.

  13. Defect structure of TiS{sub 3} single crystals of the A-ZrSe{sub 3} type

    Energy Technology Data Exchange (ETDEWEB)

    Bolotina, N. B., E-mail: nb-bolotina@mail.ru [Russian Academy of Sciences, Shubnikov Institute of Crystallography, Federal Scientific Research Centre “Crystallography and Photonics,” (Russian Federation); Gorlova, I. G. [Russian Academy of Sciences, Kotel’nikov Institute of Radioengineering and Electronics (Russian Federation); Verin, I. A. [Russian Academy of Sciences, Shubnikov Institute of Crystallography, Federal Scientific Research Centre “Crystallography and Photonics,” (Russian Federation); Titov, A. N. [Russian Academy of Sciences, Mikheev Institute of Metal Physics, Ural Branch (Russian Federation); Arakcheeva, A. V. [Phase Solutions, Co Ltd. (Switzerland)

    2016-11-15

    The defect structure of TiS{sub 3} single crystals of the A-ZrSe{sub 3} type has been determined based on X-ray diffraction data. Shear defects manifest themselves as displacements of ab layers (which can imitate a twin) by ∼0.5a. Regular shears facilitate the formation of a superstructure along the c axis. A model of defect in the layer structure is proposed to explain the atomic displacements at an angle to the layer plane.

  14. Frictional properties of CeO$_{2}$-Al$_{2}$O$_{3}$-ZrO$_{2}$ plasma-sprayed film under mixed and boundary lubricating conditions

    CERN Document Server

    Kita, H; Osumi, K; 10.2109/jcersj.112.615

    2004-01-01

    In order to find a counterpart for reducing the frictional coefficient of Al/sub 2/O/sub 3/-ZrO/sub 2/-CeO/sub 2/ plasma-sprayed film, the sliding properties in mixed and boundary lubricating conditions was investigated. It was found that combination of a CrN- coated cast iron pin and an Al/sub 2/O/sub 3/-ZrO/sub 2/-CeO/sub 2/ plasma sprayed plate provided the lowest frictional coefficient among several combinations chosen from practical materials. The coefficient of friction was much lower than that of the materials combination widely used for piston ring and cylinder liner. It was inferred that the combination of a pin made of hard materials with high density, a smooth surface such as CrN-coated cast iron and a porous plate can reduce the frictional coefficient because less sliding resistance is implemented and porosity retains oil.

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

    Science.gov (United States)

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

    2007-12-01

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

  16. Epitaxial growth and properties of YBa2Cu3O(x)-Pb(Zr(0.6)Ti(0.4))O3-YBa2Cu3O(x) trilayer structure by laser ablation

    Science.gov (United States)

    Boikov, Iu. A.; Esaian, S. K.; Ivanov, Z. G.; Brorsson, G.; Claeson, T.; Lee, J.; Safari, A.

    1992-08-01

    YBa2Cu3O(x)Pb(Zr(0.6)Ti(0.4))O3-YBa2Cu3O(x) multilayer structure has been grown on SrTiO3 and Al2O3 substrates using laser ablation. The deposition conditions for the growth of trilayers and their properties are studied in this investigation. Scanning electron microscope images and X-ray diffraction analyses indicate that all the constituent films in the trilayer grow epitaxially on SrTiO3 and were highly oriented on Al2O3. Transport measurements on these multilayers show that top YBa2Cu3O(x) films have good superconducting properties.

  17. Preparation of Ca0.5Zr2(PO4)3 and Ca0.45Eu0.05Zr2(PO4)3 nanopowders: structural characterization and luminescence emission study

    International Nuclear Information System (INIS)

    Alcaraz, L; Isasi, J; Díaz-Guerra, C; Peiteado, M; Caballero, A C

    2016-01-01

    Ca 0.5 Zr 2 (PO 4 ) 3 and Ca 0.45 Eu 0.05 Zr 2 (PO 4 ) 3 nanophosphors have been synthesized by a sol–gel process under acid and basic conditions. In order to achieve the reduction of Eu 3+ to Eu 2+ , europium-doped samples were treated in a reducing atmosphere flow. The effects of the different synthesis conditions and the partial substitution of calcium by europium ions on the structure of the samples were analyzed by x-ray diffraction (XRD) transmission electron microscopy (TEM) and micro-Raman spectroscopy. Luminescence and magnetic properties were investigated by photoluminescence (PL) spectroscopy and magnetic susceptibility measurements. XRD patterns can be indexed to a rhombohedral symmetry of space group R-3 with Z  =  6, consistent with a NASICON-type structure. A higher crystallinity was found in the samples prepared under basic conditions. TEM images of all the synthesized samples show spherically shaped particles. A broadening of the Raman bands as a result of non-equivalent vibrations of the orthophosphate groups is observed for samples prepared under acid conditions. The same effect was found when calcium is substituted by europium into the Ca 0.5 Zr 2 (PO 4 ) 3 host. PL spectra exhibit strong emission in the blue-green spectral range due to Eu 2+ 4f 6 5d 1 -4f 7 transitions and no evidence of Eu 3+ emission. Magnetic measurements confirm the 2+  oxidation state of europium ions in all samples. (paper)

  18. Investigation into the use of CaZrO{sub 3} as a facecoat material in the investment casting of TiAl alloys

    Energy Technology Data Exchange (ETDEWEB)

    Yuan, C., E-mail: c.yuan@bham.ac.uk [School of Metallurgy and Materials, The University of Birmingham, B152TT (United Kingdom); Cheng, X. [School of Metallurgy and Materials, The University of Birmingham, B152TT (United Kingdom); School of Material Science and Engineering, Beihang University, No, 37 Xueyuan Street, Haidian District, Beijing 100191 (China); Withey, P.A. [School of Metallurgy and Materials, The University of Birmingham, B152TT (United Kingdom); Rolls-Royce plc. (United Kingdom)

    2015-04-01

    Research was carried out to determine the interactions between the filler and stucco materials in CaZrO{sub 3} based facecoats during shell firing as well as between the facecoat and a TiAl alloy during the casting process. A ‘flash re-melting’ technique, which gives a similar heating profile to the actual investment casting process, was used to study the phase transformations in the shell moulds. The chemical inertness of the facecoat was then investigated using a sessile drop test using a Ti–45Al–2Nb–2Mn–0.2TiB alloy. In this study, the facecoat compositions and the interaction products between metal and shells were characterized using x-ray diffraction, scanning electron microscopy (SEM) and transmission electron microscopy (TEM). A severe interaction was found between CaZrO{sub 3} filler and Al{sub 2}O{sub 3} stucco, which rapidly damaged the shell surface. As well as oxygen, zirconium and silicon ions from the shell moulds were also observed to penetrate into the TiAl metal to form (Ti, Zr){sub 5}(Al, Si){sub 3} phases in the metal/shell interfacial areas. - Highlights: • To determine the interactions between CaZrO{sub 3} filler and stucco materials during shell firing. • To study the reaction between the CaZrO{sub 3} facecoat and TiAl alloy during casting. • The Al{sub 2}O{sub 3} stucco can react with CaZrO{sub 3} filler to form (Zr, Ca)O{sub 2} and CaAl{sub x}O{sub y} at 1650 °C. • O, Zr and Si ions from the ceramic moulds were observed to penetrate into the TiAl metal. • The reaction products include (Ti, Zr){sub 5}(Al, Si){sub 3} and ZrAl{sub 2} phase with high Ti ions solid solution.

  19. Microstructure and Phase Analysis in Mn-Al and Zr-Co Permanent Magnets

    Science.gov (United States)

    Lucis, Michael J.

    In America's search for energy independence, the development of rare-earth free permanent magnets is one hurdle that still stands in the way. Permanent magnet motors provide a higher efficiency than induction motors in applications such as hybrid vehicles and wind turbines. This thesis investigates the ability of two materials, Mn-Al and Zr-Co, to fill this need for a permanent magnet material whose components are readily available within the U.S. and whose supply chain is more stable than that of the rare-earth materials. This thesis focuses on the creation and optimization of these two materials to later be used as the hard phase in nanocomposites with high energy products (greater than 10 MGOe). Mn-Al is capable of forming the pure L10 structure at a composition of Mn54Al43C3. When Mn is replaced by Fe or Cu using the formula Mn48Al43C3T6 the anisotropy constant is lowered from 1.3·107 ergs/cm3 to 1.0·107 ergs/cm3 and 0.8·10 7 ergs/cm3 respectively. Previous studies have reported a loss in magnetization in Mn-Al alloys during mechanical milling. The reason for this loss in magnetization was investigated and found to be due to the formation of the equilibrium beta-Mn phase of the composition Mn3Al2 and not due to oxidation or site disorder. It was also shown that fully dense Mn-Al permanent magnets can be created at hot pressing temperatures at or above 700°C and that the epsilon-phase to tau-phase transition and consolidation can be combined into a single processing step. The addition of small amounts of Cu to the alloy, 3% atomic, can increase the compaction density allowing high densities to be achieved at lower pressing temperatures. While the structure is still under debate, alloys at the composition Zr2Co11 in the Zr-Co system have been shown to have hard magnetic properties. This thesis shows that multiple structures exist at this Zr2Co11 composition and that altering the cooling rate during solidification of the alloy affects the ratio of the phase

  20. Analytical electron microscopy investigation of the AlN-ZrO2 system

    International Nuclear Information System (INIS)

    Stoto, T.; Doukhan, J.C.; Mocellin, A.

    1989-01-01

    A combination of electron microscopy, diffraction, and spectroscopic techniques were used to identify and characterize the quaternary Zr-Al-O-N phase, which forms during reaction sintering of AIN + ZrO 2 mixtures. In this paper it is proposed that this phase has a space group Fd 3 m; several compositions are suggested

  1. Kinetic studies of oxidation of MgAlON and a comparison of the oxidation behaviour of AlON, MgAlON, O'SiAlON-ZrO{sub 2}, and BN-ZCM ceramics

    Energy Technology Data Exchange (ETDEWEB)

    Wang Xidong; Seetharaman, S. [Div. of Metallurgy, Royal Inst. of Tech., Stockholm (Sweden); Li Wenchao [Dept. of Physical Chemistry, Univ. of Science and Technology Beijing (USTB), Beijing, BJ (China)

    2002-06-01

    The kinetics and morphology of the oxidation process of magnesium-aluminium oxynitride (MgAlON), aluminium oxynitride (AlON), O'SiAlON-ZrO{sub 2}, and BN-ZCM have been studied in the temperature range 1373-1773 K (ZCM=30 wt% ZrO{sub 2}, 52 wt% Al{sub 2}O{sub 3} and 18 wt% 3 Al{sub 2}O{sub 3}.2 SiO{sub 2}). Oxidation experiments with powder and plate samples of the above materials have been carried out in air. MgAlON shows the best resistance to oxidation at lower temperatures (< 1473 K), whereas at higher temperatures ({proportional_to} 773 K), AlON shows the best resistance. O'SiAlON-ZrO{sub 2} shows very good oxidation resistance up to 1673 K. But its oxidation rate increases strongly above 1673 K, presumably due to the formation of liquid phase. BN-ZCM has the poorest oxidation resistance due to the evaporation of B{sub 2}O{sub 3}. The activation energies for the chemical oxidation reaction of AlON, MgAlON, and O'SiAlON-ZrO{sub 2} are 214, 330 and 260 kJ/mol, respectively. The overall diffusion activation energies for AlON, MgAlON, O'SiAlON-ZrO{sub 2} and BN-ZCM are 227, 573, 367 and 289 kJ/mol, respectively. (orig.)

  2. Vacancy-type defects in Al2O3/GaN structure probed by monoenergetic positron beams

    Science.gov (United States)

    Uedono, Akira; Nabatame, Toshihide; Egger, Werner; Koschine, Tönjes; Hugenschmidt, Christoph; Dickmann, Marcel; Sumiya, Masatomo; Ishibashi, Shoji

    2018-04-01

    Defects in the Al2O3(25 nm)/GaN structure were probed by using monoenergetic positron beams. Al2O3 films were deposited on GaN by atomic layer deposition at 300 °C. Temperature treatment above 800 °C leads to the introduction of vacancy-type defects in GaN due to outdiffusion of atoms from GaN into Al2O3. The width of the damaged region was determined to be 40-50 nm from the Al2O3/GaN interface, and some of the vacancies were identified to act as electron trapping centers. In the Al2O3 film before and after annealing treatment at 300-900 °C, open spaces with three different sizes were found to coexist. The density of medium-sized open spaces started to decrease above 800 °C, which was associated with the interaction between GaN and Al2O3. Effects of the electron trapping/detrapping processes of interface states on the flat band voltage and the defects in GaN were also discussed.

  3. Ferromagnetic resonance spectroscopy of CoFeZr-Al{sub 2}O{sub 3} granular films containing “FeCo core – oxide shell” nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Kołtunowicz, Tomasz N., E-mail: t.koltunowicz@pollub.pl [Department of Electrical Devices and High Voltage Technology, Lublin University of Technology, Nadbystrzycka 38a, 20-618 Lublin (Poland); Zukowski, Pawel [Department of Electrical Devices and High Voltage Technology, Lublin University of Technology, Nadbystrzycka 38a, 20-618 Lublin (Poland); Sidorenko, Julia [Department of Semiconductors Physics and Nanoelectronics, Belarusian State University, Independence Av. 4, 220030 Minsk (Belarus); Bayev, Vadim; Fedotova, Julia A. [Institute for Nuclear Problems, Belarusian State University, Bobrujskaya Str. 11, 220030 Minsk (Belarus); Opielak, Marek [Institute of Transport, Combustion Engines and Ecology, Lublin University of Technology, Nadbystrzycka 36, 20-618 Lublin (Poland); Marczuk, Andrzej [Department of Transporting and Agricultural Machinery, University of Life Sciences in Lublin, Głeboka 28, 20-612 Lublin (Poland)

    2017-01-01

    Ferromagnetic resonance (FMR) spectroscopy is applied for comparative analysis of granular (CoFeZ){sub x}(Al{sub 2}O{sub 3}){sub 100−x}, (31 at%≤x≤47 at%) films containing pure FeCo-based nanoparticles (NPs) or “FeCo-based core – oxide shell” NPs inside Al{sub 2}O{sub 3} matrix when deposited in oxygen-free or oxygen-containing atmosphere, correspondingly. It is established that g-factor extracted from the FMR spectra of films with core–shell NPs decreases with x below the value g =2.0023 for free electron that is untypical for metallic NPs. This effect is associated with the formation of the interface between ferromagnetic core and antiferromagnetic (ferrimagnetic) oxide shell of NPs. - Highlights: • CoFeZr-Al{sub 2}O{sub 3} granular films containing “FeCo core – oxide shell” nanoparticles. • magnetic anisotropy of (CoFeZr){sub x}(Al{sub 2}O{sub 3}){sub 100−x} films is of an easy plane type. • essential difference in dependence of g-factor on metal content in non- and oxidized film. • non-oxidized samples indicates the reduction of the value of films magnetization.

  4. Electrical and mechanical properties of 0.5Ba (Zr0.2Ti0.8)O3-0.5 (Ba0.7Ca0.3)TiO3 (BZT-BCT) lead free ferroelectric ceramics reinforced with Al2O3 nano-oxide

    International Nuclear Information System (INIS)

    Adhikari, Prativa; Mazumder, R.

    2014-01-01

    Piezoelectric ceramics are widely used as actuator, resonator, and spark igniter. Recently, much attention has been paid to prepare 0.5Ba (Zr 0.2 Ti 0.8 )O 3 -0.5 (Ba 0.7 Ca 0.3 )TiO 3 (BZT-BCT) piezoelectric ceramics because of its good dielectric, piezoelectric properties and environment friendly nature. However, piezoelectric ceramics based on BaTiO 3 suffer from low reliability and poor mechanical properties such as strength and toughness. For practical application improvement of the mechanical properties of BaTiO 3 -based ceramics is strongly required. A novel method has been used to improve the mechanical properties of structural ceramics by reinforcement of oxide (Al 2 O 3 , MgO, ZrO 2 and Stabilized-ZrO 2 ) or non-oxide (SiC) particles. It is well known that electrical properties of ferroelectric ceramics generally degrade with non-ferroelectric additives and decrease in sinterability usually encountered with refractory oxide additives. Use of nano-oxide additives may drastically reduce the amount of additive and electrical property may not degrade much. In this report we would show the electrical and mechanical properties of BZT-BCT with Al 2 O 3 nano oxide additive. Modified BZT-BCT nanocomposites were prepared by mixing and sintering of solid state synthesized Zr, Ca modified barium titanate powder and small amount (0.1-2.0 vol %) of nano-oxides, i.e. Al 2 O 3 . Effect of sintering temperature, time, particle size of the nano-oxide additives on electrical (dielectric constant, loss factor, Curie temperature, d 33 ) and mechanical (flexural strength, fracture toughness, hardness) properties were studied. We obtained ∼ 94% dense BZT-BCT reinforced with Al 2 O 3 nano-oxide at 1300℃ without degrading electrical properties (dielectric constant (4850), low dissipation factor (0.0242)) and superior mechanical properties (flexural strength - 60.3 MPa, Vickers hardness-750-800 MPa). (author)

  5. Hydrogenation/Deoxygenation (H/D Reaction of Furfural-Acetone Condensation Product using Ni/Al2O3-ZrO2 Catalyst

    Directory of Open Access Journals (Sweden)

    Adam Mahfud

    2016-08-01

    Full Text Available The catalytic hydrogenation/deoxygenation (H/D reaction was carried out using Ni/Al2O3-ZrO2 catalyst. The 10% (wt/wt of Ni were impregnated on Al2O3-ZrO2 (10NiAZ by wet impregnation method followed by calcination and reduction. X-Ray diffraction analysis showed that Nideposited on the surface, with specific surface areas (SBET was 48.616 m2/g. Catalyst performance were evaluated for H/D reaction over furfural-acetone condensation products, mixture of 2-(4-furyl-3-buten-2-on and 1,5-bis-(furan-2-yl-pentan-3-one. The reaction was carried out in a batch, performed at 150°C for 8 hours. The H/D reaction gave alkane derivatives C8 and C10 by hydrogenation process followed by ring opening of furan in 15.2% yield. While, oxygenated product C10-C13 were also detected in 17.2% yield. The increasing of pore volume of 10NiAZ might enhance catalyst activity over H/D reaction. The alkene C=C bond was easy to hydrogenated under this condition by the lower bond energy gap.

  6. Interdiffusion between U(Mo,Pt) or U(Mo,Zr) and Al or Al A356 alloy

    International Nuclear Information System (INIS)

    Komar Varela, C.; Mirandou, M.; Arico, S.; Balart, S.; Gribaudo, L.

    2009-01-01

    Solid state reactions in chemical diffusion couples U-7 wt.%Mo-0.9 wt.%Pt/Al at 580 deg. C and U-7 wt.%Mo-0.9 wt.%Pt/Al A356 alloy, U-7 wt.%Mo-1 wt.%Zr/Al and U-7 wt.%Mo-1 wt.%Zr/Al A356 alloy at 550 deg. C were characterized. Results were obtained from optical and scanning electron microscopy, electron probe microanalysis and X-ray diffraction. The UAl 3, UAl 4 and Al 20 Mo 2 U phases were identified in the interaction layers of γU(Mo,Pt)/Al and γU(Mo,Zr)/Al diffusion couples. Al 43 Mo 4 U 6 ternary compound was also identified in γU(Mo,Zr)/Al due to the decomposition of γU(Mo,Zr) phase. The U(Al,Si) 3 and U 3 Si 5 phases were identified in the interaction layers of γU(Mo,Pt)/Al A356 and γU(Mo,Zr)/Al A356 diffusion couples. These phases are formed due to the migration of Si to the interaction layer. In the diffusion couple U(Mo,Zr)/Al A356, Zr 5 Al 3 phase was also identified in the interaction layer. The use of synchrotron radiation at Brazilian Synchrotron Light Laboratory (LNLS, CNPq, Campinas, Brazil) was necessary to achieve a complete crystallographic characterization.

  7. Stability and electronic structure of Zr-based ternary metallic glasses and relevant compounds

    International Nuclear Information System (INIS)

    Hasegawa, M.; Soda, K.; Sato, H.; Suzuki, T.; Taketomi, T.; Takeuchi, T.; Kato, H.; Mizutani, U.

    2007-01-01

    The electronic structure of the Zr-based metallic glasses has been investigated by theoretical and experimental approaches. One approach is band calculations of the Zr 2 Ni (Zr 66.7 Ni 33.3 ) compound to investigate the electronic structure of the Zr 66.7 Ni 33.3 metallic glass (ΔT x = 0 K) of which the local atomic structure is similar to that of the Zr 2 Ni compound. The other is photoemission spectroscopy of the Zr 50 Cu 35 Al 15 bulk metallic glass (BMG) (ΔT x = 69 K). Here ΔT x = T x - T g where T x and T g are crystallization and glass transition temperature, respectively. Both results and previous ones on the Zr 55 Cu 30 Ni 5 Al 10 BMG indicate that there is a pseudogap at the Fermi level in the electronic structure of these Zr-based metallic glasses, independent of the value of the ΔT x . This implies that the pseudogap at the Fermi level is one of the factors that stabilize the glass phase of Zr-based metallic glasses

  8. Espumas vítreas do sistema Li2O-ZrO2-SiO2-Al2O 3 produzidas pelo processo gelcasting Li2O-ZrO2-SiO2 -Al2O3 glass-ceramic foams produced by the gelcasting process

    Directory of Open Access Journals (Sweden)

    E. de Sousa

    2009-06-01

    Full Text Available Espumas vítreas do sistema Li2O-ZrO2-SiO2-Al2O 3 (LZSA foram produzidas pelo processo gelcasting, associado à aeração de suspensões cerâmicas, sem controle atmosférico. Por meio da adição de diferentes concentrações de agente espumante (Fongraminox foi possível obter espumas vítreas com densidade relativa variando entre uma estreita faixa (0,10-0,15. As espumas vítreas apresentaram resistência à compressão de 2,5-3,7 MPa, que correspondem a porosidade entre 85 e 89% e macroestrutra com poros aproximadamente esféricos e interconectados. Tais características tornam esses materiais atraentes para as seguintes aplicações tecnológicas: filtros para metais fundidos e gases quentes e, suportes catalíticos.Vitreous foams in the Li2O-ZrO2-SiO2-Al2O 3 (LZSA system were produced by the gelcasting process with aeration of ceramic suspensions and without atmospheric control. By the addition of different concentrations of foaming agent (Fongraminox it was possible to attain glass-ceramic foams in a narrow range of relative density (0.10-0.15. The glass-ceramic foams showed compressive strength of 2.5-3.7 MPa, which corresponds to porosity between 85-89%, and macrostructure with pores nearly spherical and interconnected, these characteristics make these materials attractive for the following applications technology: filters of molten metals and hot gas, and catalytic support.

  9. Characterization of the interaction layer in diffusion couples U-Mo-Zr/Al and U-Mo-Zr/Al-A356 at 550 C degrees; Caracterizacion de la zona de interaccion en pares de difusion a 550 grados C U-Mo-Zr/Al y U-Mo-Zr/Al-A356

    Energy Technology Data Exchange (ETDEWEB)

    Komar Varela, Carolina; Arico, Sergio; Mirandou, Marcela; Balart, Silvia; Gribaudo, Luis [Comision Nacional de Energia Atomica, General San Martin (Argentina). Dept. de Materiales; com, carolinakomar@gmail

    2007-07-01

    Out-of-pile diffusion experiments were performed between U-7 wt.% Mo-1 wt.% Zr and Al or Al A356 (7,1 wt.% Si) at 550 C degrees. In this work morphological characterization and phase identification on both interaction layers are presented. They were carried out by the use of different techniques: optical and scanning electron microscopy, X-ray diffraction and WDS microanalysis. In the interaction layer U-7 wt.% Mo-1 wt.% Zr/Al, the phases UAl{sub 3}, UAl{sub 4}, Al{sub 20}Mo{sub 2}U and Al{sub 43}Mo{sub 4}U{sub 6} were identified. Similar results in the interaction layer of the U-7 % Mo/Al at 580 C degrees were previously obtained. In the interaction layer U-7 wt.% Mo-1 wt.% Zr/Al A356, the phases U(Al,Si){sub 3} with 25 at.% Si and Si{sub 5}U{sub 3} were identified. This last phase, with a higher Si concentration, was identified with X-ray diffraction synchrotron radiation performed at the National Synchrotron Light Laboratory, Campinas, Brazil. (author) [Spanish] Se realizaron experiencias fuera de reactor en pares de difusion quimica U-7 % Mo-1 % Zr/Al y U-7 % Mo-1 % Zr/Al A356. En este trabajo se presentan los resultados de la caracterizacion morfologica e identificacion de fases presentes en la zona de interaccion que se forma al ser sometidos a un tratamiento isotermico de 1,5 h a 550 grados C. Las tecnicas utilizadas fueron: microscopia optica y electronica de barrido, difraccion de rayos X y microanalisis cuantitativo por sonda electronica. En la zona de interaccion correspondiente al par U-7 % Mo-1 % Zr/Al se identificaron las fases UAl{sub 3}, UAl{sub 4}, Al{sub 20}Mo{sub 2}U y Al{sub 43}Mo{sub 4}U{sub 6}. Estas cuatro fases fueron identificadas en pares U-7 % Mo/Al a 580 grados C en trabajos anteriores. En la zona de interaccion correspondiente al par U-7 % Mo-1 % Zr/Al A356 se identificaron las fases U(Al,Si){sub 3} (con una concentracion de 25 %at.Si) y Si{sub 5}U{sub 3}. Este compuesto rico en Si solo pudo ser identificado mediante la utilizacion de

  10. Partial oxidation of methane to syngas on Rh/Al{sub 2}O{sub 3} and Rh/Ce-ZrO{sub 2} catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Oliveira, Raquel L.; Bitencourt, Isabela G.; Passos, Fabio B., E-mail: fbpassos@vm.uff.br [Universidade Federal Fluminense (UFF), Niteroi, RJ (Brazil). Dept. de Engenharia Quimica e Petroleo

    2013-01-15

    The partial oxidation of methane with {gamma}-Al{sub 2}O{sub 3}-, CeO{sub 2}-, ZrO{sub 2}- and Ce-ZrO{sub 2}-supported rhodium catalysts was investigated. DRIFTS (diffuse reflectance infrared spectroscopy) measurements of adsorbed CO showed the formation of different rhodium species on different supports, which influenced the dispersion of the metal. The effects of the metal dispersion, oxygen storage capacity on the activity of these catalysts for the partial oxidation of methane are discussed. (author)

  11. Surface crystallization in a Li{sub 2}O-ZrO{sub 2}-SiO{sub 2}-Al{sub 2}O{sub 3} glass; Cristalizacao de superficie em vidro do sistema Li{sub 2}O-ZrO{sub 2}-SiO{sub 2}-Al{sub 2}O{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Oliveira, Antonio Pedro Novaes de; Teixeira, Alexandre Henrique Bortolotto; Venturelli, Hugo Henrique, E-mail: bortolotto_teixeira@yahoo.com.br, E-mail: venturellihugo@gmail.com, E-mail: antonio.pedro@ufsc.br [Universidade Federal de Santa Catarina (VITROCER/PGMAT/UFSC), Florianopolis, SC (Brazil). Laboratorio de Materiais Vitroceramicos; Montedo, Oscar Rubem Klegues, E-mail: oscar.rkm@gmail.com [Universidade do Extremo Sul Catarinense (CERTEC/PPGCEM/UNESC), Criciuma, SC (Brazil). Grupo de Pesquisa em Ceramica Tecnica

    2017-04-15

    Growth kinetics of crystallized surface layer in a LZSA glass composition, 11.7Li{sub 2}O·12.6ZrO{sub 2}·68.6SiO{sub 2}·7.1Al{sub 2}O{sub 3} (wt%), was studied. For the production of the LZSA glass, it was used commercial raw materials (Li{sub 2}CO{sub 3}, ZrSiO{sub 4}, SiO{sub 2}, Al{sub 2}O{sub 3}) which were mixed and melted at 1550 °C for 120 min and then poured into a metallic mold. Samples of the obtained glass were cut and subjected to heat treatments at different temperatures (825 - 925 °C) and times (30 - 150 min) for formation and growth of crystalline layer. Cross-sections of the heat-treated samples were ground and polished such that images of the formed crystallized layers could be visualized and measured by microscopy. Results showed that it is possible to obtain LZSA glasses with crystallized layers formed by β-spodumene, zircon and lithium silicate, which present thicknesses between 13 and 665 μ and grow at rates varying from 0.4 to 4.8 μm/min in the studied temperature range. (author)

  12. Zr O/sub 2/ and ZrSiO/sub 4/ addition influence in mechanical resistance and thermical shock of Al/sub 2/TiO/sub 5/

    Energy Technology Data Exchange (ETDEWEB)

    Marinho, P A; Longo, E; Varela, J A; Pandolfelli, V C

    1985-01-01

    The ZrO/sub 2/ and ZrSiO/sub 4/ addition on the Al/sub 2/O/sub 3/TiO/sub 2/ composition showed to be efficient on higher the mechanical and thermal shock resistence of the compound formed. The reactions that formed the phases and the influence of the ones on thermal and mechanical behaviour of the compound Al/sub 2/TiO/sub 5/ were discussed. (L.M.J.).

  13. Atomic bonding and mechanical properties of Al-Mg-Zr-Sc alloy

    Institute of Scientific and Technical Information of China (English)

    高英俊; 班冬梅; 韩永剑; 钟夏平; 刘慧

    2004-01-01

    The valence electron structures of Al-Mg alloy with minor Sc and Zr were calculated according to the empirical electron theory(EET) in solid. The results show that because of the strong interaction of Al atom with Zr and Sc atom in melting during solidification, the Al3 Sc and Al3 (Sc1-xZrx) particles which act as heterogeneous nuclear are firstly crystallized in alloy to make grains refine. In progress of solidification, the Al-Sc, Al-Zr-Sc segregation regions are formed in solid solution matrix of Al-Mg alloy owing to the strong interaction of Al atom with Zr, Scatoms in bulk of alloy, so in the following homogenization treatment, the finer dispersed Al3 Sc and Al3 (Sc1-x Zrx) second-particles which are coherence with the matrix are precipitated in the segregation region. These finer second particles with the strong Al-Zr, Al-Sc covalent bonds can strengthen the covalent bonds in matrix of the alloy, and also enhance the hardness and strength of Al-Mg alloy. Those finer second-particles precipitated in interface of sub-grains can also strengthen the covalence bonds there, and effectively hinder the interface of sub-grains from migrating and restrain the sub-grains from growing, and cause better thermal stability of Al-Mg alloy.

  14. Zr-(Cu,Ag)-Al bulk metallic glasses

    International Nuclear Information System (INIS)

    Jiang, Q.K.; Wang, X.D.; Nie, X.P.; Zhang, G.Q.; Ma, H.; Fecht, H.-J.; Bendnarcik, J.; Franz, H.; Liu, Y.G.; Cao, Q.P.; Jiang, J.Z.

    2008-01-01

    In this paper, we report the formation of a series Zr-(Cu,Ag)-Al bulk metallic glasses (BMGs) with diameters at least 20 mm and demonstrate the formation of about 25 g amorphous metallic ingots in a wide Zr-(Cu,Ag)-Al composition range using a conventional arc-melting machine. The origin of high glass-forming ability (GFA) of the Zr-(Cu,Ag)-Al alloy system has been investigated from the structural, thermodynamic and kinetic points of view. The high GFA of the Zr-(Cu,Ag)-Al system is attributed to denser local atomic packing and the smaller difference in Gibbs free energy between amorphous and crystalline phases. The thermal, mechanical and corrosion properties, as well as elastic constants for the newly developed Zr-(Cu,Ag)-Al BMGs, are also presented. These newly developed Ni-free Zr-(Cu,Ag)-Al BMGs exhibit excellent combined properties: strong GFA, high strength, high compressive plasticity, cheap and non-toxic raw materials and biocompatible property, as compared with other BMGs, leading to their potential industrial applications

  15. EFFECT OF CUP AND BALL TYPES ON MECHANO-CHEMICAL SYNTHES IS OF Al2O3–TiC NANOCOMPOSITE POWDER

    Directory of Open Access Journals (Sweden)

    M. Zakeri

    2012-07-01

    Full Text Available Al2O3–TiC nanocomposite powder was successfully synthesized by ball milling TiO2, Al and graphite powders. Effects of cup and ball type, milling time and annealing were investigated. XRD was used to characterize milled and annealed powders. The morphological and microstructural evolutions were studied by SEM and TEM. Results showed that the formation of this composite begins after 20 h and completes after 35 h of milling with stainless steel cup and balls. In contrast, there is no reaction during milling (up to 80 h with ZrO2 cup and balls. Fe and ZrO2 were the major impurities introduced during milling with stainless steel and ZrO2 cups, respectively. The Fe impurity was removed by leaching in 3HCl·HNO3 solution for 4 days. Mean grain size less than 7 nm was achieved at the end of milling. In spite of grain growth, this composite maintained its nanocrystalline nature after annealing at 1000°C.

  16. Structural evolution during fragile-to-strong transition in CuZr(Al) glass-forming liquids

    DEFF Research Database (Denmark)

    Zhou, C.; Hu, L.N.; Sun, Q.J.

    2015-01-01

    In the present work, we show experimental evidence for the dynamic fragile-to-strong (F-S) transition in a series of CuZr(Al) glass-forming liquids (GFLs). A detailed analysis of the dynamics of 98 glass-forming liquids indicates that the F-S transition occurs around Tf-s ≈ 1.36 Tg. Using...... the hyperquenching-annealing-x-ray scattering approach, we have observed a three-stage evolution pattern of medium-range ordering (MRO) structures during the F-S transition, indicating a dramatic change of the MRO clusters around Tf-s upon cooling. The F-S transition in CuZr(Al) GFLs is attributed to the competition...... among the MRO clusters composed of different locally ordering configurations. A phenomenological scenario has been proposed to explain the structural evolution from the fragile to the strong phase in the CuZr(Al) GFLs....

  17. Investigation of the structure and properties of the titanium alloy of the Ti-Al-Mo-V-Fe-Cu-Zr-Sn system

    International Nuclear Information System (INIS)

    Moiseev, V.N.; Dolzhanskij, Yu.M.; Zakharov, Yu.I.; Znamenskaya, E.V.

    1979-01-01

    The alloys of martensitic type in the Ti-Al-Mo-V-Fe-Cu-Zr-Sn system after heat treatment are investigated. To determine the composition of the titanium alloy methods of mathematical planning of the experiment are applied. Results of mechanical tests of the alloys are presented, as well as coefficients of models for the properties, calculated according to these data. The investigation establishes the composition of a high-strength titanium alloy of a martensitic type, containing 4.5-60 % Al, 2.0-4.0 % Mo, 0.5-1.9 % V, 0.3-1.5 % Fe, 0.3-1.5 % Cu, 1.5-3.0 % Sn, 2.0-4.0 % Zr. The semiproducts, produced by deformation in β-field, after heat treatment have an ultimate strength >=120 kg/mm 2 , satisfactory ductility and reliability. The alloy possesses rather a high heat resistance and can be operated at 400-500 deg C

  18. Structural Origin of the Enhanced Glass-Forming Ability Induced by Microalloying Y in the ZrCuAl Alloy

    Directory of Open Access Journals (Sweden)

    Gu-Qing Guo

    2016-03-01

    Full Text Available In this work, the structural origin of the enhanced glass-forming ability induced by microalloying Y in a ZrCuAl multicomponent system is studied by performing synchrotron radiation experiments combined with simulations. It is revealed that the addition of Y leads to the optimization of local structures, including: (1 more Zr-centered and Y-centered icosahedral-like clusters occur in the microstructure; (2 the atomic packing efficiency inside clusters and the regularity of clusters are both enhanced. These structural optimizations help to stabilize the amorphous structure in the ZrCuAlY system, and lead to a high glass-forming ability (GFA. The present work provides an understanding of GFAs in multicomponent alloys and will shed light on the development of more metallic glasses with high GFAs.

  19. Zr-ZrO sub 2 cermet solar coatings designed by modelling calculations and deposited by dc magnetron sputtering

    CERN Document Server

    Zhang Qi Chu; Lee, K D; Shen, Y G

    2003-01-01

    High solar performance Zr-ZrO sub 2 cermet solar coatings were designed using a numerical computer model and deposited experimentally. The layer thickness and Zr metal volume fraction for the Zr-ZrO sub 2 cermet solar selective coatings on a Zr or Al reflector with a surface ZrO sub 2 or Al sub 2 O sub 3 anti-reflection layer were optimized to achieve maximum photo-thermal conversion efficiency at 80 deg. C under concentration factors of 1-20 using the downhill simplex method in multi-dimensions in the numerical calculation. The dielectric function and the complex refractive index of Zr-ZrO sub 2 cermet materials were calculated using Sheng's approximation. Optimization calculations show that Al sub 2 O sub 3 /Zr-ZrO sub 2 /Al solar coatings with two cermet layers and three cermet layers have nearly identical solar absorptance, emittance and photo-thermal conversion efficiency that are much better than those for films with one cermet layer. The optimized Al sub 2 O sub 3 /Zr-ZrO sub 2 /Al solar coating film w...

  20. Voltage linearity modulation and polarity dependent conduction in metal-insulator-metal capacitors with atomic-layer-deposited Al{sub 2}O{sub 3}/ZrO{sub 2}/SiO{sub 2} nano-stacks

    Energy Technology Data Exchange (ETDEWEB)

    Zhu, Bao; Liu, Wen-Jun; Wei, Lei; Zhang, David Wei; Jiang, Anquan; Ding, Shi-Jin, E-mail: sjding@fudan.edu.cn [State Key Laboratory of ASIC and System, School of Microelectronics, Fudan University, Shanghai 200433 (China)

    2015-07-07

    Excellent voltage linearity of metal-insulator-metal (MIM) capacitors is highly required for next generation radio frequency integration circuits. In this work, employing atomic layer deposition technique, we demonstrated how the voltage linearity of MIM capacitors was modulated by adding different thickness of SiO{sub 2} layer to the nano-stack of Al{sub 2}O{sub 3}/ZrO{sub 2}. It was found that the quadratic voltage coefficient of capacitance (α) can be effectively reduced from 1279 to −75 ppm/V{sup 2} with increasing the thickness of SiO{sub 2} from zero to 4 nm, which is more powerful than increasing the thickness of ZrO{sub 2} in the Al{sub 2}O{sub 3}/ZrO{sub 2} stack. This is attributed to counteraction between the positive α for Al{sub 2}O{sub 3}/ZrO{sub 2} and the negative one for SiO{sub 2} in the MIM capacitors with Al{sub 2}O{sub 3}/ZrO{sub 2}/SiO{sub 2} stacks. Interestingly, voltage-polarity dependent conduction behaviors in the MIM capacitors were observed. For electron bottom-injection, the addition of SiO{sub 2} obviously suppressed the leakage current; however, it abnormally increased the leakage current for electron top-injection. These are ascribed to the co-existence of shallow and deep traps in ZrO{sub 2}, and the former is in favor of the field-assisted tunnelling conduction and the latter contributes to the trap-assisted tunnelling process. The above findings will be beneficial to device design and process optimization for high performance MIM capacitors.

  1. Performance improvement of charge-trap memory by using a stacked Zr_0_._4_6Si_0_._5_4O_2/Al_2O_3 charge-trapping layer

    International Nuclear Information System (INIS)

    Tang, Zhenjie; Hu, Dan; Zhang, Xiwei; Zhao, Yage; Li, Rong

    2016-01-01

    The postdeposition annealing (PDA)-treated charge-trap flash memory capacitor with stacked Zr_0_._4_6Si_0_._5_4O_2/Al_2O_3 charge-trapping layer flanked by a SiO_2 tunneling oxide and an Al_2O_3 blocking oxide was fabricated and investigated. It is observed that the memory capacitor exhibits prominent memory characteristics with large memory windows 12.8 V in a ±10 V gate sweeping voltage range, faster program/erase speed, and good data-retention characteristics even at 125 C compared to a single charge-trapping layer (Zr_0_._4_6Si_0_._5_4O_2, Zr_0_._7_9Si_0_._2_1O_2, and Zr_0_._4_6Al_1_._0_8O_2_._5_4). The quantum wells and introduced interfacial traps of the stacked trapping layer regulate the storage and loss behavior of charges, and jointly contribute to the improved memory characteristics. Hence, the memory capacitor with a stacked trapping layer is a promising candidate in future nonvolatile charge-trap memory device design and application. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  2. Optical and structural characterization of Ge clusters embedded in ZrO2

    OpenAIRE

    Agocs, E; Zolnai, Z.; Rossall, A. K.; Van den Berg, Jakob; Fodor, B.; Lehninger, D.; Khomenkova, L.; Ponomaryov, S.; Gudymenko, O.; Yukhymchuk, V.; Kalas, B.; Heitmann, J.; Petrik, P.

    2017-01-01

    The change of optical and structural properties of Ge nanoclusters in ZrO2 matrix have been investigated by spectroscopic ellipsometry versus annealing temperatures. Radio-frequency top-down magnetron sputtering approach was used to produce the samples of different types, i.e. single-layers of pure Ge, pure ZrO2 and Ge-rich-ZrO2 as well as multi-layers stacked of 40 periods of 5-nm-Ge-rich-ZrO2 layers alternated by 5-nm-ZrO2 ones. Germanium nanoclusters in ZrO2 host were formed by rapid-therm...

  3. Espumas vítreas do sistema Li2O-ZrO2-SiO2-Al2O 3 produzidas pelo processo gelcasting Li2O-ZrO2-SiO2 -Al2O3 glass-ceramic foams produced by the gelcasting process

    OpenAIRE

    E. de Sousa; C. R. Rambo; F. S. Ortega; A. P. N. de Oliveira; V. C. Pandolfelli

    2009-01-01

    Espumas vítreas do sistema Li2O-ZrO2-SiO2-Al2O 3 (LZSA) foram produzidas pelo processo gelcasting, associado à aeração de suspensões cerâmicas, sem controle atmosférico. Por meio da adição de diferentes concentrações de agente espumante (Fongraminox) foi possível obter espumas vítreas com densidade relativa variando entre uma estreita faixa (0,10-0,15). As espumas vítreas apresentaram resistência à compressão de 2,5-3,7 MPa, que correspondem a porosidade entre 85 e 89% e macroestrutra com por...

  4. Zr-Cu-Ni-Al bulk metallic glasses with superhigh glass-forming ability

    International Nuclear Information System (INIS)

    Sun, Y.J.; Qu, D.D.; Huang, Y.J.; Liss, K.-D.; Wei, X.S.; Xing, D.W.; Shen, J.

    2009-01-01

    Zr-Cu-Ni-Al quaternary amorphous alloy compositions with varying glass-forming ability are developed by an efficient method of proportional mixing of binary eutectics. The critical diameter of the glassy sample is improved from 6 mm for Zr 53 Cu 18.7 Ni 12 Al 16.3 to 14 mm for Zr 50.7 Cu 28 Ni 9 Al 12.3 by straightforwardly adjusting the eutectic unit's coefficients. The drastic improvement in GFA is attributed to balancing the chemical affinities of the Zr, Cu, Ni and Al components in the melt prior to solidification which makes the precipitation of competing crystalline phases more difficult. As the glass-forming ability increases, the concentration of Cu in the alloys exhibits a same trend. Based on synchrotron radiation high-energy X-ray diffraction analysis and Miracle's structural model, it is envisioned that the substitution of additional Cu atoms for Zr atoms in the investigated alloys stabilizes the efficient cluster packing structure of the amorphous alloys, leading to the pronounced increase in their glass-forming ability

  5. Nanoparticle dispersion effect of laser-surface melting in ZrB{sub 2p}/6061Al composites

    Energy Technology Data Exchange (ETDEWEB)

    Zeng, Yida; Chao, Yuhjin; Luo, Zhen, E-mail: lz-tju@163.com [Tianjin University, School of Material Science and Engineering (China); Huang, Yongxian [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology (China)

    2017-04-15

    Zirconium diboride (ZrB{sub 2p}, 15 vol%)/6061 aluminum (Al) composites were fabricated via in situ reaction. The existence, morphologies, and dispersion degree of the in situ ZrB{sub 2} particles with size from tens to hundreds of nanometers were studied by X-ray diffractometry, energy-dispersive X-ray spectroscopy, field-emission scanning electron microscopy, and high-resolution transmission electron microscopy. As the particle-settlement effect becomes dominant during the composite fabrication process, ZrB{sub 2} nanoparticles agglomerate to a certain extent in some areas of the as-cast composites. A laser-surface melting (LSM) strategy was applied to disperse agglomerated ZrB{sub 2} nanoparticles in as-cast composites, and the ZrB{sub 2} nanoparticle dispersion is affected visibly by LSM. After LSM, nanoparticles tend to distribute along the grain boundary. Particle clusters were dispersed in an explosive orientation and the particle diffusion distance varied in terms of its radius and melt-viscosity vicinity. High-resolution transmission electron microscopy showed the existence of a subgrain structure near the ZrB{sub 2}–Al interface after LSM. This may increase the yield strength when a dislocation tangle forms.

  6. Effects of homogenization on microstructures and properties of a new type Al-Mg-Mn-Zr-Ti-Er alloy

    International Nuclear Information System (INIS)

    He, L.Z.; Li, X.H.; Liu, X.T.; Wang, X.J.; Zhang, H.T.; Cui, J.Z.

    2010-01-01

    Research highlights: These new type alloys are very potential for increased use in aerospace and automobile industries. However, most of published reports have focused on the effects of Cu, Sc, Zr, Ag, rare metals and Si additions, Portevin-LeChatelier effect, corrosion properties, friction stir welding and superplasticity in 5000-series aluminum alloy, few investigated on Er and stepped homogenization on the precipitation of dispersoids in Al-Mg-Mn alloy. The purpose of this work was to study the effects of Er and homogenization treatment on mechanical properties and microstructural evolution in new type Al-Mg-Mn-Er alloy. - Abstract: Microstructural evolutions and mechanical properties of Al-Mg-Mn-Zr-Ti-Er alloy after homogenization were investigated in detail by optical microscope (OM), scanning electronic microscope (SEM), transmission electronic microscope (TEM), energy dispersive spectrum (EDS) and tensile test. A maximum tensile strength is obtained when the alloy homogenized at 510 deg. C for 16 h. With increasing preheating temperature (200-400 deg. C), the strength of the alloy finial homogenized at 490 deg. C for 16 h increases. When the preheating temperature is ≥300 deg. C, the strengths of the two-step homogenized alloys are higher than those of the single homogenized alloys. The preheating stage plays an important role in the microstructures and properties of the final homogenized alloy. Many fine (Mn,Fe)Al 6 precipitates when the preheating temperature is 400 deg. C. ErAl 3 phase cannot be observed during preheating stage. Plenty of fine (Mn,Fe)Al 6 and ErAl 3 precipitate in finial homogenized alloy when the preheating temperature is ≥300 deg. C. The Al-Mg-Mn-Zr-Ti-Er alloy is effectively strengthened by substructure and dispersoids of (Mn,Fe)Al 6 and ErAl 3 .

  7. Thermoluminescence induced by UV radiation in ZrO2-La2O3 and ZrO2-CeO2 mixed systems

    International Nuclear Information System (INIS)

    Estrada G, R.; Salas C, P.; Mendoza A, D.; Gonzalez, P.R.

    2002-01-01

    Nowadays, the development of catalytic materials by means of pure or mixed oxides mainly as TiO 2 , Al 2 O 3 , ZrO 2 , La 2 O 3 and CeO 2 used as support or active phases, are widely used in oxidation-reduction reactions in the chemical industry and in petroleum refining processes. the cerium and lanthanum oxides in zircon, have been studied recently in processes for reduction of pollutant gases (SO x , NO x , etc.). They result very interesting for resolving the problems of environmental pollution. Moreover, it has been observed that some of these materials are highly sensitive to ultraviolet radiation (UV), characteristic that can be took in advantage for detecting this type of radiation. In this work the preliminary obtained results on the thermoluminescent response (Tl) induced by the UV radiation in ZrO 2 -La 2 O 3 and ZrO 2 -CeO 2 mixed systems obtained by the sol-gel method are presented. The results show that the first system has a high sensitivity to UV radiation with a Tl curve composed by three peaks, two ones of greater intensity located in 70 and 140 Centigrade degrees. Likewise it was observed that for both materials, the peak located at low temperature is fadeout in few minutes after irradiation, while that the second one peak presented very good stability, resulting promising for dosimetric applications in UV radiation fields. (Author)

  8. Phase transitions in complex oxide systems based on Al{sub 2}O{sub 3} and ZrO{sub 2}; Przemiany fazowe w zlozonych ukladach tlenkowych na bazie Al{sub 2}O{sub 3} i ZrO{sub 2} zachodzace w procesach z szybkozmiennym dzialaniem temperatury

    Energy Technology Data Exchange (ETDEWEB)

    Gorski, L [Institute of Atomic Energy, Otwock-Swierk (Poland)

    1999-07-01

    Different compositions of materials based on Al{sub 2}O{sub 3} and ZrO{sub 2} and protective coatings sprayed from them working in the high temperature region are studied. There are especially thermal barrier coatings of increasing resistance to thermal shocks and conditions of corrosion and erosion caused by the hot gases and liquids. Such conditions are encountered in many technical branches among others in jet and Diesel engines. These coatings are deposited by the plasma spraying process and their resistance to thermal shocks is studied on special experimental arrangement in the conditions near to coatings applications. Both above processes are characterized by a short time temperature action with subsequent high cooling rate, which may cause phase transitions other than in the conditions of thermodynamical equilibrium. These transitions are studied by X-ray diffraction analysis methods. The microstructure changes accompanied to phase transitions are determined by light microscopy and scanning electron microscopy methods. The cases of coating degradation caused by thermal shocks have been observed. The highest resistance to thermal fatigue conditions (up to thermal shocks) show coatings based on Al{sub 2}O{sub 3} containing aluminium titanate and coatings based on ZrO{sub 2} stabilised by 7-8% of Y{sub 2}O{sub 3}. (author)

  9. The application of DTA and TG methods to investigate the non-crystalline hydration products of CaAl2O4 and Ca7ZrAl6O18 compounds

    International Nuclear Information System (INIS)

    Szczerba, Jacek; Madej, Dominika; Śnieżek, Edyta; Prorok, Ryszard

    2013-01-01

    Highlights: ► Hydrates, i.e. CAH 10 , C 2 AH 8 , C 3 AH 6 and C 4 AH 19 are formed during hydration of CaAl 2 O 4 and Ca 7 ZrAl 6 O 18 . ► Hydrated CaAl 2 O 4 and Ca 7 ZrAl 6 O 18 compounds were investigated by X-ray diffraction, SEM/EDS and thermal analysis. ► The hydration reaction proceeds as consumes the unreacted core of the CaAl 2 O 4 and Ca 7 ZrAl 6 O 18 grain. - Abstract: The hydration products and thermal decomposition mechanism of hydrated CaAl 2 O 4 and Ca 7 ZrAl 6 O 18 compounds were investigated by X-ray diffraction, SEM/EDS and thermal analysis. The processes of crystal hydrate nucleation and precipitation were preceded by the evolution of the X-ray amorphous phase during the first 24 h of hydration. DTA–TGA–EGA techniques allowed the study of the detailed decomposition and identification of intermediate and stable to be performed. The differential thermal analysis (DTA) curves of hydrated CaAl 2 O 4 and Ca 7 ZrAl 6 O 18 compounds show five similar endothermic peaks due to crystal water desorption. According to the quantitative TGA–EGA analyses performed on hydrated CaAl 2 O 4 and Ca 7 ZrAl 6 O 18 compounds, it was found that C 2 AH 8 , C 3 AH 6 and Al(OH) 3 phases are the main hydration products of CaAl 2 O 4 . Under the same laboratory conditions, the hydration of Ca 7 ZrAl 6 O 18 proceeds with the formation of mainly CAH 10 and AH 3 -gel phases. We provide the original illustrations of the hydrate crystals formation via amorphous phases

  10. Study of spinodal decomposition and formation of nc-Al2O3/ZrO2 nanocomposites by combined ab initio density functional theory and thermodynamic modeling

    International Nuclear Information System (INIS)

    Sheng, S.H.; Zhang, R.F.; Veprek, S.

    2011-01-01

    Using ab initio density functional theory, the equilibrium properties, such as the total energy, the molar volume, the bulk modulus and its first derivative, as well as the formation enthalpy of monoclinic ZrO 2 and hexagonal α-Al 2 O 3 phases, were calculated and compared with the published theoretical and experimental data. Based on the good agreement of these data, we calculated the lattice instabilities of hypothetical binary hexagonal Zr 2 O 3 and monoclinic AlO 2 , and the interaction parameters of ternary Zr 1-x Al x O y solid solutions. The binodal and spinodal diagrams were then constructed to predict the possibility of the formation of oxide-based nanocomposites which may display hardness enhancement above that of the solid solutions. It is shown that exponential dependence of the interaction parameter on temperature yields the most reliable results. The system should undergo spinodal phase segregation within the composition range that is relevant for the formation of hard or superhard nanocomposites with high thermal and oxidation stability, which are important for their applications.

  11. X-ray photoelectron spectroscopy of nano-multilayered Zr-O/Al-O coatings deposited by cathodic vacuum arc plasma

    International Nuclear Information System (INIS)

    Zhitomirsky, V.N.; Kim, S.K.; Burstein, L.; Boxman, R.L.

    2010-01-01

    Nano-multilayered Zr-O/Al-O coatings with alternating Zr-O and Al-O layers having a bi-layer period of 6-7 nm and total coating thickness of 1.0-1.2 μm were deposited using a cathodic vacuum arc plasma process on rotating Si substrates. Plasmas generated from two cathodes, Zr and Al, were deposited simultaneously in a mixture of Ar and O 2 background gases. The Zr-O/Al-O coatings, as well as bulk ZrO 2 and Al 2 O 3 reference samples, were studied using X-ray photoelectron spectroscopy (XPS). The XPS spectra were analyzed on the surface and after sputtering with a 4 kV Ar + ion gun. High resolution angle resolved spectra were obtained at three take-off angles: 15 o , 45 o and 75 o relative to the sample surface. It was shown that preferential sputtering of oxygen took place during XPS of bulk reference ZrO 2 samples, producing ZrO and free Zr along with ZrO 2 in the XPS spectra. In contrast, no preferential sputtering was observed with Al 2 O 3 reference samples. The Zr-O/Al-O coatings contained a large amount of free metals along with their oxides. Free Zr and Al were observed in the coating spectra both before and after sputtering, and thus cannot be due solely to preferential sputtering. Transmission electron microscopy revealed that the Zr-O/Al-O coatings had a nano-multilayered structure with well distinguished alternating layers. However, both of the alternating layers of the coating contained of a mixture of aluminum and zirconium oxides and free Al and Zr metals. The concentration of Zr and Al changed periodically with distance normal to the coating surface: the Zr maximum coincided with the Al minimum and vice versa. However the concentration of Zr in both alternating layers was significantly larger than that of Al. Despite the large free metal concentration, the Knoop hardness, 21.5 GPa, was relatively high, which might be attributed to super-lattice formation or formation of a metal-oxide nanocomposite within the layers.

  12. Optical and structural characterization of Ge clusters embedded in ZrO2

    Science.gov (United States)

    Agocs, E.; Zolnai, Z.; Rossall, A. K.; van den Berg, J. A.; Fodor, B.; Lehninger, D.; Khomenkova, L.; Ponomaryov, S.; Gudymenko, O.; Yukhymchuk, V.; Kalas, B.; Heitmann, J.; Petrik, P.

    2017-11-01

    The change of optical and structural properties of Ge nanoclusters in ZrO2 matrix have been investigated by spectroscopic ellipsometry versus annealing temperatures. Radio-frequency top-down magnetron sputtering approach was used to produce the samples of different types, i.e. single-layers of pure Ge, pure ZrO2 and Ge-rich-ZrO2 as well as multi-layers stacked of 40 periods of 5-nm-Ge-rich-ZrO2 layers alternated by 5-nm-ZrO2 ones. Germanium nanoclusters in ZrO2 host were formed by rapid-thermal annealing at 600-800 °C during 30 s in nitrogen atmosphere. Reference optical properties for pure ZrO2 and pure Ge have been extracted using single-layer samples. As-deposited multi-layer structures can be perfectly modeled using the effective medium theory. However, annealed multi-layers demonstrated a significant diffusion of elements that was confirmed by medium energy ion scattering measurements. This fact prevents fitting of such annealed structure either by homogeneous or by periodic multi-layer models.

  13. Preparation, structural characterization, and enhanced electrical conductivity of pyrochlore-type (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} ceramics

    Energy Technology Data Exchange (ETDEWEB)

    Xia, X.L. [Institute for Advanced Ceramics, School of Materials Science and Engineering, Harbin Institute of Technology, Harbin (China); Institute of Oceanography Instruments, Shandong Academy of Science, Chinese National Engineering Research Center for Marine Monitoring Equipment, Qingdao (China); Liu, Z.G.; Ouyang, J.H. [Institute for Advanced Ceramics, School of Materials Science and Engineering, Harbin Institute of Technology, Harbin (China); Zheng, Y. [Institute of Oceanography Instruments, Shandong Academy of Science, Chinese National Engineering Research Center for Marine Monitoring Equipment, Qingdao (China)

    2012-08-15

    (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} (0 {<=} x {<=} 1.0) samples are prepared by solid state reaction method using Sm{sub 2}O{sub 3}, Eu{sub 2}O{sub 3}, and ZrO{sub 2} as starting materials. The phase composition and microstructure of (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} ceramics are investigated by X-ray diffraction (XRD), scanning electron microscopy, high-resolution transmission electron microscopy (HRTEM) coupled with selected area electron diffraction and Raman spectroscopy. XRD and TEM show that all the samples exhibit a single pyrochlore-type structure. HRTEM observation indicates that the whole grain interior of Sm{sub 2}Zr{sub 2}O{sub 7} ceramic is a perfect crystal free of any dislocation. Raman spectroscopy reveals that the degree of structural disorder of (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} ceramics increases gradually with increasing Eu content. The electrical conductivity of (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} ceramics is investigated by impedance spectroscopy in the air and hydrogen atmospheres, respectively. The electrical conductivity of (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} ceramics increases with increasing Eu content at identical temperature levels. Both the activation energy E{sub g} and the pre-exponential factor {sigma}{sub 0g} for the grain conductivity gradually increase with increasing Eu content. As the ionic conductivity shows no obvious change in both air and hydrogen atmospheres, the conduction of (Sm{sub 1-x}Eu{sub x}){sub 2}Zr{sub 2}O{sub 7} is purely ionic with negligible electronic conduction. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  14. Ferroelectric Polarization-Modulated Interfacial Fine Structures Involving Two-Dimensional Electron Gases in Pb(Zr,Ti)O3/LaAlO3/SrTiO3 Heterostructures.

    Science.gov (United States)

    Wang, Shuangbao; Bai, Yuhang; Xie, Lin; Li, Chen; Key, Julian D; Wu, Di; Wang, Peng; Pan, Xiaoqing

    2018-01-10

    Interfacial fine structures of bare LaAlO 3 /SrTiO 3 (LAO/STO) heterostructures are compared with those of LAO/STO heterostructures capped with upward-polarized Pb(Zr 0.1 ,Ti 0.9 )O 3 (PZT up ) or downward-polarized Pb(Zr 0.5 ,Ti 0.5 )O 3 (PZT down ) overlayers by aberration-corrected scanning transmission electron microscopy experiments. By combining the acquired electron energy-loss spectroscopy mapping, we are able to directly observe electron transfer from Ti 4+ to Ti 3+ and ionic displacements at the interface of bare LAO/STO and PZT down /LAO/STO heterostructure unit cell by unit cell. No evidence of Ti 3+ is observed at the interface of the PZT up /LAO/STO samples. Furthermore, the confinement of the two-dimensional electron gas (2DEG) at the interface is determined by atomic-column spatial resolution. Compared with the bare LAO/STO interface, the 2DEG density at the LAO/STO interface is enhanced or depressed by the PZT down or PZT up overlayer, respectively. Our microscopy studies shed light on the mechanism of ferroelectric modulation of interfacial transport at polar/nonpolar oxide heterointerfaces, which may facilitate applications of these materials as nonvolatile memory.

  15. Amorphous phase formation in the Cu_3_6Zr_5_9A_l_5 and Cu_4_8Zr_4_3A_l_9 ternary alloys studied by molecular dynamics

    International Nuclear Information System (INIS)

    Aliaga, L.C.R.; Schimidt, C.S.; Lima, L.V.; Domingues, G.M.B.; Bastos, I.N.

    2016-01-01

    Amorphous alloys presents better mechanical and physical properties than its crystalline counterparts. However, there is a scarce understanding on structure - properties relationship in this class of materials. This paper presents the results of the molecular dynamics application to obtain an atomistic description of melting, solidification and the glass forming ability in the ternary Cu_3_6Zr_5_9A_l_5 and Cu_4_8Zr_4_3A_l_9 alloys. In the study we used the EAM potential and different cooling rates, β = 0.1, 1 and 100 K/ps to form the amorphous phase in a system consisting of 32,000 atoms by using the free code LAMMPS. The solidus and liquidus temperatures, on a heating rate of the 5 K/ps, were obtained. Also, on the cooling down step, it was observed that the glass transition temperature (T_g) decreases as cooling rate increases. The structural evolution was analyzed through the radial distribution functions and Voronoi polyhedra. Furthermore, it was determined the evolution of viscosity upper T_g, as well as the fragility (m) parameter for each amorphous alloy. The thermal parameters of the simulation obtained are compared with those of the experiments. (author)

  16. Synthesis and hydration behavior of calcium zirconium aluminate (Ca7ZrAl6O18) cement

    International Nuclear Information System (INIS)

    Kang, Eun-Hee; Yoo, Jun-Sang; Kim, Bo-Hye; Choi, Sung-Woo; Hong, Seong-Hyeon

    2014-01-01

    Calcium zirconium aluminate (Ca 7 ZrAl 6 O 18 ) cements were prepared by solid state reaction and polymeric precursor methods, and their phase evolution, morphology, and hydration behavior were investigated. In polymeric precursor method, a nearly single phase Ca 7 ZrAl 6 O 18 was obtained at relatively lower temperature (1200 °C) whereas in solid state reaction, a small amount of CaZrO 3 coexisted with Ca 7 ZrAl 6 O 18 even at higher temperature (1400 °C). Unexpectedly, Ca 7 ZrAl 6 O 18 synthesized by polymeric precursor process was the large-sized and rough-shaped powder. The planetary ball milling was employed to control the particle size and shape. The hydration behavior of Ca 7 ZrAl 6 O 18 was similar to that of Ca 3 Al 2 O 6 (C3A), but the hydration products were Ca 3 Al 2 O 6 ·6H 2 O (C3AH6) and several intermediate products. Thus, Zr (or ZrO 2 ) stabilized the intermediate hydration products of C3A

  17. Influence of aluminium incorporation on the structure of ZrN films deposited at low temperatures

    International Nuclear Information System (INIS)

    Araiza, J J; Sanchez, O

    2009-01-01

    We have studied the influence of Al incorporation in the crystalline structure of ZrN thin films deposited by dc magnetron sputtering at low temperature. The amount of aluminium in the films depends directly on the power applied to the aluminium cathode during the deposition. Energy dispersive x-ray analysis and x-ray diffraction (XRD) were used to obtain the chemical composition and crystalline structure of the films, respectively. When Al atoms are incorporated into the ZrN coatings, the strong ZrN (2 0 0) orientation is modified by a combination of other ones such as ZrN (1 1 1), Zr 3 N 4 (2 1 1) and hexagonal AlN (1 0 0) as detected from the XRD spectra for high aluminium concentrations. Fourier-transform infrared spectroscopy allowed us to identify oxides and nitrides, ZrO, AlO and AlN, incorporated into the deposited films. The effect of a bias voltage applied to the substrate has also been investigated and related to the changes in the microstructure and in the nanohardness values of the ZrAlN films.

  18. Non-stoichiometric mullites from Al2O3-SiO2-ZrO2 amorphous materials by rapid quenching

    International Nuclear Information System (INIS)

    Yoshimura, M.; Hanaue, Y.; Somiya, S.

    1990-01-01

    In order to study the formation of zirconia dispersed mullite ceramics from homogeneous starting materials hot-pressing and heat-treatments have been carried out for rapidly quenched amorphous materials with 0 to 20 wt% ZrO 2 mullite compositions. These amorphous materials crystallized directly to mullite for 0-10 wt% ZrO 2 samples or mullite + t-ZrO 2 for 20 wt% ZrO 2 at about 970 degrees C. An A1 2 O 3 - rich composition (82 wt% A1 2 O 3 ) and also a significant solid solubility of ZrO 2 (>10 wt%) were estimated for these mullites by XRD studies. Amorphous speres of 10 nm which were considered to be SiO 2 - rich phase were produced by a phase separation in mullite grains

  19. Effects of Fabrication Parameters on Interface of Zirconia and Ti-6Al-4V Joints Using Zr55Cu30Al10Ni5 Amorphous Filler

    Science.gov (United States)

    Liu, Yuhua; Hu, Jiandong; Shen, Ping; Guo, Zuoxing; Liu, Huijie

    2013-09-01

    ZrO2 was brazed to Ti-6Al-4V using a Zr55Cu30Al10Ni5 (at.%) amorphous filler in a high vacuum at 1173-1273 K. The influences of brazing temperature, holding time, and cooling rate on the microstructure and shear strength of the joints were investigated. The interfacial microstructures can be characterized as ZrO2/ZrO2- x + TiO/(Zr,Ti)2(Cu,Ni)/(Zr,Ti)2(Cu,Ni,Al)/acicular Widmanstäten structure/Ti-6Al-4V. With the increase in the brazing temperature, both the thickness of the ZrO2- x + TiO layer and the content of the (Zr,Ti)2(Cu,Ni) phase decreased. However, the acicular Widmanstäten structure gradually increased. With the increase in the holding time, the (Zr,Ti)2(Cu,Ni) phase decreased, and the thickness of the (Zr,Ti)2(Cu,Ni) + (Zr,Ti)2(Cu,Ni,Al) layer decreased. In addition, cracks formed adjacent to the ZrO2 side under rapid cooling. The microstructures produced under various fabrication parameters directly influence the shear strength of the joints. When ZrO2 and Ti-6Al-4V couples were brazed at 1173 K for 10 min and then cooled at a rate of 5 K/min, the maximum shear strength of 95 MPa was obtained.

  20. Thermal expansion of phosphates with the NaZr2(PO4)3 structure containing lanthanides and zirconium: R0.33Zr2(PO4)3 (R = Nd, Eu, Er) and Er0.33(1–x) Zr0.25xZr2(PO4)3

    International Nuclear Information System (INIS)

    Volgutov, V. Yu.; Orlova, A. I.

    2015-01-01

    Phosphates R 0.33 Zr 2 (PO 4 ) 3 (R = Nd, Eu, or Er) and Er 0.33(1–x) Zr 0.25 Zr 2 (PO 4 ) 3 (x = 0, 0.25, 0.5, 0.75, 1.0) of the NaZr 2 (PO 4 ) 3 family have been synthesized and investigated by high-temperature X-ray diffraction. The crystallochemical approach is used to obtain compounds with expected small and controllable thermal-expansion parameters. Phosphates with close-to-zero thermal-expansion parameters, including those with low thermal-expansion anisotropy, have been obtained: Nd 0.33 Zr 2 (PO 4 ) 3 with α a =–2.21 × 10 −6 °C −1 , α c = 0.81 × 10 −6 °C −1 , and Δα = 3.02 × 10 −6 °C –1 and Er 0.08 Zr 0.19 Zr 2 (PO 4 ) 3 with α a =–1.86 × 10 −6 °C −1 , α c = 1.73 × 10 −6 °C −1 , and Δα = 3.58 × 10 −6 °C −1

  1. Raman spectroscopy used for structural investigations of anodically formed ZrO2

    International Nuclear Information System (INIS)

    Koneska, Zagorka; Arsova, Irena

    2003-01-01

    The structure of the oxide formed on Zr(99% + Hf) with anodic oxidation at different potentials in 1 mol/dm 3 H 3 PO 4 and 2 mol/dm 3 KOH solutions were investigated using Raman spectroscopy. Normally the anodic oxides of Zr form only crystals. Under certain circumstances, amorphous anodic ZrO 2 can be observed. Amorphous phase is observed for the anodically formed zirconium oxides in H 3 PO 4 . The oxide formed in KOH at potential of 80 V, where sparks appears on the Zr electrode showed crystalline structure. (Original)

  2. Cation mobility in NASICON compounds Li1-xZr2-xNbx(PO4)3 and Li1+xZr2-xScx(PO4)3

    International Nuclear Information System (INIS)

    Stenina, I.A.; Yaroslavtsev, A.B.; Aliev, A.D.; Antipov, E.V.; Velikodnyj, Yu.A.; Rebrov, A.I.

    2002-01-01

    Compounds featuring NASICON structure of the composition Li 1-x Zr 2-x Nb x (PO 4 ) 3 and Li 1+x Zr 2-x Sc x (PO 4 ) 3 were studied by the method of X-ray phase analysis and 7 Li and 31 P NMR. Structure of Li 0.8 Zr 1.8 Nb 0.2 (PO 4 ) 3 was refined on the basis of X-ray powder pattern. It is shown that cationic disordering in LiZr 2 (PO 4 ) 3 is stimulated both by cationic vacancies and interstitial atoms formation. The cationic vacancies are characterized by a higher mobility. The level of intrinsic disordering was estimated and the Frenkel constant for the compound was calculated [ru

  3. Growth kinetics of tetragonal and monoclinic ZrO2 crystallites in 3 mol% yttria partially stabilized ZrO2 (3Y-PSZ) precursor powder

    International Nuclear Information System (INIS)

    Kuo, Chih-Wei; Lee, Kuen-Chan; Yen, Feng-Lin; Shen, Yun-Hwei; Lee, Huey-Er; Wen, Shaw-Bing; Wang, Moo-Chin; Stack, Margaret Mary

    2014-01-01

    Highlights: • The crystalline structures were composed of tetragonal and monoclinic ZrO 2 . • Growth kinetics of t-ZrO 2 in the 3Y-PSZ precursor powder is described as: D te 2 =(4.57±0.55)t 0.12±0.02 exp(-((24.79±0.38)×10 3 )/(RT) ). • Growth kinetics of m-ZrO 2 in the 3Y-PSZ precursor powder is described as: D m 2 =(4.40±1.63)t 0.17±0.08 exp(-((66.47±3.97)×10 3 )/(RT) ). - Abstract: The growth kinetics of tetragonal and monoclinic ZrO 2 crystallites in 3 mol% yttria partially stabilized ZrO 2 (3Y-PSZ) precursor powder has been investigated using X-ray diffraction (XRD), Brunauer–Emmett–Teller (BET) specific surface area analysis, transmission electron microscopy (TEM) and high resolution TEM (HRTEM). After calcination of the 3Y-PSZ precursor powder between 773 and 1073 K for 2 h, the crystalline structures were composed of tetragonal and monoclinic ZrO 2 as the primary and secondary phases, respectively. When the 3Y-PSZ precursor powder was calcined at 773 K for 2 h, the BET specific surface area was 97.13 m 2 /g, which is equivalent to a particle size of 10.30 nm. The crystallite sizes determined via XRD and BET agreed well, indicating that the powder was virtually non-agglomerated. The growth kinetics of tetragonal and monoclinic ZrO 2 crystallite isothermal growth in the 3Y-PSZ precursor powder are described by: D te 2 =(4.57±0.55)t 0.12±0.02 exp(-((24.79±0.38)×10 3 )/(RT) ) and D m 2 =(4.40±1.63)t 0.17±0.08 exp(-((66.47±3.97)×10 3 )/(RT) ), respectively, for 773K≤T≤1073K. D te and D m denote the crystallite size of tetragonal and monoclinic ZrO 2 at time t and temperature T, respectively

  4. Crystal structure investigations of ZrAsxSey (x>y, x+y≤2) by single crystal neutron diffraction at 300 K, 25 K and 2.3 K

    International Nuclear Information System (INIS)

    Niewa, Rainer; Czulucki, Andreas; Schmidt, Marcus; Auffermann, Gudrun; Cichorek, Tomasz; Meven, Martin; Pedersen, Bjoern; Steglich, Frank; Kniep, Ruediger

    2010-01-01

    Large single crystals of ZrAs x Se y (x>y, x+y≤2, PbFCl type of structure, space group P4/nmm) were grown by Chemical Transport. Structural details were studied by single crystal neutron diffraction techniques at various temperatures. One single crystal specimen with chemical composition ZrAs 1.595(3) Se 0.393(1) was studied at ambient temperature (R1=5.10 %, wR2=13.18 %), and a second crystal with composition ZrAs 1.420(3) Se 0.560(1) was investigated at 25 K (R1=2.70%, wR2=5.70 %) and 2.3 K (R1=2.30 %, wR2=4.70 %), respectively. The chemical compositions of the crystals under investigation were determined by wavelength dispersive X-ray spectroscopy. The quantification of trace elements was carried out by Laser Ablation-Inductively Coupled Plasma-Mass Spectrometry. According to the crystal structure refinements the crystallographic 2a site is occupied by As, together with a significant amount of vacancies. One of the 2c sites is fully occupied by As and Se (random distribution). With respect to the fractional coordinates of the atoms, the crystal structure determinations based on the data obtained at 25.0 K and 2.3 K did not show significant deviations from ambient temperature results. The temperature dependence of the displacement parameters indicates a static displacement of As on the 2a sites (located on the (0 0 1) planes) for all temperatures. No indications for any occupation of interstitial sites or the presence of vacancies on the Zr (2a) site were found. - Graphical abstract: Large single crystals of ZrAs x Se y grown by Chemical Transport to study structural details as the As-Se order scheme by single crystal neutron diffraction.

  5. FRACTIONAL RECRYSTALLIZATION KINETICS IN DIRECTLY COLD ROLLED Al-Mg, Al-Mg-Sc AND Al-Mg-Sc-Zr ALLOY

    Directory of Open Access Journals (Sweden)

    M. S. Kaiser

    2014-12-01

    Full Text Available The evaluation of texture as a function of recrystallization has been characterized for directly cold rolled Al-6Mg, Al-6Mg-0.4Sc and Al-6Mg-0.4Sc-0.2Zr alloys. Samples were annealed isothermally at 400 °C for 1 to 240 minutes to allow recrystallization. Recrystallization kinetics of the alloys is analyzed from the micro-hardness variation. Isothermally annealed samples of aluminum alloys were also studied using JMAK type analysis to see if there exists any correlation between the methods. Recrystallization fraction behavior between two methods the scandium added alloys show the higher variation due to precipitation hardening and higher recrystallization behavior. The scandium and zirconium as a combined shows the more variation due to formation of Al3(Sc, Zr precipitate. From the microstructure it is also observed that the base Al-Mg alloy attained almost fully re-crystallized state after annealing at 400 °C for 60 minutes

  6. Preparation, characterization, and thermal stability of B2O3-ZrO2

    Directory of Open Access Journals (Sweden)

    Theresia Debora Simbolon

    2017-04-01

    Full Text Available Synthesis of the borate-based compound with ZrOCl2 to form B2O3-ZrO2 has been conducted. The compound was characterized by FT-IR spectrophotometer, X-ray diffraction, acidity and thermal stability test. The results showed that the FT-IR main vibration spectrum of B2O3-ZrO2 compound has appeared at wave number 401.2 cm-1 for Zr-O bonding vibration, 617.2 cm-1 for B-O-B bonding vibration and 910.4 cm-1 for B-O bonding vibration. The XRD diffraction pattern shows B2O3-ZrO2 compound has an amorphous structure. The FT-IR spectrum after saturated with ammonia and potentiometric titration indicates that the compound of B2O3-ZrO2 has acidic properties with a strong level of acidity. Thermal stability test shows that the B2O3-ZrO2 compounds have high stability on temperature with increasing crystallinity after the compound was heated at 700 °C. Keywords: B2O3-ZrO2, impregnation, thermal stability.

  7. Order-disorder phase transition in ZrV2Dsub(3.6)

    International Nuclear Information System (INIS)

    Didisheim, J.-J.; Yvon, K.; Tissot, P.

    1981-01-01

    The deuterated C15-type Laves phase ZrV 2 Dsub(3.6) undergoes a structural phase transition near room temperature (T of the order of 325 K). In the cubic high-temperature phase the deuterium atoms are disordered over two types of tetrahedral interstices, the centres of which are 1.3 A apart. In the tetragonal low-temperature phase the D atoms are ordered and occupy only the energetically more favourable interstices. The tetragonal structure is isotypic with the low-temperature phase of HfV 2 D 4 . The shortest D-D distance is 2.1 A. (author)

  8. Effect of the Zr elements with thermal properties changes of U-7Mo-xZr/Al dispersion fuel

    International Nuclear Information System (INIS)

    Supardjo; Agoeng Kadarjono; Boybul; Aslina Br Ginting

    2016-01-01

    Thermal properties data of nuclear fuel is required as input data to predict material properties change phenomenon during the fabrication process and irradiated in a nuclear reactor. Study the influence of Zr element in the U-7Mo-xZr/Al (x = 1%, 2% and 3%) fuel dispersion to changes in the thermal properties at various temperatures have been stiffened. Thermal analysis includes determining the melting temperature, enthalpy, and phase changes made using Differential Thermal Analysis (DTA) in the temperature range between 30 °C up to 1400 °C, while the heat capacity of U-7Mo-xZr alloy and U-7Mo-xZr/Al dispersion fuel using Differential Scanning Calorimeter (DSC) at room temperature up to 450 °C. Thermal analyst data DTA shows that Zr levels of all three compositions showed a similar phenomenon. At temperatures between 565.60 °C - 584.98 °C change becomes α + δ to α + γ phase and at 649.22 °C – 650.13 °C happen smelting Al matrix Occur followed by a reaction between Al matrix with U-7Mo-xZr on 670.38 °C - 673.38 °C form U (Al, Mo)x Zr. Furthermore a phase change α + β becomes β + γ Occurs at temperatures 762.08 °C - 776.33 °C and diffusion between the matrix by U-7Mo-xZr/Al on 853.55 °C - 875.20 °C. Every phenomenon that Occurs, enthalpy posed a relative stable. Consolidation of uranium Occur in 1052.42 °C - 1104.99 °C and decomposition reaction of U (Al, Mo)x and U (Al, Zr)_x becomes (UAl_4, UAl_3, UAl_2), U-Mo, and UZr on 1328,34 °C - 1332,06 °C , The existence of Zr in U-Mo alloy increases the heat capacity of the U-7Mo-xZr/Al, dispersion fuel and the higher heat capacity of Zr levels increased due to interactions between the atoms of Zr with Al matrix so that the heat absorbed by the fuel increase. (author)

  9. Superconducting properties of Zr1+xNi2-xGa and Zr1-xNi2+xGa Heusler compounds

    Directory of Open Access Journals (Sweden)

    Saad Alzahrani

    2017-05-01

    Full Text Available The superconducting properties of a series of Zr1+xNi2-xGa and Zr1-xNi2+xGa compounds have been investigated by x-ray diffraction, electrical resistivity, dc magnetization, and ac susceptibility measurements. While the parent compound, ZrNi2Ga, exhibited the cubic L21 Heusler structure, multiple non-cubic structures formed in the Zr and Ni rich doped materials. For x ≤ 0.3, all Zr1-xNi2+xGa compounds demonstrated superconducting behavior, but no superconductivity was observed in the Zr1+xNi2-xGa alloys for x > 0.2. The magnetization data revealed that all materials in both Zr1+xNi2-xGa and Zr1-xNi2+xGa series exhibited type-II superconductivity. With increasing doping concentration x, the paramagnetic ordering were enhanced in both systems while the superconducting properties were found to weaken. The observations are discussed considering the structural disorders in the systems.

  10. The corrosion Characteristics and Behaviors of the Ti-2.19Al-2.35Zr alloy

    International Nuclear Information System (INIS)

    Kim, Tae Hoon; Kang, Chang Sun; Baek, Jong Hyuk; Kim, Hyun Gil; Choi, Byoung Kwon; Jeong, Yong Hwan

    2007-01-01

    Ti-2.19Al-2.35Zr alloy is being considered as a steam generator tube material for the advanced pressurized water reactor (PWR) which is being developed by KAERI for the purpose of seawater desalination as well as a small scale electricity production. The main operational environment of SMART differs somewhat from that of a commercial PWR. That is, a heat-exchange tube is always exposed to a high temperature/pressure condition and an ammonia water chemistry is designed as a pH controlling agent without an addition of boric acid. The excellent mechanical and corrosion resistance properties are required for the steam generator tube material in SMART. Thus Ti-2.19Al-2.35Zr alloy was studied to investigate of the corrosion characteristics and behaviors of the Ti- 2.19Al-2.35Zr alloy in a simulated-SMART loop

  11. Densification and mechanical properties of ZrO2-CaAl4O7 composites obtained by reaction sintering

    International Nuclear Information System (INIS)

    Bruni, Yesica; Aglietti, Esteban

    2016-01-01

    Composites of the ZrO 2 -CaO-Al 2 O 3 system exhibit high corrosion resistance and high chemical stability, these being suitable properties for enhanced performance as refractories. In this work composites based on ZrO 2 -CaAl 4 O 7 (CA 2 ) were developed by reaction sintering of two pure ZrO 2 powders with different particle size (d 50 = 0.44 μm and d 50 = 8 μm) mixed with high-alumina cement. The effects of CaO to ZrO 2 molar ratio, particle size of ZrO 2 and sintering temperature on densification, c-ZrO 2 formation, microstructure and mechanical properties (Vickers hardness, dynamic Young's modulus and compressive strength) were determined. Porosity and mean pore size of composites reduced with decreasing both particle size of ZrO 2 and CaO content. The highest compression strength of ∝350 MPa and hardness of 6 GPa corresponded to dense ZrO 2 -based composite with 15 vol.% CA 2 sintered at 1400 C.

  12. Superstructure formation in PrNi_2Al_3 and ErPd_2Al_3

    International Nuclear Information System (INIS)

    Eustermann, Fabian; Hoffmann, Rolf-Dieter; Janka, Oliver; Oldenburg Univ.

    2017-01-01

    The intermetallic phase ErPd_2Al_3 was obtained by arc-melting of the elements and subsequent annealing for crystal growth. The sample was studied by X-ray diffraction on powders and single crystals. The structure of ErPd_2Al_3 was refined from X-ray diffraction data and revealed a superstructure of PrNi_2Al_3 - a CaCu_5 derivative (P6/m, a=1414.3(1), c=418.87(3) pm wR=0.0820, 1060 F"2 values, 48 variables). The same superstructure was subsequently found for PrNi_2Al_3 (P6/m, a=1407.87(4), c=406.19(2) pm, wR=0.0499, 904 F"2 values, 47 variables). In the crystal structure, the aluminium and transition metal atoms form a polyanionic network according to [T_2Al_3]"δ"-, while rare earth atoms fill cavities within the networks. They are coordinated by six transition metal and twelve aluminum atoms. In contrast to the PrNi_2Al_3 type structure reported so far, two crystallographic independent rare-earth sites are found of which one (1b) is shifted by 1/2 z, causing a distortion in the structure along with a recoloring of the T and Al atoms in the network.

  13. Cesium and its analogs, rubidium and potassium, in rhombohedral [NaZr2(PO4)3 type] and cubic (langbeinite type) phosphates: 2. Properties: behavior on heating, in aqueous solutions, and in salt melts

    International Nuclear Information System (INIS)

    Orlova, A.I.; Orlova, V.A.; Buchirin, A.V.; Korchenkin, K.K.; Beskrovnyj, A.I.; ); Demarin, V.T.

    2005-01-01

    The properties (behavior on heating, in aqueous solutions, and in salt melts) of orthophosphates A 2 RM(PO 4 ) 3 , A 2 B 0.5 Zr 1.5 (PO 4 ) 3 , and ABR 2 (PO 4 ) 3 [A = K, Rb, Cs; B = Mg, Sr, Ba; R = Ga, Fe, Cr, Ln (Ce-Lu)] crystallizing in the structure of langbeinite mineral (cubic system, space group P2 1 3, Z = 4) were studied and compared with those of NaZr 2 (PO 4 ) 3 type phosphates. The thermal transformations of the structure and the influence of temperature on the distortion of the framework-forming polyhedra were examined. The volatilization of cesium, in particular, from the solid phase in the course of its formation, was evaluated. The rates of cesium and barium leaching at 90 and 95 deg C were determined [ru

  14. Energy-loss straggling study of proton and alpha-particle beams incident onto ZrO{sub 2} and Al{sub 2}O{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Behar, M.; Fadanelli, R.C. [Instituto de Fisica, Universidade Federal do Rio Grande do Sul, Porto Alegre, 91501-970 (Brazil); Abril, I. [Departamento de Fisica Aplicada, Universitat d' Alacant, 03080 Alacant (Spain); Garcia-Molina, R. [Departamento de Fisica, Centro de Investigacion en Optica y Nanofisica, Universidad de Murcia, 30100 Murcia (Spain); Nagamine, L.C.C. [Instituto de Fisica, Universidade de Sao Paulo, C.P.66318, 05315-970 Sao Paulo (Brazil)

    2011-10-15

    The energy-loss straggling of zirconia (ZrO{sub 2}) and alumina (Al{sub 2}O{sub 3}) has been experimentally determined for proton and alpha-particle beams mainly by means of the Rutherford backscattering technique and in some few cases using the transmission method. The incident energies of the projectiles covers a wide range, from 200 keV up to 2000 keV for H{sup +} and from 200 keV up to 4000 keV for He{sup +} in zirconia films. In the case of alumina films the studied energy range was 100 keV - 3000 keV for H{sup +} and 100 keV - 6000 keV for He{sup +}. Our experimental results compare very well with theoretical calculations based on the dielectric formalism and a suitable description of the electronic excitation spectrum of ZrO{sub 2} and Al{sub 2}O{sub 3} films through their energy-loss function. (authors)

  15. Phase transformations, heat evolution, and atomic diffusion during slow heating of Al-rich Al/Zr multilayered foils

    Energy Technology Data Exchange (ETDEWEB)

    Fisher, Kaitlynn; Barron, S. C.; Knepper, R.; Weihs, T. P., E-mail: weihs@jhu.edu [Department of Materials Science and Engineering, Johns Hopkins University, Baltimore, Maryland 21218-2689 (United States); Bonds, M. A.; Browning, N. D. [Department of Chemical Engineering and Materials Science, University of California, Davis, California 95616 (United States); Condensed Matter and Materials Division, Lawrence Livermore National Laboratory, Livermore, California 94550 (United States); Livi, K. J. T. [High-Resolution Analytical Electron Microbeam Facility, Integrated Imaging Center, Johns Hopkins University, Baltimore, Maryland 21218 (United States); Campbell, G. H. [Condensed Matter and Materials Division, Lawrence Livermore National Laboratory, Livermore, California 94550 (United States)

    2013-12-28

    We describe the energy and sequence of phase transformations in multilayered Al/Zr foils with atomic ratios of 3 Al:1 Zr during low temperature (<350 °C) heat treatments in a differential scanning calorimeter. The initial phase formed is an Al-rich amorphous phase that appears to grow by Zr diffusion through the amorphous phase. The subsequent nucleation and growth of tetragonal Al{sub 3}Zr along the Al/amorphous layer interface is mediated by Al diffusion through the crystalline intermetallic phase. Diffusion coefficients associated with these processes are higher than expected from reports of diffusivities measured at higher temperatures. The inferred heat of formation of the tetragonal Al{sub 3}Zr phase is 1240 ± 40 J/g (53 ± 2 kJ/mol atom). No anomalous variation in the energy or sequence of phase transformations is found with bilayer thickness for samples with bilayer thickness in the range of 17 nm to 90 nm despite anomalies in the bilayer dependence of self-propagating reaction velocities in the same foils.

  16. Characterization of physical properties of Al2O3 and ZrO2 nanofluids for heat transfer applications

    International Nuclear Information System (INIS)

    Rocha, Marcelo S.; Cabral, Eduardo L.L.; Sabundjian, Gaiane; Yoriyaz, Helio; Lima, Ana Cecilia S.; Belchior Junior, Antonio; Prado, Adelk C.; Filho, Tufic M.; Andrade, Delvonei A.; Shorto, Julian M.B.; Mesquita, Roberto N.; Otubo, Larissa; Baptista Filho, Benedito D.; Pinho, Priscila G.M.; Ribatsky, Gherhardt; Moraes, Anderson Antonio Ubices

    2015-01-01

    Studies demonstrate that nanofluids based on metal oxide nanoparticles have physical properties that characterize them as promising fluids, mainly, in industrial systems in which high heat flux takes place. Water based nanofluids of Al 2 O 3 and ZrO 2 were characterized regarding its promising use in heat transfer applications. Three different concentrations of dispersed solutions of cited nanofluids were prepared (0.01% vol., 0.05% vol., and 0.1% vol.) from commercial nanofluids. Experimental measurements were carried out at different temperatures. Thermal conductivity, viscosity and density of the prepared nanofluids were measured. (author)

  17. Influence of aluminium incorporation on the structure of ZrN films deposited at low temperatures

    Energy Technology Data Exchange (ETDEWEB)

    Araiza, J J [Unidad Academica de Fisica, Universidad Autonoma de Zacatecas, Paseo a la Bufa esq, Calzada Solidaridad s/n 98060, Zacatecas (Mexico); Sanchez, O [Departamento de Fisica e Ingenieria de Superficies, Instituto de Ciencia de Materiales de Madrid-CSIC, C/ Sor Juana Ines de la Cruz 3, 28049 Cantoblanco, Madrid (Spain)], E-mail: olgas@icmm.csic.es

    2009-06-07

    We have studied the influence of Al incorporation in the crystalline structure of ZrN thin films deposited by dc magnetron sputtering at low temperature. The amount of aluminium in the films depends directly on the power applied to the aluminium cathode during the deposition. Energy dispersive x-ray analysis and x-ray diffraction (XRD) were used to obtain the chemical composition and crystalline structure of the films, respectively. When Al atoms are incorporated into the ZrN coatings, the strong ZrN (2 0 0) orientation is modified by a combination of other ones such as ZrN (1 1 1), Zr{sub 3}N{sub 4} (2 1 1) and hexagonal AlN (1 0 0) as detected from the XRD spectra for high aluminium concentrations. Fourier-transform infrared spectroscopy allowed us to identify oxides and nitrides, ZrO, AlO and AlN, incorporated into the deposited films. The effect of a bias voltage applied to the substrate has also been investigated and related to the changes in the microstructure and in the nanohardness values of the ZrAlN films.

  18. Development of powder metallurgy 2XXX series Al alloys for high temperature aircraft structural applications

    Science.gov (United States)

    Chellman, D. J.

    1984-01-01

    The objective of the present investigation was to improve the strength and fracture toughness combination of P/M 2124 Al alloys in accordance with NASA program goals for damage tolerance and fatigue resistance. Two (2) P/M compositions based on Al-3.70 Cu-1.85 Mg-0.20 Mn with 0.12 and 0.60 wt. pct. Zr were selected for investigation. The rapid solidification rates produced by atomization were observed to prohibit the precipitation of coarse, primary Al3Zr in both alloys. A major portion of the Zr precipitated as finely distributed, coherent Al3Zr phases during vacuum preheating and solution heat treatment. The proper balance between Cu and Mg contents eliminated undissolved, soluble constituents such as Al2CuMg and Al2Cu during atomization. The resultant extruded microstructures produced a unique combination of strength and fracture toughness. An increase in the volume fraction of coherent Al3Zr, unlike incoherent Al20Cu2Mn3 dispersoids, strengthened the P/M Al base alloy either directly by dislocation-precipitate interactions, indirectly by a retardation of recrystallization, or a combination of both mechanisms. Furthermore, coherent Al3Zr does not appear to degrade toughness to the extent that incoherent Al20Cu2Mn3 does. Consequently, the addition of 0.60 wt. pct. Zr to the base alloy, incorporated with a 774K (935 F) solution heat treatment temperature, produces an alloy which exceeds all tensile property and fracture toughness goals for damage tolerant and fatigue resistant applications in the naturally aged condition.

  19. Characterization of the interaction layer in diffusion couples U-Mo-Zr/Al and U-Mo-Zr/Al-A356 at 550 C degrees

    International Nuclear Information System (INIS)

    Komar Varela, Carolina; Arico, Sergio; Mirandou, Marcela; Balart, Silvia; Gribaudo, Luis

    2007-01-01

    Out-of-pile diffusion experiments were performed between U-7 wt.% Mo-1 wt.% Zr and Al or Al A356 (7,1 wt.% Si) at 550 C degrees. In this work morphological characterization and phase identification on both interaction layers are presented. They were carried out by the use of different techniques: optical and scanning electron microscopy, X-ray diffraction and WDS microanalysis. In the interaction layer U-7 wt.% Mo-1 wt.% Zr/Al, the phases UAl 3 , UAl 4 , Al 20 Mo 2 U and Al 43 Mo 4 U 6 were identified. Similar results in the interaction layer of the U-7 % Mo/Al at 580 C degrees were previously obtained. In the interaction layer U-7 wt.% Mo-1 wt.% Zr/Al A356, the phases U(Al,Si) 3 with 25 at.% Si and Si 5 U 3 were identified. This last phase, with a higher Si concentration, was identified with X-ray diffraction synchrotron radiation performed at the National Synchrotron Light Laboratory, Campinas, Brazil. (author) [es

  20. Influence of Thickness of Multilayered Nano-Structured Coatings Ti-TiN-(TiCrAlN and Zr-ZrN-(ZrCrNbAlN on Tool Life of Metal Cutting Tools at Various Cutting Speeds

    Directory of Open Access Journals (Sweden)

    Alexey Vereschaka

    2018-01-01

    Full Text Available This paper considers the influence of thickness of multilayered nano-structured coatings Ti-TiN-(TiCrAlN and Zr-ZrN-(ZrCrNbAlN on tool life of metal cutting tools at various cutting speeds (vc = 250, 300, 350 and 400 m·min−1. The paper investigates the basic mechanical parameters of coatings and the mechanism of coating failure in scratch testing depending on thickness of coating. Cutting tests were conducted in longitudinal turning of steel C45 with tools with the coatings under study of various thicknesses (3, 5, and 7 µm, with an uncoated tool and with a tool with a “reference” coating of TiAlN. The relationship of “cutting speed vc—tool life T” was built and investigated; and the mechanisms were found to determine the selection of the optimum coating thickness at various cutting speeds. Advantages of cutting tools with these coatings are especially obvious at high cutting speeds (in particular, vc = 400 m·min−1. If at lower cutting speeds, the longest tool life is shown by tools with thicker coatings (of about 7 μm, then with an increase in cutting speed (especially at vc = 400 m·min−1 the longest tool life is shown by tools with thinner coating (of about 3 μm.

  1. Valence electron structure and properties of stabilized ZrO2

    Institute of Scientific and Technical Information of China (English)

    LI JinPing; HAN JieOai; MENG SongHe; ZHANG XingHong

    2008-01-01

    To reveal the properties of stabilizers in ZrO2 on nanoscopic levels,the valence elec-tron structures of four stable ZrO2 phases and c-ZrO2 were analyzed on the basis of the empirical electron theory of solids and molecules.The results showed that the hybridization levels of Zr atoms in c-ZrO2 doped with Ca and Mg dropped from B17 to B13,the hybridization levels of Zr atoms in c-ZrO2 doped with Y and Ce dropped from B17 to B15,and that the four stabilizing atoms all made the hybridization levels of O atoms drop from level 4 to level 2.The numbers of covalent electrons in the strongest covalent bond in the descending order are c-ZrO2>ZrCeO2>ZrYOZrMgO>ZrCaO.The bond energies of the strongest covalent bond and the melting points of the solid solutions in the descending order are ZrCeO2>c-ZrO2>ZrYO>ZrMgO>ZrCaO.The percent-ages of the total number of covalent electrons in the descending order arec-ZrO2>ZrYO> ZrCeO2>ZrMgO> ZrCaO.From the above analysis,it can be concluded that the stabilizing degrees of the four stabilizers in the descending order are CaO> MgO>Y2O3>CeO2.

  2. Design of Rh/Ce0.2Zr0.8O2-Al2O3 nanocomposite for ethanol steam reforming

    International Nuclear Information System (INIS)

    De Rogatis, Loredana; Montini, Tiziano; Casula, Maria F.; Fornasiero, Paolo

    2008-01-01

    Rh(1 wt.%)/Ce 0.2 Zr 0.8 O 2 (10 wt.%)-Al 2 O 3 nanocomposite has been investigated as active and thermally stable catalyst for ethanol steam reforming. Rh nanoparticles were synthesised by surfactant assisted route, using N-hexadecyl-N-(2-hydroxyethyl)-N,N-dimethyl ammonium bromide (HEAC16Br). Metal particles with average diameter of 2.1 nm were obtained at 0.53 Rh/HEAC16Br molar ratio, while increasing the amount of surfactant lead to formation of larger particles. The preformed Rh nanoparticles have been effectively embedded into a porous layer of nanocomposite oxides. Low temperature H 2 chemisorption experiments and activity data confirm that most of the Rh atoms are accessible to the reaction mixture. The Ce 0.2 Zr 0.8 O 2 mixed oxide inhibits the dehydration of ethanol to ethylene and favours the water gas shift reaction. The alumina ensures good thermal stability and high surface area of the catalyst. No significant deactivation is observed after repeated run-up and run-down experiments

  3. Synthesis of ZrO2-8%CeO2 and ZrO2-8%Y2O3 by polymeric precursors route

    International Nuclear Information System (INIS)

    Macedo, D.A.; Macedo, M.C.; Melo, D.M.A.; Nascimento, R.M.; Rabelo, A.A.

    2006-01-01

    The stabilization of zirconia in the cubical and tetragonal structures comes gaining importance because of its excellent thermal stability, chemical resistance, mechanical properties and oxygen conductivity. Its main applications include electrolytes of high temperature fuel cells, sensors of oxygen and electrochemical reactors. In this work the polymeric precursors route was used to synthesize ZrO 2 -8 mol% Y 2 O 3 and ZrO 2 -8 mol%CeO 2 . In this process the dopant concentration, besides making possible the stabilization of distinct structures, influences in the morphologic characteristics of the powders synthesized. The characterization of the powders was carried through X-ray diffraction for existing phases verification and average crystallite size, thermogravimetric analysis, specific surface area measures, particles size distribution by laser scattering and the powder morphology was observed using scanning electronic microscopy. The powder only calcined at 700 deg C had presented of average crystallite size of 6,77 nm for ZrO 2 -8%Y 2 O 3 and 7,14 nm for ZrO 2 -CeO 2 . (author)

  4. Crystal Structure, Spectroscopic Investigations, and Physical Properties of the Ternary Intermetallic REPt2Al3 (RE = Y, Dy–Tm and RE2Pt3Al4 Representatives (RE = Tm, Lu

    Directory of Open Access Journals (Sweden)

    Fabian Eustermann

    2018-04-01

    Full Text Available The REPt2Al3 compounds of the late rare-earth metals (RE = Y, Dy–Tm were found to crystallize isostructural. Single-crystal X-ray investigations of YPt2Al3 revealed an orthorhombic unit cell (a = 1080.73(6, b = 1871.96(9, c = 413.04(2 pm, wR2 = 0.0780, 942 F2 values, 46 variables with space group Cmmm (oC48; q2pji2hedb. A comparison with the Pearson database indicated that YPt2Al3 forms a new structure type, in which the Pt and Al atoms form a [Pt2Al3]δ− polyanion and the Y atoms reside in the cavities within the framework. Via a group-subgroup scheme, the relationship between the PrNi2Al3-type structure and the new YPt2Al3-type structure was illustrated. The compounds with RE = Dy–Tm were characterized by powder X-ray diffraction experiments. While YPt2Al3 is a Pauli-paramagnet, the other REPt2Al3 (RE = Dy–Tm compounds exhibit paramagnetic behavior, which is in line with the rare-earth atoms being in the trivalent oxidation state. DyPt2Al3 and TmPt2Al3 exhibit ferromagnetic ordering at TC = 10.8(1 and 4.7(1 K and HoPt2Al3 antiferromagnetic ordering at TN = 5.5(1 K, respectively. Attempts to synthesize the isostructural lutetium compound resulted in the formation of Lu2Pt3Al4 (Ce2Ir3Sb4-type, Pnma, a = 1343.4(2, b = 416.41(8, c = 1141.1(2 pm, which could also be realized with thulium. The structure was refined from single-crystal data (wR2 = 0.0940, 1605 F2 values, 56 variables. Again, a polyanion with bonding Pt–Al interactions was found, and the two distinct Lu atoms were residing in the cavities of the [Pt3Al4]δ– framework. X-ray photoelectron spectroscopy (XPS measurements were conducted to examine the electron transfer from the rare-earth atoms onto the polyanionic framework.

  5. The Structural Evolution of (Gd, Y)Ba2Cu3Ox Tapes With Zr Addition Made by Metal Organic Chemical Vapor Deposition

    Energy Technology Data Exchange (ETDEWEB)

    Lei, CH; Galstyan, E; Chen, YM; Shi, T; Liu, YH; Khatri, N; Liu, JF; Xiong, XM; Majkic, G; Selvamanickam, V

    2013-06-01

    Structural analysis of (Gd, Y) Ba2Cu3Ox tapes with Zr addition made by metal organic chemical vapor deposition has been conducted with transmission electron microscopy and X-ray diffraction. Zr content in the films was varied from 0 to 25% in the precursor. In all Zr-doped films, self-assembled nanocolumnar structures of BaZrO3 (BZO) were observed along the c-axis. The amount of BaZrO3 was found to increase steadily with Zr content. Additionally, planar BZO plates were found on the (001) plane of (Gd, Y) Ba2Cu3Ox film. The size and thickness of BZO plates were seen to increase with Zr doping level. Rare-earth copper oxide phases were observed to begin to emerge in the 20% Zr-doped film. Cross-sectional study of the interface between (Gd, Y)Ba2Cu3Ox and LaMnO3 cap layer revealed a thin discrete BZO layer on the LaMnO3 in the 20% Zr doped film.

  6. Evaluating the toughness of APS and HVOF-sprayed Al2O3-ZrO2-coatings by in-situ- and macroscopic bending

    Czech Academy of Sciences Publication Activity Database

    Kiilakoski, J.; Mušálek, Radek; Lukáč, František; Koivuluoto, H.; Vuoristo, P.

    2018-01-01

    Roč. 38, č. 4 (2018), s. 1908-1918 ISSN 0955-2219 R&D Projects: GA ČR GB14-36566G Institutional support: RVO:61389021 Keywords : Thermal spray * Al2O3-ZrO2 * Toughening * Fracture * Mechanical testing Subject RIV: JK - Corrosion ; Surface Treatment of Materials OBOR OECD: Coating and films Impact factor: 3.411, year: 2016 https://www.sciencedirect.com/science/article/pii/S0955221917308051

  7. Effect of {gamma}` and {gamma} (Ag{sub 2}Al) precipitates on the steady state creep of Al-16wt%Ag alloys with and without Zr addition

    Energy Technology Data Exchange (ETDEWEB)

    Deaf, G.H. [Ain Shams Univ., Cairo (Egypt). Dept. of Physics; Youssef, S.B. [Ain Shams Univ., Cairo (Egypt). Dept. of Physics; Mahmoud, M.A. [Ain Shams Univ., Cairo (Egypt). Dept. of Physics

    1996-11-16

    The steady state creep behaviour of Al-16 wt% Ag and Al-16 wt% Ag-0.1 wt% Zr alloys has been studied at constant load (= 137.2 MPa) and tested at different working temperatures for samples aged at temperatures favouring the formation of {gamma}` and {gamma} precipitates. It was found that addition of Zr to Al-16 wt% Ag alloy accelerates the precipitations {gamma}` and {gamma} due to the formation of the metastable phase Al{sub 3}Zr. For both alloys, two values of activation energy have been obtained as (34 {+-} 0.3) kJ/mol for viscous glide of dislocations due to the existence of {gamma}` precipitates and (68 {+-} 0.3) kJ/mol for grain boundary diffusion due to the existence of {gamma} precipitates. TEM investigations of {gamma}` and {gamma} precipitates confirmed the above-mentioned effect of Zr addition. (orig.)

  8. Effect of Zr on microstructures and mechanical properties of an Al-Mg-Si-Cu-Cr alloy prepared by low frequency electromagnetic casting

    Energy Technology Data Exchange (ETDEWEB)

    Meng, Yi, E-mail: yimonmy@sina.com; Cui, Jianzhong; Zhao, Zhihao; He, Lizi

    2014-06-01

    The Al-1.6Mg-1.2Si-1.1Cu-0.15Cr (all in wt. %) alloys with and without Zr addition prepared by low frequency electromagnetic casting process were investigated by using the optical microscope, scanning electron microscope and transmission electron microscope equipped with energy dispersive analytical X-ray. The effects of Al{sub 3}Zr phases on the microstructures and mechanical properties during solidification, homogenization, hot extrusion and solid solution were studied. The results show that Al{sub 3}Zr phases reduce the grain size by ∼ 29% and promote the formation of an equiaxed grain structure during solidification. Numerous spherical Al{sub 3}Zr dispersoids with 35–60 nm in diameters precipitate during homogenization, and these fine dispersoids change little during subsequent hot extrusion and solid solution. Adding 0.15 wt. % Zr results in no recrystallization after hot extrusion and partial recrystallization after solid solution, while the recrystallized grain size is 400–550 μm in extrusion direction in the Zr-free alloy. In addition, adding 0.15 wt. % Zr can obviously promote Q′ phase precipitation, while the β″ phases are predominant in the alloy without Zr. Adding 0.15 wt. % Zr, the ultimate tensile strength of the T6 treated alloy increases by 45 MPa, while the elongation remains about 16.7%. - Highlights: • Minor Zr can refine as-cast grains of the LFEC Al-Mg-Si-Cu-Cr alloy. • L1{sub 2} Al{sub 3}Zr phases with 35–60 nm in diameter precipitate during homogenization. • L1{sub 2} and DO{sub 22} Al{sub 3}Zr phases result in partial recrystallization after solid solution. • Minor Zr can promote the precipitation of Q′ phases. • Mechanical properties of Al-Mg-Si-Cu-Cr-Zr alloy are higher than those of AA7005.

  9. Effect of Zr on microstructures and mechanical properties of an Al-Mg-Si-Cu-Cr alloy prepared by low frequency electromagnetic casting

    International Nuclear Information System (INIS)

    Meng, Yi; Cui, Jianzhong; Zhao, Zhihao; He, Lizi

    2014-01-01

    The Al-1.6Mg-1.2Si-1.1Cu-0.15Cr (all in wt. %) alloys with and without Zr addition prepared by low frequency electromagnetic casting process were investigated by using the optical microscope, scanning electron microscope and transmission electron microscope equipped with energy dispersive analytical X-ray. The effects of Al 3 Zr phases on the microstructures and mechanical properties during solidification, homogenization, hot extrusion and solid solution were studied. The results show that Al 3 Zr phases reduce the grain size by ∼ 29% and promote the formation of an equiaxed grain structure during solidification. Numerous spherical Al 3 Zr dispersoids with 35–60 nm in diameters precipitate during homogenization, and these fine dispersoids change little during subsequent hot extrusion and solid solution. Adding 0.15 wt. % Zr results in no recrystallization after hot extrusion and partial recrystallization after solid solution, while the recrystallized grain size is 400–550 μm in extrusion direction in the Zr-free alloy. In addition, adding 0.15 wt. % Zr can obviously promote Q′ phase precipitation, while the β″ phases are predominant in the alloy without Zr. Adding 0.15 wt. % Zr, the ultimate tensile strength of the T6 treated alloy increases by 45 MPa, while the elongation remains about 16.7%. - Highlights: • Minor Zr can refine as-cast grains of the LFEC Al-Mg-Si-Cu-Cr alloy. • L1 2 Al 3 Zr phases with 35–60 nm in diameter precipitate during homogenization. • L1 2 and DO 22 Al 3 Zr phases result in partial recrystallization after solid solution. • Minor Zr can promote the precipitation of Q′ phases. • Mechanical properties of Al-Mg-Si-Cu-Cr-Zr alloy are higher than those of AA7005

  10. Surface Characterization of ZrO2/Zr Coating on Ti6Al4V and IN VITRO Evaluation of Corrosion Behavior and Biocompatibility

    Science.gov (United States)

    Wang, Ruoyun; Sun, Yonghua; He, Xiaojing; Gao, Yuee; Yao, Xiaohong

    Biocompatibility is crucial for implants. In recent years, numerous researches were conducted aiming to modify titanium alloys, which are the most extensively used materials in orthopedic fields. The application of zirconia in the biomedical field has recently been explored. In this study, the biological ZrO2 coating was synthesized on titaniumalloy (Ti6Al4V) substrates by a duplex-treatment technique combining magnetron sputtering with micro-arc oxidation (MAO) in order to further improve the corrosion resistance and biocompatibility of Ti6Al4V alloys. The microstructures and phase constituents of the coatings were characterized by scanning electron microscope (SEM) equipped with energy dispersive spectroscopy (EDS) and X-ray diffraction (XRD), the surface wettability was evaluated by contact angle measurements. The results show that ZrO2 coatings are porous with pore sizes less than 2μm and consist predominantly of the tetragonal ZrO2 (t-ZrO2) and cubic ZrO2(c-ZrO2) phase. Electrochemical tests indicate that the corrosion rate of Ti6Al4V substrates is appreciably reduced after surface treatment in the phosphate buffer saline (PBS). In addition, significantly improved cell adhesion and growth were observed from the ZrO2/Zr surface. Therefore, the hybrid approach of magnetron sputtering and MAO provides a surface modification for Ti6Al4V to achieve acceptable corrosion resistance and biocompatibility.

  11. Al2O3 Passivation Effect in HfO2·Al2O3 Laminate Structures Grown on InP Substrates.

    Science.gov (United States)

    Kang, Hang-Kyu; Kang, Yu-Seon; Kim, Dae-Kyoung; Baik, Min; Song, Jin-Dong; An, Youngseo; Kim, Hyoungsub; Cho, Mann-Ho

    2017-05-24

    The passivation effect of an Al 2 O 3 layer on the electrical properties was investigated in HfO 2 -Al 2 O 3 laminate structures grown on indium phosphide (InP) substrate by atomic-layer deposition. The chemical state obtained using high-resolution X-ray photoelectron spectroscopy showed that interfacial reactions were dependent on the presence of the Al 2 O 3 passivation layer and its sequence in the HfO 2 -Al 2 O 3 laminate structures. Because of the interfacial reaction, the Al 2 O 3 /HfO 2 /Al 2 O 3 structure showed the best electrical characteristics. The top Al 2 O 3 layer suppressed the interdiffusion of oxidizing species into the HfO 2 films, whereas the bottom Al 2 O 3 layer blocked the outdiffusion of In and P atoms. As a result, the formation of In-O bonds was more effectively suppressed in the Al 2 O 3 /HfO 2 /Al 2 O 3 /InP structure than that in the HfO 2 -on-InP system. Moreover, conductance data revealed that the Al 2 O 3 layer on InP reduces the midgap traps to 2.6 × 10 12 eV -1 cm -2 (compared to that of HfO 2 /InP, that is, 5.4 × 10 12 eV -1 cm -2 ). The suppression of gap states caused by the outdiffusion of In atoms significantly controls the degradation of capacitors caused by leakage current through the stacked oxide layers.

  12. Effect of Zr Purity and Oxygen Content on the Structure and Mechanical Properties of Melt-Spun and Suction-Cast Cu46Zr42Al7Y5 Alloy

    Directory of Open Access Journals (Sweden)

    Kozieł T.

    2016-06-01

    Full Text Available The effect of oxygen content in zirconium on the structure and mechanical properties of the Cu46Zr42Al7Y5 alloy, in the form of melt-spun ribbons and suction-cast rods, was investigated. Two types of Zr, rod and crystal bar of different nominal purities and oxygen contents, were used to synthesize the alloy by arc melting. Rapidly solidified ribbons were produced by melt spinning and their amorphous structures were confirmed by X-ray diffractometry (XRD and differential scanning calorimetry (DSC. Bulk samples in the form of rods were cast using a special water-cooled suction casting unit attached to the arc melting system. XRD and DSC studies proved the amorphous structure of the bulk alloy synthesized from low-oxygen Zr and partial crystallization of the same alloy for high-oxygen Zr. In both bulk samples, uniformly distributed crystalline particles were identified as yttrium oxides. Higher mean compressive strength of amorphous alloy was observed. The hardness of amorphous phase was close to 500 HV1 in both bulk alloys, while the hardness of crystalline dendritic areas, observed in the alloy synthesized from high oxygen Zr, was lower by about 50 HV1.

  13. Alpha and beta stabilizer character of Al in Zr-Nb-Al alloys

    International Nuclear Information System (INIS)

    Peruzzi Bardella, A.; Bolcich, J.C.

    1987-01-01

    The T β/α+β of Zr5Nb and Zr5Nb2Al (weight %) were determined in order to observe the alpha-stabilizer character of Al in ternary Zr-Nb-Al alloys. Techniques employed were change of resistivity with temperature in dynamic experiences, and metallography of samples quenched to room temperature after isothermal annealings. The T β/α+β of the ternary resulted 17 ± 8 deg C higher than that of the binary alloy. In addition, taking into account the results of previous investigations of the transformation of beta on quenching Zr-Nb-Al alloys from the beta field to room temperature, it is concluded that the beta-stabilizer character of Nb is stronger than the alpha-stabilizer character of Al in these Zr alloys, and that the Al can have important influence on the mechanical properties by the appearance of TRIP effect. (Author) [es

  14. Structural characterization and optical properties of perovskite ZnZrO 3 nanoparticles

    KAUST Repository

    Zhu, Xinhua

    2014-03-17

    Perovskite ZnZrO3 nanoparticles were synthesized by hydrothermal method, and their microstructures and optical properties were characterized. The crystallinity, phase formation, morphology and composition of the as-synthesized nanoparticles were characterized by X-ray diffraction (XRD), selected area electron diffraction (SAED), high-resolutiontransmission electron microscopy (HRTEM), and energy-dispersive X-ray (EDX) spectroscopy analysis, respectively. TEM images demonstrated that the average particle size of the ZnZrO3 powders was increased with increasing the Zn/Zr molar ratios in the precursors, and more large ZnZrO3 particles with cubic morphology were observed at high Zn/Zr molar ratios. In addition, the phase structures of the ZnZrO3 particles were also evolved from a cubic to tetragonal perovskite phase, as revealed by XRD and SAED patterns. HRTEM images demonstrate that surface structures of the ZnZrO3 powders synthesized at high Zn/Zr molar ratios, are composed of corners bound by the {100} mini-facets, and the surface steps lying on the {100} planes are frequently observed, whereas the (101) facet isoccasionally observed. The formation of such a rough surface structure is understood from the periodic bond chain theory. Quantitative EDX analyses demonstrated that the atomic concentrations (at.%) of Zn:Zr:O in the particles were 20.70:21.07:58.23, as close to the composition of ZnZrO3. In the optical spectra, a significant red shift of the absorption edges (for the ZnZrO3 nanopowders) from UV to visible region (from 394 to 417 nm) was observed as increasing the Zn/Zr molar ratios in the precursors, which corresponds to that the band gap energies of the ZnZrO3 nanopowders can be continuously tuned from 3.15 to 2.97 eV. This opens an easy way to tune the band gap energies of the ZnZrO3 nanopowders. © 2014 The American Ceramic Society.

  15. The behavior of ZrO{sub 2}/20%Y{sub 2}O{sub 3} and Al{sub 2}O{sub 3} coatings deposited on aluminum alloys at high temperature regime

    Energy Technology Data Exchange (ETDEWEB)

    Pintilei, G.L., E-mail: laura_rares082008@yahoo.com [Pitesti University, Faculty of Mechanics and Technology, Str. Targu din Vale nr.1, 110040 Pitesti, Arges (Romania); Technical University “Gheorghe Asachi” of Iasi, Faculty of Mechanics, Bld D. Mangeron nr. 61, 700050 Iasi (Romania); Crismaru, V.I. [Technical University “Gheorghe Asachi” of Iasi, Faculty of Mechanics, Bld D. Mangeron nr. 61, 700050 Iasi (Romania); Abrudeanu, M. [Pitesti University, Faculty of Mechanics and Technology, Str. Targu din Vale nr.1, 110040 Pitesti, Arges (Romania); Munteanu, C. [Technical University “Gheorghe Asachi” of Iasi, Faculty of Mechanics, Bld D. Mangeron nr. 61, 700050 Iasi (Romania); Baciu, E.R. [University of Medicine and Pharmacy “Gr.T.Popa”, Department Implantology, Removable Restorations, Technology, Str. Universitatii nr. 16, 700115 Iasi (Romania); Istrate, B.; Basescu, N. [Technical University “Gheorghe Asachi” of Iasi, Faculty of Mechanics, Bld D. Mangeron nr. 61, 700050 Iasi (Romania)

    2015-10-15

    Highlights: • In both the ZrO{sub 2}/20%Y{sub 2}O{sub 3} and Al{sub 2}O{sub 3} coatings the high temperature caused a decrease of pores volume and a lower thickness of the interface between successive splats. • The NiCr bond layer in the sample with a ZrO{sub 2}/20%Y{sub 2}O{sub 3} suffered a fragmentation due to high temperature exposure and thermal expansion which can lead to coating exfoliation. • The NiCr bond layer in the sample with an Al{sub 2}O{sub 3} coating showed an increase of pore volume due to high temperature. - Abstract: Aluminum alloy present numerous advantages like lightness, high specific strength and diversity which recommend them to a high number of applications from different fields. In extreme environments the protection of aluminum alloys is difficult and requires a high number of requirements like high temperature resistance, thermal fatigue resistance, corrosion fatigue resistance and galvanic corrosion resistance. To obtain these characteristics coatings can be applied to the surfaces so they can enhance the mechanical and chemical properties of the parts. In this paper two coatings were considered for deposition on an AA2024 aluminum alloy, ZrO{sub 2}/20%Y{sub 2}O{sub 3} and Al{sub 2}O{sub 3}. To obtain a better adherence of the coating to the base material an additional bond layer of NiCr is used. Both the coatings and bond layer were deposited by atmospheric plasma spraying on the samples. The samples were subjected to a temperature of 500 °C and after that slowly cooled to room temperature. The samples were analyzed by electron microscopy and X-ray diffraction to determine the morphological and phase changes that occurred during the temperature exposure. To determine the stress level in the parts due to thermal expansion a finite element analysis was performed in the same conditions as the tests.

  16. Computer simulation of the structural transformation in liquid Al2O3

    International Nuclear Information System (INIS)

    Vo Van Hoang; Oh, Suhk Kun

    2005-01-01

    We investigate the pressure-induced structural transformation in liquid Al 2 O 3 by a molecular dynamics (MD) method. Simulations were done in the basic cube, under periodic boundary conditions, containing 3000 ions with Born-Mayer-type pair potentials. The structure of the liquid Al 2 O 3 model with a real density at ambient pressure is in good agreement with Landron's experiment. In order to study the structural transformation, seven models of liquid alumina at temperature 2500 K and at densities in the range 2.80-4.5 g cm -3 have been built. The microstructure of Al 2 O 3 systems has been analysed through the pair radial distribution functions, coordination number distributions, interatomic distances and bond-angle distributions. And we found clear evidence of a structural transition in liquid alumina from a tetrahedral to an octahedral network. According to our results, this transformation occurred at densities in the range 3.6-4.5 g cm -3 . We also obtained an anomalous density dependence of the self-diffusion constant in the region of the structural transformation

  17. Experimental Investigation of the 1073 K (800 °C) Isothermal Section of the Al-V-Zr Ternary System

    Science.gov (United States)

    Zhu, Yude; Ouyang, Xuemei; Yin, Fucheng; Zhao, Manxiu; Lou, Jia

    2018-03-01

    This work is focused on an experimental investigation of the phase equilibria of the Al-V-Zr system at 1073 K (800 °C). The phase equilibria were analyzed using scanning electron microscopy (SEM) coupled with energy-dispersive spectrometry and X-ray diffraction. The results confirmed the presence of twelve three-phase regions and one ternary compound, Τ, which contains 10.0 to 16.5 at. pct Zr, 52.8 to 55.2 at. pct Al, and 29.3 to 36.3 at. pct V. The T phase can be in equilibrium with Al8V5, Al3Zr, Al2Zr, and α-V. The T phase belongs to the tetragonal crystal system with confirmed lattice parameters of a = 0.658531 nm and c = 0.517334 nm. The Al2Zr phase region is extraordinarily large and can be in equilibrium with all the compounds in the Al-Zr and V-Zr systems, with the exception of the AlZr phase.

  18. Performance improvement of charge-trap memory by using a stacked Zr{sub 0.46}Si{sub 0.54}O{sub 2}/Al{sub 2}O{sub 3} charge-trapping layer

    Energy Technology Data Exchange (ETDEWEB)

    Tang, Zhenjie; Hu, Dan; Zhang, Xiwei; Zhao, Yage [College of Physics and Electronic Engineering, Anyang Normal University, Anyang 455000 (China); Li, Rong [School of Mathematics and Statistics, Anyang Normal University, Anyang 455000 (China)

    2016-11-15

    The postdeposition annealing (PDA)-treated charge-trap flash memory capacitor with stacked Zr{sub 0.46}Si{sub 0.54}O{sub 2}/Al{sub 2}O{sub 3} charge-trapping layer flanked by a SiO{sub 2} tunneling oxide and an Al{sub 2}O{sub 3} blocking oxide was fabricated and investigated. It is observed that the memory capacitor exhibits prominent memory characteristics with large memory windows 12.8 V in a ±10 V gate sweeping voltage range, faster program/erase speed, and good data-retention characteristics even at 125 C compared to a single charge-trapping layer (Zr{sub 0.46}Si{sub 0.54}O{sub 2}, Zr{sub 0.79}Si{sub 0.21}O{sub 2}, and Zr{sub 0.46}Al{sub 1.08}O{sub 2.54}). The quantum wells and introduced interfacial traps of the stacked trapping layer regulate the storage and loss behavior of charges, and jointly contribute to the improved memory characteristics. Hence, the memory capacitor with a stacked trapping layer is a promising candidate in future nonvolatile charge-trap memory device design and application. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  19. Correlation between local structure and stability of supercooled liquid state in Zr-based metallic glasses

    International Nuclear Information System (INIS)

    Saida, Junji; Imafuku, Muneyuki; Sato, Shigeo; Sanada, Takashi; Matsubara, Eiichiro; Inoue, Akihisa

    2007-01-01

    The correlation between the local structure and stability of supercooled liquid state is investigated in the Zr 70 (Ni, Cu) 30 binary and Zr 70 Al 10 (Ni, Cu) 20 (numbers indicate at.%) ternary metallic glasses. The Zr 70 Ni 30 binary amorphous alloy with a low stability of supercooled liquid state has a tetragonal Zr 2 Ni-like local structure around Ni atom. Meanwhile, the Zr 70 Cu 30 binary metallic glass has a different local structure of tetragonal Zr 2 Cu, where we suggest the icosahedral local structure by the quasicrystallization behavior in addition of a very small amount of noble metals. The effect of Al addition on the local structure in the Zr-Ni alloy is also examined. We have investigated that the dominant local structure changes in the icosahedral-like structure from the tetragonal Zr 2 Ni-like local structure by the Al substitution with Ni accompanying with the significant stabilization of supercooled liquid state. It is concluded that the formation of icosahedral local structure contributes to the enhancement of stability of supercooled liquid state in the Zr-based alloys

  20. Bixbyite-type phases in the system Ta-Zr-O-N

    Energy Technology Data Exchange (ETDEWEB)

    Luedtke, Tobias; Orthmann, Steven; Lerch, Martin [Technische Univ. Berlin (Germany). Inst. fuer Chemie

    2017-06-01

    Phase-pure tantalum/zirconium oxide nitrides and nitrides were synthesized by the ammonolysis of amorphous oxide precursors. The nitrogen-rich oxide nitrides with variable anion composition and the nitride TaZrN3 crystallize in the cubic bixbyite-type structure (space group Ia3). The nitrogen content of these compounds has a significant influence on the cell parameters, the atomic positions, and the optical band gap. The results extend the already well-studied Ta-Zr-O-N system by new oxide nitrides in addition to the already known baddeleyite- and anosovite-type phases. TaZrN{sub 3} can be considered as a thermodynamically stable ternary variant of metastable Ta{sub 2}N{sub 3}.

  1. Espumas vítreas do sistema Li2O-ZrO2-SiO2-Al2O 3 produzidas pelo processo gelcasting

    OpenAIRE

    Sousa,E. de; Rambo,C. R.; Ortega,F. S.; Oliveira,A. P. N. de; Pandolfelli,V. C.

    2009-01-01

    Espumas vítreas do sistema Li2O-ZrO2-SiO2-Al2O 3 (LZSA) foram produzidas pelo processo gelcasting, associado à aeração de suspensões cerâmicas, sem controle atmosférico. Por meio da adição de diferentes concentrações de agente espumante (Fongraminox) foi possível obter espumas vítreas com densidade relativa variando entre uma estreita faixa (0,10-0,15). As espumas vítreas apresentaram resistência à compressão de 2,5-3,7 MPa, que correspondem a porosidade entre 85 e 89% e macroestrutra com por...

  2. Tritium inventory in Li2ZrO3 blanket

    International Nuclear Information System (INIS)

    Nishikawa, M.; Baba, A.

    1998-01-01

    Recently, we have presented the way to estimate the tritium inventory in a solid breeder blanket considering effects of diffusion of tritium in the grain, absorption of water in the bulk of grain, and adsorption of water on the surface of grain, together with two types of isotope exchange reactions. It is reported in our previous paper that the estimated tritium inventory for a LiAlO 2 blanket agrees well with data observed in various in situ experiments when the effective diffusivity of tritium from the EXOTIC-6 experiment is used and that the better agreement is obtained when existence of some water vapor is assumed in the purge gas. The same way as used for a LiAlO 2 blanket is applied to a Li 2 ZrO 3 blanket in this study and the estimated tritium inventory shows a good agreement with data obtained in such in situ experiments as MOZART, EXOTIC-6 and TRINE experiments. (orig.)

  3. Structure and mechanical properties of TiZr binary alloy after Al addition

    International Nuclear Information System (INIS)

    Jiang, X.J.; Jing, R.; Liu, C.Y.; Ma, M.Z.; Liu, R.P.

    2013-01-01

    Microstructure and mechanical properties of hot-rolled TiZrAl alloys were studied. The results showed that the microstructure of all alloys mainly consisted of lamellar α phase. The thickness of the lamellar α phase gradually increased with increasing aluminum content. Moreover, large numbers of stacking faults was observed in Ti–25Zr–15Al (at%) alloy. The aluminum addition strongly affected the mechanical properties of the TiZrAl alloys. With increased aluminum contents, the strength increased evidently, whereas, the elongation decreased. Ti–25Zr–15Al (at%) with the highest aluminum contents in all alloys, possessed the highest tensile strength (σ b =1319 MPa), i.e. strengthened by 41% compared with Ti–25Zr (at%) alloy, and still retained the elongation of 5.5%. According to the classical size and/or modulus misfits model, the effect of aluminum addition was significant in TiZr alloys because of the considerable misfits between aluminum and zirconium

  4. Glass forming in La2O3-TiO2-ZrO2 ternary system by containerless processing

    Science.gov (United States)

    Kaneko, Masashi; Kentei Yu, Yu; Kumar, Vijaya; Masuno, Atsunobu; Inoue, Hiroyuki; Odawara, Osamu; Yoda, Shinichi

    The containerless processing is an appropriate method to create new glasses, because it sup-presses nucleation at the boundary between liquid and crucible during solidification and it enables molten samples to be solidified without crystallization. Recently, we have succeeded in forming BaTi2 O5 glass in the bulk state by using an aerodynamic levitation furnace. BaTi2 O5 glass includes no traditional glass network former and it possesses high electric permittivity [1, 2]. From the point of view of optical application, BaTi2 O5 glass has high refractive indices over 2.1. BaTi2 O5 glass, however, vitrify only in a small sphere, and it crystallize when its diameter exceed 1.5 mm. In order to synthesize new titanate oxide glasses which possess higher refractive indices and larger diameter than BaTi2 O5 , La and Zr can be used as substitutive components. When Ba is replaced with La, refractive indices are expected to increase because of the heavier element. The addition of a third element is thought to be effective for enhance-ment of glass formation ability and Zr can be a candidate because Ti and Zr are homologous. In this research, we have succeeded in forming new bulk glass in La2 O3 -TiO2 -ZrO2 ternary system by means of the aerodynamic levitation furnace. We investigated the glass forming region, thermal properties and optical properties of La2 O3 -TiO2 -ZrO2 glass. Glass transition temperature, crystallization temperature, density, refractive indices and transmittance spectra were varied depending on the chemical composition. Reference [1] J. Yu et al, "Fabrication of BaTi2O5 Glass-Ceramics with Unusual Dielectric Properties during Crystallization", Chem-istry of Materials, 18 (2006) 2169-2173. [2] J. Yu et al., "Comprehensive Structural Study of Glassy and Metastable Crystalline BaTi2O5", Chemistry of Materials, 21 (2009) 259-263.

  5. Growth kinetics of tetragonal and monoclinic ZrO{sub 2} crystallites in 3 mol% yttria partially stabilized ZrO{sub 2} (3Y-PSZ) precursor powder

    Energy Technology Data Exchange (ETDEWEB)

    Kuo, Chih-Wei [Department of Resources Engineering, National Cheng Kung University, 1 Ta-Hsueh Road, Tainan 70101, Taiwan (China); Lee, Kuen-Chan [Department of Fragrance and Cosmetic Science, Kaohsiung Medical University, 100 Shih-Chuan 1st Road, Kaohsiung 807, Taiwan (China); Yen, Feng-Lin, E-mail: flyen@kmu.edu.tw [Department of Fragrance and Cosmetic Science, Kaohsiung Medical University, 100 Shih-Chuan 1st Road, Kaohsiung 807, Taiwan (China); Shen, Yun-Hwei [Department of Resources Engineering, National Cheng Kung University, 1 Ta-Hsueh Road, Tainan 70101, Taiwan (China); Lee, Huey-Er [Department of Dentistry, Kaohsiung Medical University, 100 Shih-Chuan 1st Road, Kaohsiung 807, Taiwan (China); Department of Dentistry, Kaohsiung Medical University, Chung Ho Memorial Hospital, 100 Tzyou 1st Road, Kaohsiung 807, Taiwan (China); Wen, Shaw-Bing [General Education Center, Meiho Institute of Technology, 23 Pingguang Road, Neipu, Pingtung 91202, Taiwan (China); Wang, Moo-Chin, E-mail: mcwang@kmu.edu.tw [Department of Fragrance and Cosmetic Science, Kaohsiung Medical University, 100 Shih-Chuan 1st Road, Kaohsiung 807, Taiwan (China); Stack, Margaret Mary [Department of Mechanical and Aerospace Engineering, University of Strathclyde, 75 Montrose Street, Glasgow (United Kingdom)

    2014-04-01

    Highlights: • The crystalline structures were composed of tetragonal and monoclinic ZrO{sub 2}. • Growth kinetics of t-ZrO{sub 2} in the 3Y-PSZ precursor powder is described as: D{sub te}{sup 2}=(4.57±0.55)t{sup 0.12±0.02}exp(-((24.79±0.38)×10{sup 3})/(RT) ). • Growth kinetics of m-ZrO{sub 2} in the 3Y-PSZ precursor powder is described as: D{sub m}{sup 2}=(4.40±1.63)t{sup 0.17±0.08}exp(-((66.47±3.97)×10{sup 3})/(RT) ). - Abstract: The growth kinetics of tetragonal and monoclinic ZrO{sub 2} crystallites in 3 mol% yttria partially stabilized ZrO{sub 2} (3Y-PSZ) precursor powder has been investigated using X-ray diffraction (XRD), Brunauer–Emmett–Teller (BET) specific surface area analysis, transmission electron microscopy (TEM) and high resolution TEM (HRTEM). After calcination of the 3Y-PSZ precursor powder between 773 and 1073 K for 2 h, the crystalline structures were composed of tetragonal and monoclinic ZrO{sub 2} as the primary and secondary phases, respectively. When the 3Y-PSZ precursor powder was calcined at 773 K for 2 h, the BET specific surface area was 97.13 m{sup 2}/g, which is equivalent to a particle size of 10.30 nm. The crystallite sizes determined via XRD and BET agreed well, indicating that the powder was virtually non-agglomerated. The growth kinetics of tetragonal and monoclinic ZrO{sub 2} crystallite isothermal growth in the 3Y-PSZ precursor powder are described by: D{sub te}{sup 2}=(4.57±0.55)t{sup 0.12±0.02}exp(-((24.79±0.38)×10{sup 3})/(RT) ) and D{sub m}{sup 2}=(4.40±1.63)t{sup 0.17±0.08}exp(-((66.47±3.97)×10{sup 3})/(RT) ), respectively, for 773K≤T≤1073K. D{sub te} and D{sub m} denote the crystallite size of tetragonal and monoclinic ZrO{sub 2} at time t and temperature T, respectively.

  6. Effect of a ZrO{sub 2} coating deposited by the sol–gel method on the resistance of FeCrAl alloy in high-temperature oxidation conditions

    Energy Technology Data Exchange (ETDEWEB)

    Chęcmanowski, Jacek Grzegorz, E-mail: jacek.checmanowski@pwr.wroc.pl [Wrocław University of Technology, Faculty of Chemistry, Wybrzeże Wyspiańskiego 27, 50-370 Wrocław (Poland); Szczygieł, Bogdan, E-mail: bogdan.szczygiel@pwr.wroc.pl [Wrocław University of Technology, Faculty of Chemistry, Wybrzeże Wyspiańskiego 27, 50-370 Wrocław (Poland)

    2013-05-15

    One-, three- and five-layer protective ZrO{sub 2} coatings were deposited on a FeCrAl alloy base by the sol–gel method. A zirconium(IV) isopropoxide isopropanol complex was used as the zirconium precursor. It has been shown that zirconium in the amount of 0.3–0.5 wt.% improves the resistance of FeCrAl alloy in high-temperature oxidation conditions (in air at T = 1060 °C for t = 2400 h). Even a very low Zr content affects the morphology, porosity and composition of the forming scale (SEM, EDS). An analysis of the chemical composition of the material after oxidation indicated to-core Zr diffusion. The presence of zirconium prevents catastrophic corrosion of the FeCrAl alloy during oxidation. In the case of the alloy without the reactive element (Zr) this type of corrosion occurred after about 1800 h. The oxidation of the FeCrAl alloy covered with ZrO{sub 2} coatings proceeds in three stages. In the first stage, lasting about 50 h, the mass of the sample grows rapidly, then for 700 h the mass changes minimally and in the third stage the oxidation proceeds according to a parabolic dependence. The presence of Zr on the surface of the FeCrAl alloy significantly contributes to the protective effect of the coatings. - Highlights: ► Multilayer ZrO{sub 2} coatings were deposited on FeCrAl alloy by sol–gel method. ► Study of alloy composition indicates to-core Zr diffusion in high temperature. ► Even very low content affects morphology and porosity of forming scale. ► Zirconium improves the resistance of FeCrAl alloy in high temperature conditions. ► Presence of ZrO{sub 2} prevents catastrophic corrosion of FeCrAl alloy during oxidation.

  7. Microstructure of Al2O3 scales formed on NiCrAl alloys. Ph.D. Thesis - Case Western Reserve Univ.

    Science.gov (United States)

    Smialek, J. L.

    1981-01-01

    The structure of transient scales formed on pure and Y or Zr-doped Ni-15Cr-13Al alloys oxidized for 0.1 hr at 1100 C was studied by the use of transmission electron microscopy. Crystallographically oriented scales were found on all three alloys, but especially for the Zr-doped NiCrAl. The oriented scales consisted of alpha-(Al,Cr)2O3, Ni(Al,Cr)2O4 and gamma-Al2O3. They were often found in intimate contact with each other such that the close-packed planes and directions of one oxide phase were aligned with those of another. The prominent structural features of the oriented scales were approximately equal to micrometer subgrains; voids, antiphase domain boundaries and aligned precipitates were also prevalent. Randomly oriented alpha-Al2O3 was also found and was the only oxide ever observed at the immediate oxide metal interface. These approximately 0.15 micrometer grains were populated by intragranular voids which decreased in size and number towards the oxide metal interface. A sequence of oxidation was proposed in which the composition of the growing scale changed from oriented oxides rich in Ni and Cr to oriented oxides rich in Al. At the same time the structure changed from cubic spinels to hexagonal corundums with apparent precipitates of one phase in the matrix of the other. Eventually randomly oriented pure alpha-Al2O3 formed as the stable oxide with an abrupt transition: there was no gradual loss of orientation, no gradual compositional change or no gradual decrease in precipitate density.

  8. Compatibility behavior of beryllium with LiAlO2 and Li2ZrO3 ceramics, with 316L and 1.4914 steels in Sibelius

    International Nuclear Information System (INIS)

    Flament, T.; Roux, N.; Abassin, J.J.; Briec, M.; Cruz, D.; Schuster, I.

    1991-01-01

    The compatibility under irradiation of beryllium with Li 2 O, LiAlO 2 , Li 4 SiO 4 and Li 2 ZrO 3 ceramics and with 316L and 1.4914 steels was investigated in SIBELIUS. The irradiation was performed in the SILOE reactor at 550 deg C for 1690 hours in He + 0.1%H 2 purge pas. Examinations of the LiAlO 2 /Be and Li 2 ZrO 3 /Be couples show a weak oxidation of beryllium and the presence of cavities near the interface with ceramics. Examinations of the 316L/Be and 1.4914/Be couples show the formation of an oxide layer on all beryllium and steel surfaces suggesting that corrosion arises from a species (most likely T 2 O and/or H 2 O) present in the environmental atmosphere. Post-irradiation annealing tests of beryllium indicate that the major part of helium is released during irradiation whereas the major part of tritium is released above 700 deg C

  9. Crystallization behavior and the thermal properties of Zr63Al7.5Cu17.5Ni10B2 bulk amorphous alloy

    International Nuclear Information System (INIS)

    Jang, J.S.C.; Chang, L.J.; Jiang, Y.T.; Wong, P.W.

    2003-01-01

    The ribbons of amorphous Zr 63 Al 7.5 Cu 17.5 Ni 10 B 2 alloys with 0.1 mm thickness were prepared by melt spinning method. The thermal properties and micro structural development during the annealing of amorphous alloy have been investigated by a combination of differential thermal analysis, differential scanning calorimetry, high-temperature optical microscope, X-ray diffractometry and TEM. The glass transition temperature for the Zr 63 Al 7.5 Cu 17.5 Ni 10 B 2 alloys are measured about 645 K (372 C). This alloy also obtains a large temperature interval ΔT x about 63 K. Meanwhile, the calculated T rg for Zr 63 Al 7.5 Cu 17.5 Ni 10 B 2 alloy presents the value of 0.57. The activation energy of crystallization for the alloy Zr 63 Al 7.5 Cu 17.5 Ni 10 B 2 was about 370± 10 kJ/mole as determined by the Kissinger and Avrami plot, respectively. These values are about 20% higher than the activation energy of crystallization for the Zr 65 Al 7.5 Cu 17.5 Ni 10 alloy (314 kJ/mol.). This implies that the boron additions exhibit the effect of improving the thermal stability for the Zr-based alloy. The average value of the Avrami exponent n were calculated to be 1.75±0.15 for Zr 63 Al 7.5 Cu 17.5 Ni 10 B 2 alloy. This indicates that this alloy presents a crystallization process with decreasing nucleation rate. (orig.)

  10. Crystallization of AlON layers and its effects on the microstructure and hardness of reactively synthesized ZrN/AlON nanomultilayers

    Energy Technology Data Exchange (ETDEWEB)

    Dong Yunshan; Yue Jianling; Liu Yan; Li Geyang [State Key Lab of Metal Matrix Composites, Shanghai Jiao Tong University, Shanghai, 200030 (China)

    2006-11-21

    By reactively sputtering Zr and Al{sub 2}O{sub 3} targets in a gaseous mixture of Ar and N{sub 2}, ZrN/AlON nanomultilayers were synthesized to study the crystallization conditions for AlON layers and how they influence the characteristics of multilayers. The composition analysis indicated that some of the oxygen atoms were replaced by nitrogen atoms in Al{sub 2}O{sub 3}, leading to the formation of aluminium oxynitride, AlON, during the procedure of the Al{sub 2}O{sub 3} target being sputtered in the gaseous mixture. Further investigations showed that when their thickness was limited to less than 1 nm, amorphous AlON layers were crystallized under the template effects of crystalline ZrN layers, and then coherent interfaces formed as a result. Correspondingly, the multilayers were remarkably strengthened with hardness approaching a maximum of 33 GPa. After the layer thickness of AlON exceeded the critical value of 1 nm, the subsequently deposited AlON grew amorphously and blocked the epitaxial growth of multilayers, accompanied by the decline of hardness. Yet, on the other hand, the integrated hardness of multilayers was not sensitive to the thickness of the ZrN template layers and its value was maintained a bit higher than 30 GPa in a wide range of ZrN layer thickness variations.

  11. Valence electron structure and properties of stabilized ZrO2

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    To reveal the properties of stabilizers in ZrO2 on nanoscopic levels, the valence electron structures of four stable ZrO2 phases and c-ZrO2 were analyzed on the basis of the empirical electron theory of solids and molecules. The results showed that the hybridization levels of Zr atoms in c-ZrO2 doped with Ca and Mg dropped from B17 to B13, the hybridization levels of Zr atoms in c-ZrO2 doped with Y and Ce dropped from B17 to B15, and that the four stabilizing atoms all made the hybridization levels of O atoms drop from level 4 to level 2. The numbers of covalent electrons in the strongest covalent bond in the descending order are c-ZrO2>Zr0.82Ce0.18O2> Zr0.82Y0.18O1.91>Zr0.82Mg0.18O1.82>Zr0.82Ca0.18O1.82. The bond energies of the strongest covalent bond and the melting points of the solid solutions in the descending order are Zr0.82Ce0.18O2> c-ZrO2>Zr0.82Y0.18O1.91>Zr0.82Mg0.18O1.82>Zr0.82Ca0.18O1.82. The percent-ages of the total number of covalent electrons in the descending order are c-ZrO2>Zr0.82Y0.18O1.91> Zr0.82Ce0.18O2>Zr0.82Mg0.18O1.82> Zr0.82Ca0.18O1.82. From the above analysis, it can be concluded that the stabilizing degrees of the four stabilizers in the descending order are CaO> MgO>Y2O3>CeO2.

  12. Cube textured CeO2, BaZrO3 and LaAlO3 buffer layers on Ni based Substrates

    International Nuclear Information System (INIS)

    Deinhofer, C; Gritzner, G

    2006-01-01

    CeO 2 , BaZrO 3 as well as LaAlO 3 buffer layers were deposited on {100} Ni + 5 weight-% W substrates by a wet chemical technique. The solutions were prepared by dissolving the metal nitrates or acetates and zirconiumacetylacetonate, respectively, in mixtures of acetic acid, methanol and water. The solutions were applied by dip- or spincoating, dried at 135 deg. C and annealed at temperatures between 900 and 1 400 deg. C depending on the buffer layer for 15 min. under Ar-5% H 2 gas flow. Pole-figure measurements proved the exact texture of each buffer layer. Electron microscopy showed dense and smooth buffer layers

  13. First-principles study of new quaternary Heusler compounds without 3d transition metal elements: ZrRhHfZ (Z = Al, Ga, In)

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Xiaotian [School of Material Sciences and Engineering, Hebei University of Technology, Tianjin 300130 (China); Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Cheng, Zhenxiang, E-mail: cheng@uow.edu.au [Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Guo, Ruikang [School of Material Sciences and Engineering, Hebei University of Technology, Tianjin 300130 (China); Wang, Jianli [Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Rozale, Habib [Condensed Matter and Sustainable Development Laboratory, Physics Department, University of Sidi-Bel-Abbès, 22000 Sidi-Bel-Abbès (Algeria); Wang, Liying [Department of Physics, Tianjin University, Tianjin 300350 (China); Yu, Zheyin [Institute for Superconducting & Electronic Materials (ISEM), University of Wollongong, Wollongong 2500 (Australia); Liu, Guodong, E-mail: gdliu1978@126.com [School of Material Sciences and Engineering, Hebei University of Technology, Tianjin 300130 (China)

    2017-06-01

    Plane-wave pseudo-potential methods based on density functional theory are employed to investigate the electronic structures, and the magnetic and half-metallic properties of the newly designed quaternary Heusler compounds ZrRhHfZ (Z = Al, Ga, In) without 3d transition metal elements. The calculated results show that ZrRhHfZ (Z = Al, Ga, In) compounds are half-metallic, with 100% spin polarization around the Fermi level. The structural stability of these compounds has been tested from the aspects of their cohesion energy and formation. The spin-flip/half-metallic gaps of ZrRhHfZ (Z = Al, Ga, In) compounds are quite large, with values of 0.2548 eV, 0.3483 eV, and 0.2866 eV, respectively. These compounds show Slater-Pauling behavior, and the total spin magnetic moment per unit cell (M{sub t}) scales with the total number of valence electrons (Z{sub t}) following the rule: M{sub t} = Z{sub t} - 18. The magnetization of ZrRhHfZ (Z = Al, Ga, In) compounds mainly comes from the 4d electrons of the Zr atoms and the 5d electrons of the Hf atoms. Furthermore, the effects of uniform strain and tetragonal deformation on the half metallicity has been investigated in detail, which is important for practical application. Finally, we reveal that the half-metallicity can be maintained when the Coulomb interactions are considered. - Highlights: • New quaternary compounds without 3d transition metal elements have been designed. • The electronic structures and magnetism of the ZrRhHfZ compounds have been studied. • The effect of strain on the half-metallic behavior has been tested. • The effect of the Coulomb interactions on the half-metallicity has been investigated.

  14. Characterizing the residual glass in a MgO/Al2O3/SiO2/ZrO2/Y2O3 glass-ceramic

    Science.gov (United States)

    Seidel, Sabrina; Patzig, Christian; Wisniewski, Wolfgang; Gawronski, Antje; Hu, Yongfeng; Höche, Thomas; Rüssel, Christian

    2016-01-01

    The non-isochemical crystallization of glasses leads to glass-ceramics in which the chemical composition of the amorphous matrix differs from that of the parent glass. It is challenging to solely analyse the properties of these residual glassy phases because they frequently contain finely dispersed crystals. In this study, the composition of the residual glass matrix after the crystallization of a glass with the mol% composition 50.6 SiO2 · 20.7 MgO · 20.7 Al2O3 · 5.6 ZrO2 · 2.4 Y2O3 is analysed by scanning transmission electron microscopy (STEM) including energy dispersive X-ray analysis (EDXS). A batch of the residual glass with the determined composition is subsequently melted and selected properties are analysed. Furthermore, the crystallization behaviour of this residual glass is studied by X-ray diffraction, scanning electron microscopy including electron backscatter diffraction and STEM-EDXS analyses. The residual glass shows sole surface crystallization of indialite and multiple yttrium silicates while bulk nucleation does not occur. This is in contrast to the crystallization behaviour of the parent glass, in which a predominant bulk nucleation of spinel and ZrO2 is observed. The crystallization of the residual glass probably leads to different crystalline phases when it is in contact to air, rather than when it is enclosed within the microstructure of the parent glass-ceramics. PMID:27734918

  15. X-ray photoelectron spectroscopy as detection tool for coordinated or uncoordinated fluorine atoms demonstrated on fluoride systems NaF, K2TaF7, K3TaF8, K2ZrF6, Na7Zr6F31 and K3ZrF7

    Science.gov (United States)

    Boča, Miroslav; Barborík, Peter; Mičušík, Matej; Omastová, Mária

    2012-07-01

    While systems K3TaF8 and K3ZrF7 were prepared by modified molten salt method modified wet pathway was used for reproducible preparation of Na7Zr6F31. Its congruently melting character was demonstrated on simultaneous TG/DSC measurements and XRD patterns. X-ray photoelectron spectroscopy was applied for identification of differently bonded fluorine atoms in series of compounds NaF, K2TaF7, K3TaF8, K2ZrF6, Na7Zr6F31 and K3ZrF7. Three different types of fluorine atoms were described qualitatively and quantitatively. Uncoordinated fluorine atoms (F-) provide signals at lowest binding energies, followed by signals from terminally coordinated fluorine atoms (M-F) and then bridging fluorine atoms (M-F-M) at highest energy. Based on XPS F 1s signals assigned to fluorine atoms in compounds with correctly determined structure it was suggested that fluorine atoms in K3ZrF7 have partially bridging character.

  16. Influence of microstructure on the mechanical properties of a Zr-4.6 wt.% Al alloy

    International Nuclear Information System (INIS)

    Raman, V.; Mukhopadhyay, P.; Banerjee, S.

    1978-01-01

    The influence of microstructure on the room temperature mechanical properties of a Zr-4.6 wt.% Al alloy was investigated. Quenching from the beta phase produced a significant solid solution hardening. On aging the alloy at low temperatures for short periods aluminium rejection from the solid solution occurred and a fine dispersion of a metastable Zr 3 Al phase (DO 19 structure) formed. The strengthening caused by the presence of these ordered particles was found to more than compensate the softening brought about by decreasing supersaturation. The high strength corresponding to this structure could be explained in terms of the contributions from the coherency strains associated with and the state of order within the metastable particles. Aging at these temperatures for longer periods or at higher temperatures gave rise to a lamellar distribution of the α-zirconium (aluminium) and the equilibrium Zr 3 Al (Ll 2 structure) phases. The strength associated with this lamellar structure was found to be appreciably lower and to be strongly dependent on the interlamellar spacing. Investigations of the fracture surfaces showed that the modes of fracture associated with these different microstructures were different. An attempt was made to rationalize the observed strength properties in terms of existing theoretical models. (Auth.)

  17. Microstructures and mechanical properties of Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) ceramics

    Energy Technology Data Exchange (ETDEWEB)

    Ma, Lei [Key Laboratory for Anisotropy and Texture of Materials (Ministry of Education), Northeastern University, Shenyang, Liaoning 110819 (China); Key Laboratory for Advanced Ceramics and Application of Shenyang, Shenyang University of Chemical Technology, Shenyang, Liaoning 110142 (China); Ma, Weimin, E-mail: maleisy2003@163.com [Key Laboratory for Advanced Ceramics and Application of Shenyang, Shenyang University of Chemical Technology, Shenyang, Liaoning 110142 (China); Sun, Xudong, E-mail: xdsun@mail.neu.edu.cn [Key Laboratory for Anisotropy and Texture of Materials (Ministry of Education), Northeastern University, Shenyang, Liaoning 110819 (China); Ji, Lianyong; Liu, Jianan; Hang, Kai [Key Laboratory for Advanced Ceramics and Application of Shenyang, Shenyang University of Chemical Technology, Shenyang, Liaoning 110142 (China)

    2015-09-25

    Highlights: • Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composites were prepared using vacuum sintering. • The phase composition and microstructure are studied. • Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) materials show superior mechanical properties. • The solid solution strengthening and stress-induced phase transformation toughening mechanism are proposed. • Two kinds of mechanisms explain the improvement of mechanical properties. - Abstract: Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composite ceramics were prepared by vacuum sintering using Gd{sub 2}Zr{sub 2}O{sub 7} and ZrO{sub 2}(3Y) nanoparticles. The ceramics were characterized using X-ray diffraction (XRD), scanning electron microscopy (SEM), energy dispersive spectrometer (EDS), the three-point-bending technique and single-edge-notched-beam tests. The effect of various proportions of ZrO{sub 2}(3Y) on the phase composition, microstructure, bending strength and fracture toughness of the final Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composite ceramics was also analyzed. The change from m-ZrO{sub 2} to t-ZrO{sub 2} phase contents, before and after fracture, was measured using XRD quantitative phase analysis. The results confirm that, with the increasing content of ZrO{sub 2}(3Y), a phase transition from solid solution to saturated precipitation occurs and the bending strength and fracture toughness of the samples increase gradually. When the content of ZrO{sub 2}(3Y) reached 95 vol.%, the Gd{sub 2}Zr{sub 2}O{sub 7}/ZrO{sub 2}(3Y) composite ceramics had a bending strength of 547 MPa and a fracture toughness of 5.5 MPa m{sup 1/2}, indicating that stress-induced phase transformation toughening was an efficient way to increase the mechanical properties of the Gd{sub 2}Zr{sub 2}O{sub 7} ceramics.

  18. Time resolved emission spectroscopy investigations of pulsed laser ablated plasmas of ZrO2 and Al2O3

    International Nuclear Information System (INIS)

    Hadoko, A D; Lee, P S; Lee, P; Mohanty, S R; Rawat, R S

    2006-01-01

    With the rising trend of synthesizing ultra thin films and/or quantum-confined materials using laser ablation, optimization of deposition parameters plays an essential role in obtaining desired film characteristics. This paper presents the initial step of plasma optimization study by examining temporal distribution of the plasma formation by pulsed laser ablation of materials. The emitted spectra of ZrO 2 and Al 2 O 3 are obtained ∼3mm above the ablated target to derive the ablated plasma characteristics. The plasma temperature is estimated to be at around 2.35 eV, with electron density of 1.14 x 10 16 (cm -3 ). Emission spectra with different gate delay time (40-270 ns) are captured to study the time resolved plume characteristics. Transitory elemental species are identified

  19. The evolution of interface microstructure in a ZrO2/Ag-Cu-Al-Ti system

    International Nuclear Information System (INIS)

    Lee, Youngmin; Yu, Jin

    1993-01-01

    Among ceramic/metal (C/M) joining technologies, the active filler metal method has been studied extensively due to the simple brazing process and excellent joint strength. Active metal elements, typically Ti, are intentionally added to braze alloys to enhance the formation of reaction products between the ceramic and the braze metal at the C/M interface. In the brazing of Al 2 O 3 with the Ag-Cu-Ti filler metal, reaction products such as γ-TiO, Cu 2 (Ti, Al) 4 O, Ti 3 (Cu 0.76 Al 0.18 Sn 0.06 ) 3 O were found, while products such as Ti 5 Si 3 and TiN formed in the brazing of Si 3 N 4 . The presence of reaction layers at the C/M interface influences the interface strength in a complex way. In Cu/Al 2 O 3 , Co/Al 2 O 3 , Ni/Al 2 O 3 , and Cu/diamond systems, maxima of joint strength were observed at some intermediate Ti addition, while the flexural strength decreased substantially with the thickening of the TiO layer in a ZrO 2 /Ag-Cu-Sn-Ti system. Thus, composition of the braze alloy (particularly, the content of the active metal), process conditions such as brazing temperature and time, microstructure and mechanical properties of reaction products at the C/M interfaces, interfacial chemistry, and residual stress are primary factors to be studied in order to understand the strengths of the C/M interfaces systematically. In the present and the following papers, evolutions of interfacial microstructures at various brazing conditions, and corresponding interface strengths are reported, respectively, for a ZrO 2 /Ag-Cu-Al-Ti system

  20. Mechanical spectroscopy study of the Cu36Zr59Al5 and Cu54Zr40Al6 amorphous alloys

    Directory of Open Access Journals (Sweden)

    Paulo Wilmar Barbosa Marques

    2012-12-01

    Full Text Available A mechanical spectroscopy study of Cu-Zr-Al bulk metallic glasses, was performed with two types of equipment: a Kê-type inverted torsion pendulum and an acoustic elastometer, working in the frequency ranges of Hz and kHz, respectively, with a heating rate of 1 K/min. The analysis of the anelastic relaxation shows similar spectra for both types of equipment resulting in internal friction patterns that vary with temperature and are not reproducible at each thermal cycle. The normalized of the square of the frequency changes from the first to later measurement cycles. These results indicate that the specimens of Cu-Zr-Al alloys were changing by mechanical relaxation, owing to the motion of atoms or clusters in the glassy state and possible "defects" produced during the processing of alloys.

  1. Effect of ZnO, ZrO2 and B2O3 on clinkerization process. Part I. Clinkerization reactions and clinker composition

    Directory of Open Access Journals (Sweden)

    Palacios, M.

    2008-12-01

    Full Text Available The use of clay-based product waste as an alternative prime material in Portland cement raw mixes raises the ZnO, ZrO2 and B2O3 content in the clinker. These compounds are found in the enamelled surface of the tile added to the raw mix. The present study explores the effect of adding 0.5 and 2% ZnO, ZrO2 and B2O3 to the raw mix, separately and jointly, on clinkerization and the distribution and morphology of the mineral phases in the clinker. The findings showed that while ZnO and ZrO2 are fixed in the clinker, B2O3 is partially volatized. Zinc oxide acted as a flux, while neither ZrO2 nor B2O3 increased the molten phase. The addition of the oxides to the raw mix changed the content of the main mineral phases in the clinker. Zinc oxide lowered the C3S and C3A contents, ZrO2 reduced the ferritic phase and B2O3 stabilized C2S. New mineral phases, namely 3CaO·ZnO·2Al2O3 and CaZrO3, were identified in the clinkers obtained when 2% ZnO and ZrO2 were added to the raw mix.El empleo de residuos cerámicos como materia prima alternativa en la fabricación del crudo de cemento Portland, aumenta el contenido de ZnO, ZrO2 y B2O3 en el clinker. Estos elementos se encuentran en la capa esmaltada de los residuos cerámicos incorporados al crudo. Por ello el presente trabajo de investigación aborda el estudio del efecto que tiene la adición en el crudo de contenidos del 0,5 y 2% de ZnO, ZrO2 y B2O3 de manera individual y conjunta en los procesos de clinkerización, en la distribución y morfología de las fases mineralógicas del clinker.Los resultados obtenidos han demostrado que el ZnO y ZrO2 permanecen fijados en el clinker, sin embargo el B2O3 se volatiliza parcialmente. El ZnO actúa como fundente, mientras que el ZrO2 y el B2O3 no aumentan el contenido de fase fundida. La adición de estos óxidos al crudo modifica el contenido de las principales fases mineralógicas del clinker. El ZnO disminuye los contenidos de C3S y C3A, el ZrO2 disminuye

  2. Effects of interfacial layer on characteristics of TiN/ZrO2 structures.

    Science.gov (United States)

    Kim, Younsoo; Kang, Sang Yeol; Choi, Jae Hyoung; Lim, Jae Soon; Park, Min Young; Chung, Suk-Jin; Chung, Jaegwan; Lee, Hyung Ik; Kim, Ki Hong; Kyoung, Yong Koo; Heo, Sung; Yoo, Cha Young; Kang, Ho-Kyu

    2011-09-01

    To minimize the formation of unwanted interfacial layers, thin interfacial layer (ZrCN layer) was deposited between TiN bottom electrode and ZrO2 dielectric in TiN/ZrO2/TiN capacitor. Carbon and nitrogen were also involved in the layer because ZrCN layer was thermally deposited using TEMAZ without any reactant. Electrical characteristics of TiN/ZrO2/TiN capacitor were improved by insertion of ZrCN layer. The oxidation of TiN bottom electrode was largely inhibited at TiN/ZrCN/ZrO2 structure compared to TiN/ZrO2 structure. While the sheet resistance of TiN/ZrCN/ZrO2 structure was constantly sustained with increasing ZrO2 thickness, the large increase of sheet resistance was observed in TiN/ZrO2 structure after 6 nm ZrO2 deposition. When ZrO2 films were deposited on ZrCN layer, the deposition rate of ZrO2 also increased. It is believed that ZrCN layer acted both as a protection layer of TiN oxidation and a seed layer of ZrO2 growth.

  3. The role of Zr and T6 heat treatment on microstructure evolution and hardness of AlSi9Cu3(Fe diecasting alloy

    Directory of Open Access Journals (Sweden)

    Vončina M.

    2017-01-01

    Full Text Available The microstructure features and hardness of AlSi9Cu3(Fe die casting alloy was investigated in the presence of Zr addition. The cast alloys were undergone the solutionizing treatment 2 h at 500°C followed by artificial aging at 180°C for 5 h. Optical microscopy and electron micro-analyzer were used to study the formation of different intermetallic phases. The hardness was tested for all samples at 25°C. The results revealed that the intermetallic phase, based on (Al,Si(Zr,Ti, forms when Zr is added in the investigated alloy, while the T6 heat treatment does not influence on the formation of Zr-bearing phase. Results also indicate that the hardness slightly increases in the AlSi9Cu3 alloy in as-cast state when Zr is added, while after T6 heat treatment increases by 50% in the alloy without Zr and by 61% in the alloy with Zr addition.

  4. Local and average structures of 0.7Pb(Mg1/3Nb2/3)O3 - 0.3PbZrO3

    International Nuclear Information System (INIS)

    Krishna, P.S.R.; Shinde, A.B.; Narasimhan, S.L.; Tiwari, V.S.; Singh, G.

    2005-01-01

    The local and average structure of 0.7Pb(Mg 1/3 Nb 2/3 )O 3 - 0.3PbZrO 3 (PMN-PZ) was studied by neutron diffraction. The Rietveld refinement was carried out to determine the average, long-range crystallographic structure, while the pair density function (PDF) analysis was used in studying the local atomic structure. The local atomic structure determined by the PDF analysis, was found to be significantly different from the average crystallographic structure determined by the Rietveld analysis. These results show that the conflict between the local structural preference and the average structure is not limited to relax or ferroelectric oxides, but may be widely prevalent in mixed-ion ferroelectrics. (author)

  5. Structural Studies of dielectric HDPE+ZrO2 polymer nanocomposites: filler concentration dependences

    Science.gov (United States)

    Nabiyev, A. A.; Islamov, A. Kh; Maharramov, A. M.; Nuriyev, M. A.; Ismayilova, R. S.; Doroshkevic, A. S.; Pawlukojc, A.; Turchenko, V. A.; Olejniczak, A.; Rulev, M. İ.; Almasan, V.; Kuklin, A. I.

    2018-03-01

    Structural properties of HDPE+ZrO2 polymer nanocomposites thin films of 80-100μm thicknesses were investigated using SANS, XRD, Laser Raman and FTIR spectroscopy. The mass fraction of the filler was 1, 3, 10, and 20%. Results of XRD analysis showed that ZrO2 powder was crystallized both in monoclinic and in cubic phase under normal conditions. The percentages of monoclinic and cubic phase were found to be 99.8% and 0.2%, respectively. It was found that ZrO2 nanoparticles did not affect the main crystal and chemical structure of HDPE, but the degree of crystallinity of the polymer decreases with increasing concentration of zirconium oxide. SANS experiments showed that at ambient conditions ZrO2 nanoparticles mainly distributed like mono-particles in the polymer matrix at all concentrations of filler.The structure of HDPE+ZrO2 does not changes up to 132°C at 1-3% of filler, excepting changing of the polymer structure at temperatures upper 82°C. At high concentrations of filler 10-20% the aggregation of ZrO2 nanoparticles occurs, forming domains of 2.5μm. The results of Raman and FTIR spectroscopy did not show additional specific chemical bonds between the filler and the polymer matrix. New peaks formation was not observed. These results suggest that core-shell structure does not exist in the polymer nanocomposite system.

  6. Effect on Al:MO{sub 2}/In{sub 0.53}Ga{sub 0.47}As interface (M = Hf, Zr) of trimethyl-aluminum pre-treatment during atomic layer deposition

    Energy Technology Data Exchange (ETDEWEB)

    Lamperti, A., E-mail: alessio.lamperti@mdm.imm.cnr.it [Laboratorio MDM, IMM-CNR, via C. Olivetti 2, 20864 Agrate Brianza, MB (Italy); Molle, A.; Cianci, E.; Wiemer, C.; Spiga, S. [Laboratorio MDM, IMM-CNR, via C. Olivetti 2, 20864 Agrate Brianza, MB (Italy); Fanciulli, M. [Laboratorio MDM, IMM-CNR, via C. Olivetti 2, 20864 Agrate Brianza, MB (Italy); Dipartimento di Scienza dei Materiali, Università di Milano-Bicocca, Milano (Italy)

    2014-07-31

    For the fabrication of n-type metal–oxide–semiconductor field-effect transistor based on high mobility III–V compound semiconductors as channel materials, a major requirement is the integration of high quality gate oxides on top of the III–V substrates. A detailed knowledge of the interface between the oxide layer and the substrate is mandatory to assess the relevance of interdiffusion and related defects, which are detrimental. Here we grow high dielectric constant (k) Al:MO{sub 2} (M = Hf, Zr) gate materials on In{sub 0.53}Ga{sub 0.47}As substrates by atomic layer deposition, after an Al{sub 2}O{sub 3} pre-treatment based on trimethylaluminum is performed to properly passivate the substrate surface. Time of flight secondary ion mass spectrometry depth profiles reveal not only the film integrity and the chemical composition of the high-k oxide but also well elucidate the effect of the Al{sub 2}O{sub 3} pre-treatment on Al:MO{sub 2}/In{sub 0.53}Ga{sub 0.47}As interface. Even though the chemical profile is well defined in both cases, a broader interface is detected for Al:ZrO{sub 2}. X-ray photoemission spectroscopy evidenced the presence of As{sup 3+} states in Al:ZrO{sub 2} only. Accordingly, preliminary capacitance–voltage measurements point out to a better field effect modulation in the capacitor incorporating Al:HfO{sub 2}. Based on the above considerations Al:HfO{sub 2} looks as a preferred candidate with respect to Al:ZrO{sub 2} for the integration on top of In{sub 0.53}Ga{sub 0.47}As substrates. - Highlights: • Al:MO{sub 2} (M = Hf, Zr) thin films are grown on In{sub 0.53}Ga{sub 0.47}As substrates. • Trimethylaluminum (TMA) pre-treatment properly passivates the substrate surface. • ToF-SIMS depth profiles reveal the chemical composition of the high-k films. • Depth profiles well elucidate the effect of TMA on Al:MO{sub 2}/In{sub 0.53}Ga{sub 0.47}As substrates. • XPS evidences the presence of As{sup 3+} state in Al:ZrO{sub 2}/In{sub 0

  7. Microstructures and mechanical properties of grain refined Al-Li-Mg casting alloy by containing Zr and Ti

    International Nuclear Information System (INIS)

    Saikawa, Seiji; Nakai, Kiyoshi; Sugiura, Yasuo; Kamio, Akihiko.

    1995-01-01

    Mechanical properties and microstructures of various Al-Li-Mg alloy castings containing small amount of Zr and/or Ti were investigated. The δ(AlLi) phase was observed to crystallize in the dendrite-cell gaps as well as on the grain boundaries. Microsegregation of Mg also occurred in the solidified castings. The β(Al 3 Zr) or Al-Zr-Ti compounds crystallize during solidification and remain even after solid solution treatment at 803 K for 36 ks. The grain sizes of Al-2.5%Li-2%Mg alloy castings become finer by the addition of 0.15%Zr and 0.12%Ti compared with each addition of 0.15%Zr or 0.12%Ti. The age hardening is accelerated by the addition of 0.15%Zr. In an Al-2.5%Li-2%Mg-0.15%Zr-0.12%Ti alloy casting poured into a metallic mold and aged at 453 K for 36 ks, ultimate tensile strength, Young's modulus and density were 417 MPa, 80 GPa and was 2.52 g/cm 3 , respectively. Its specific strength and modulus are higher by 50.3 and 13.9% than those of the conventional AC4C-T6 casting. (author)

  8. Synthesis and structural characterization of the ternary Zintl phases AE3Al2Pn4 and AE3Ga2Pn4 (AE=Ca, Sr, Ba, Eu; Pn=P, As)

    International Nuclear Information System (INIS)

    He, Hua; Tyson, Chauntae; Saito, Maia; Bobev, Svilen

    2012-01-01

    Ten new ternary phosphides and arsenides with empirical formulae AE 3 Al 2 Pn 4 and AE 3 Ga 2 Pn 4 (AE=Ca, Sr, Ba, Eu; Pn=P, As) have been synthesized using molten Ga, Al, and Pb fluxes. They have been structurally characterized by single-crystal and powder X-ray diffraction to form with two different structures—Ca 3 Al 2 P 4 , Sr 3 Al 2 As 4 , Eu 3 Al 2 P 4 , Eu 3 Al 2 As 4 , Ca 3 Ga 2 P 4 , Sr 3 Ga 2 P 4 , Sr 3 Ga 2 As 4 , and Eu 3 Ga 2 As 4 crystallize with the Ca 3 Al 2 As 4 structure type (space group C2/c, Z=4); Ba 3 Al 2 P 4 and Ba 3 Al 2 As 4 adopt the Na 3 Fe 2 S 4 structure type (space group Pnma, Z=4). The polyanions in both structures are made up of TrPn 4 tetrahedra, which share common corners and edges to form 2 ∞ [TrPn 2 ] 3– layers in the phases with the Ca 3 Al 2 As 4 structure, and 1 ∞ [TrPn 2 ] 3– chains in Ba 3 Al 2 P 4 and Ba 3 Al 2 As 4 with the Na 3 Fe 2 S 4 structure type. The valence electron count for all of these compounds follows the Zintl–Klemm rules. Electronic band structure calculations confirm them to be semiconductors. - Graphical abstract: AE 3 Al 2 Pn 4 and AE 3 Ga 2 Pn 4 (AE=Ca, Sr, Ba, Eu; Pn=P, As) crystallize in two different structures—Ca 3 Al 2 P 4 , Sr 3 Al 2 As 4 , Eu 3 Al 2 P 4 , Eu 3 Al 2 As 4 , Ca 3 Ga 2 P 4 , Sr 3 Ga 2 P 4 , Sr 3 Ga 2 As 4 , and Eu 3 Ga 2 As 4 , are isotypic with the previously reported Ca 3 Al 2 As 4 (space group C2/c (No. 15)), while Ba 3 Al 2 P 4 and Ba 3 Al 2 As 4 adopt a different structure known for Na 3 Fe 2 S 4 (space group Pnma (No. 62). The polyanions in both structures are made up of TrPn 4 tetrahedra, which by sharing common corners and edges, form 2 ∞ [TrPn 2 ] 3– layers in the former and 1 ∞ [TrPn 2 ] 3– chains in Ba 3 Al 2 P 4 and Ba 3 Al 2 As 4 . Highlights: ► AE 3 Ga 2 Pn 4 (AE=Ca, Sr, Ba, Eu; Pn=P, As) are new ternary pnictides. ► Ba 3 Al 2 P 4 and Ba 3 Al 2 As 4 adopt the Na 3 Fe 2 S 4 structure type. ► The Sr- and Ca-compounds crystallize with the Ca 3

  9. Combustion synthesis of AlB2-Al2O3 composite powders with AlB2 nanowire structures

    Science.gov (United States)

    Yang, Pan; Xiao, Guoqing; Ding, Donghai; Ren, Yun; Yang, Shoulei; Lv, Lihua; Hou, Xing

    2018-05-01

    Using of Al and B2O3 powders as starting materials, and Mg-Al alloy as additives, AlB2-Al2O3 composite powders with AlB2 nanowire structures were successfully fabricated via combustion synthesis method in Ar atmosphere at a pressure of 1.5 MPa. The effect of different amount of Mg-Al alloy on the phase compositions and morphology of the combustion products was investigated. The results revealed that AlB2 and Al2O3 increased, whereas Al decreased with the content of Mg-Al alloy increasing. The impurities MgAl2O4 and AlB12 would exist in the sample with adding of 18 wt% Mg-Al alloy. Interestingly, FESEM/TEM/EDS results showed that AlB2 nanowires were observed in the products when the content of Mg-Al alloy is 6 wt% and 12 wt%. The more AlB2 nanowires can be found as the content of Mg-Al alloy increased. And the yield of AlB2 nanowires with the diameter of about 200 nanometers (nm) and the length up to several tens of micrometers (μm) in the combustion product is highest when the content of Mg-Al alloy is 12 wt%. The vapor, such as Mg-Al (g), B2O2 (g), AlO (g) and Al2O (g), produced during the process of combustion synthesis, reacted with each other to yield AlB2 nanowires by vapor-solid (VS) mechanism and the corresponding model was also proposed.

  10. The transition from amorphous to crystalline in Al/Zr multilayers

    International Nuclear Information System (INIS)

    Zhong Qi; Zhang Zhong; Ma Shuang; Qi Runze; Li Jia; Wang Zhanshan; Le Guen, Karine; André, Jean-Michel; Jonnard, Philippe

    2013-01-01

    The amorphous-to-crystalline transition in Al(1.0%wtSi)/Zr and Al(Pure)/Zr multilayers grown by direct-current magnetron sputtering system has been characterized over a range of Al layer thicknesses (1.0–5.0 nm) by using a series of complementary measurements including grazing incidence X-ray reflectometry, atomic force microscopy, X–ray diffraction, and high-resolution transmission electron microscopy. The Al layer thickness transition exhibits the Si doped in Al could not only disfavor the crystallization of Al but also influence the changing trends of surface roughness and diffraction peak position of phase Al . An interesting feature of the presence of Si in Al layer is that Si could influence the transition process in Al(1%wtSi) layer, in which the critical thickness (1.6 nm) of Al(Pure) layer in Al(Pure)/Zr shifts to 1.8 nm of Al(1.0%wtSi) layer in Al(1.0%wtSi)/Zr multilayer. We also found that the Zr-on-Al interlayer is wider than the Al-on-Zr interlayer in both systems, and the Al layers do not have specific crystal orientation in the directions vertical to the layer from selected area electron diffraction patterns below the thickness (3.0 nm) of Al layers. Above the thickness (3.0 nm) of Al layers, the Al layers are highly oriented in Al , so that the transformation from asymmetrical to symmetrical interlayers can be observed. Based on the analysis of all measurements, we build up a model with four steps, which could explain the Al layer thickness transition process in terms of a critical thickness for the nucleation of Al(Pure) and Al(1%wtSi) crystallites.

  11. Effect of Preparation Methods on Al2O3 Supported CuO-CeO2-ZrO2 Catalysts for CO Oxidation

    Directory of Open Access Journals (Sweden)

    Gaurav Rattan

    2012-12-01

    Full Text Available To examine the effect of preparation methods, four catalyst samples having same composition (CuCe5.17Zr3.83Ox/g-Al2O3 (15wt% were prepared by four different methods for CO oxidation. The catalysts were prepared by co-impregnation, citric acid sol-gel, urea nitrate combustion and urea gelation co-precipitation methods, and characterized by BET, XRD, TGA/DSC and SEM. The The air oxidation of CO was carried out in a tubular fixed bed reactor under the following operating conditions: catalyst weight - 100 mg, temperature - ambient to 250 oC, pressure - atmospheric, 2.5% CO in air, total feed rate - 60 ml/min.  It was observed that the catalytic activity greatly influenced by the preparation methods. The highest activity of the catalyst prepared by the sol gel method appeared to be associated with its largest BET surface area. All the four catalysts were active for CO oxidation and did not show deactivation of catalytic activity for 50 hours of continuous runs. The ranking order of the preparation methods of the catalyst is as follows: sol-gel > co-impregnation > urea gelation > urea nitrate combustion. Copyright © 2012 by BCREC UNDIP. All rights reservedReceived: 14th June 2012, Revised: 8th September 2012, Accepted: 19th September 2012[How to Cite: G. Rattan, R. Prasad, R.C.Katyal. (2012. Effect of Preparation Methods on Al2O3 Supported CuO-CeO2-ZrO2 Catalysts for CO Oxidation. Bulletin of Chemical Reaction Engineering & Catalysis, 7(2: 112-123. doi:10.9767/bcrec.7.2.3646.112-123] [How to Link / DOI: http://dx.doi.org/10.9767/bcrec.7.2.3646.112-123 ] | View in 

  12. Microstructure and crystallography of Al2O3-Y3Al5O12-ZrO2 ternary eutectic oxide grown by the micropulling down technique

    Science.gov (United States)

    Benamara, Omar; Cherif, Maya; Duffar, Thierry; Lebbou, Kheirreddine

    2015-11-01

    The directional solidification of Al2O3-YAG-ZrO2 eutectic ceramic by a micro-pulling down (μ-PD) technique is investigated. The effect of the pulling rate (0.1-1 mm min-1) on the crystallography and the microstructure is discussed. This ternary eutectic system has a Chinese script microstructure and the eutectic spacing λ depends on the pulling rate υ following the law: λ = 6.5υ-1/2 where λ is in μm and υ in μm/s as derived from the Jackson-Hunt model. With the lower pulling rates, all phases are oriented with the direction parallel to the growth direction; however other orientations appear at the higher pulling rates. The Cr3+ ions R-lines emission in the sapphire phase in the ternary eutectic composite is measured to estimate the stress in the alumina phase which is also shown to depend on the pulling rate.

  13. Electronic Structures and Bonding Properties of Ti2AlC and Ti3AlC2

    Institute of Scientific and Technical Information of China (English)

    MIN Xinmin; REN Yi

    2007-01-01

    The relation among electronic structure, chemical bond and property of Ti2AlC, Ti3AlC2 and doping Si into Ti2AlC was studied by density function and the discrete variation (DFT-DVM) method. After adding Si into Ti2AlC, the interaction between Si and Ti is weaker than that between Al and Ti, and the strengths of ionic and covalent bonds decrease both. The ionic and covalent bonds in Ti3AlC2, especially in Ti-Al, are stronger than those in Ti2AlC. Therefore, in synthesis of Ti2AlC, the addition of Si enhances the Ti3AlC2 content instead of Ti2AlC. The density of state (DOS) shows that there is mixed conductor characteristic in Ti2AlC and Ti3AlC2. The DOS of Ti3AlC2 is much like that of Ti2AlC. Ti2SixAl1-x C has more obvious tendency to form a semiconductor than Ti2AlC, which is seen from the obvious difference of partial DOS between Si and Al3p.

  14. Porosity and biocompatibility study of ceramic implants based on ZrO2 and Al2O3

    International Nuclear Information System (INIS)

    Litvinova, Larisa; Shupletsova, Valeria; Leitsin, Vladimir; Vasyliev, Roman; Zubov, Dmitry; Buyakov, Ales; Kulkov, Sergey

    2014-01-01

    The work studies ZrO 2 (Me x O y )-based porous ceramics produced from the powders consisting of hollow spherical particles. It was shown that the structure is represented by a cellular framework with bimodal porosity consisting of sphere-like large pores and pores that were not filled with the powder particles during the compaction. For such ceramics, the increase of pore volume is accompanied by the increased strain in an elastic area. It was also shown that the porous ZrO 2 ceramics had no acute or chronic cytotoxicity. At the same time, ceramics possess the following osteoconductive properties: adhesion support, spreading, proliferation and osteogenic differentiation of MSCs

  15. Influence of Sc on microstructure and mechanical properties of Al-Si-Mg-Cu-Zr alloy

    Science.gov (United States)

    Li, Yukun; Du, Xiaodong; Zhang, Ya; Zhang, Zhen; Fu, Junwei; Zhou, Shi'ang; Wu, Yucheng

    2018-02-01

    In the present study, the effects of Mg, Cu, Sc and Zr combined additions on the microstructure and mechanical properties of hypoeutectic Al-Si cast alloy were systematically investigated. Characterization techniques such as optical microscopy (OM), scanning electron microscope (SEM), energy dispersive spectrometer (EDS), electron back-scatter diffraction (EBSD), atomic force microscopy (AFM), transmission electron microscope (TEM), Brinell hardness tester and universal testing machine were employed to analyze the microstructure and mechanical properties. The results showed that Sc served as modifier on the microstructure of Al-3Si-0.45Mg-0.45Cu-0.2Zr alloys, including modification of eutectic Si and grains. Extraordinarily, grain refinement was found to be related to the primary particles, which exhibited a close orientation to matrix. After T6 heat treatment, the grain structures were composed of nano-scaled secondary Al3(Sc, Zr) precipitates and spherical eutectic Si. Combined with T6 heat treatment, the highest hardness, yield strength, ultimate tensile strength and elongation were achieved in 0.56 wt.% Sc-modified alloy. Interestingly, the strength and ductility had a similar tendency. This paper demonstrated that combined additions of Mg, Cu, Sc and Zr could significantly improve the microstructure and performance of the hypoeutectic Al-Si cast alloy.

  16. Impact of post-deposition annealing on interfacial chemical bonding states between AlGaN and ZrO2 grown by atomic layer deposition

    International Nuclear Information System (INIS)

    Ye, Gang; Arulkumaran, Subramaniam; Ng, Geok Ing; Li, Yang; Ang, Kian Siong; Wang, Hong; Ng, Serene Lay Geok; Ji, Rong; Liu, Zhi Hong

    2015-01-01

    The effect of post-deposition annealing on chemical bonding states at interface between Al 0.5 Ga 0.5 N and ZrO 2 grown by atomic layer deposition (ALD) is studied by angle-resolved x-ray photoelectron spectroscopy and high-resolution transmission electron microscopy. It has been found that both of Al-O/Al 2p and Ga-O/Ga 3d area ratio decrease at annealing temperatures lower than 500 °C, which could be attributed to “clean up” effect of ALD-ZrO 2 on AlGaN. Compared to Ga spectra, a much larger decrease in Al-O/Al 2p ratio at a smaller take-off angle θ is observed, which indicates higher effectiveness of the passivation of Al-O bond than Ga-O bond through “clean up” effect near the interface. However, degradation of ZrO 2 /AlGaN interface quality due to re-oxidation at higher annealing temperature (>500 °C) is also found. The XPS spectra clearly reveal that Al atoms at ZrO 2 /AlGaN interface are easier to get oxidized as compared with Ga atoms

  17. Superstructure formation in PrNi{sub 2}Al{sub 3} and ErPd{sub 2}Al{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Eustermann, Fabian; Hoffmann, Rolf-Dieter [Muenster Univ. (Germany). Inst. fuer Anorganische und Analytische Chemie; Janka, Oliver [Muenster Univ. (Germany). Inst. fuer Anorganische und Analytische Chemie; Oldenburg Univ. (Germany). Inst. fuer Chemie

    2017-09-01

    The intermetallic phase ErPd{sub 2}Al{sub 3} was obtained by arc-melting of the elements and subsequent annealing for crystal growth. The sample was studied by X-ray diffraction on powders and single crystals. The structure of ErPd{sub 2}Al{sub 3} was refined from X-ray diffraction data and revealed a superstructure of PrNi{sub 2}Al{sub 3} - a CaCu{sub 5} derivative (P6/m, a=1414.3(1), c=418.87(3) pm wR=0.0820, 1060 F{sup 2} values, 48 variables). The same superstructure was subsequently found for PrNi{sub 2}Al{sub 3} (P6/m, a=1407.87(4), c=406.19(2) pm, wR=0.0499, 904 F{sup 2} values, 47 variables). In the crystal structure, the aluminium and transition metal atoms form a polyanionic network according to [T{sub 2}Al{sub 3}]{sup δ-}, while rare earth atoms fill cavities within the networks. They are coordinated by six transition metal and twelve aluminum atoms. In contrast to the PrNi{sub 2}Al{sub 3} type structure reported so far, two crystallographic independent rare-earth sites are found of which one (1b) is shifted by 1/2 z, causing a distortion in the structure along with a recoloring of the T and Al atoms in the network.

  18. Ternary semiconductors NiZrSn and CoZrBi with half-Heusler structure: A first-principles study

    Science.gov (United States)

    Fiedler, Gregor; Kratzer, Peter

    2016-08-01

    The ternary semiconductors NiZrSn and CoZrBi with C 1b crystal structure are introduced by calculating their basic structural, electronic, and phononic properties using density functional theory. Both the gradient-corrected PBE functional and the hybrid functional HSE06 are employed. While NiZrSn is found to be a small-band-gap semiconductor (Eg=0.46 eV in PBE and 0.60 eV in HSE06), CoZrBi has a band gap of 1.01 eV in PBE (1.34 eV in HSE06). Moreover, effective masses and deformation potentials are reported. In both materials A B C , the intrinsic point defects introduced by species A (Ni or Co) are calculated. The Co-induced defects in CoZrBi are found to have a higher formation energy compared to Ni-induced defects in NiZrSn. The interstitial Ni atom (Nii) as well as the VNiNii complex introduce defect states in the band gap, whereas the Ni vacancy (VNi) only reduces the size of the band gap. While Nii is electrically active and may act as a donor, the other two types of defects may compensate extrinsic doping. In CoZrBi, only the VCoCoi complex introduces a defect state in the band gap. Motivated by the reported use of NiZrSn for thermoelectric applications, the Seebeck coefficient of both materials, both in the p -type and the n -type regimes, is calculated. We find that CoZrBi displays a rather large thermopower of up to 500 μ V /K when p doped, whereas NiZrSn possesses its maximum thermopower in the n -type regime. The reported difficulties in achieving p -type doping in NiZrSn could be rationalized by the unintended formation of Nii2 + in conjunction with extrinsic acceptors, resulting in their compensation. Moreover, it is found that all types of defects considered, when present in concentrations as large as 3%, tend to reduce the thermopower compared to ideal bulk crystals at T =600 K. For NiZrSn, the calculated thermodynamic data suggest that additional Ni impurities could be removed by annealing, leading to precipitation of a metallic Ni2ZrSn phase.

  19. Synthesis, crystal structure and spectroscopy properties of Na 3AZr(PO 4) 3 ( A=Mg, Ni) and Li 2.6Na 0.4NiZr(PO 4) 3 phosphates

    Science.gov (United States)

    Chakir, M.; El Jazouli, A.; de Waal, D.

    2006-06-01

    Na 3AZr(PO 4) 3 ( A=Mg, Ni) phosphates were prepared at 750 °C by coprecipitation route. Their crystal structures have been refined at room temperature from X-ray powder diffraction data using Rietveld method. Li 2.6Na 0.4NiZr(PO 4) 3 was synthesized through ion exchange from the sodium analog. These materials belong to the Nasicon-type structure. Raman spectra of Na 3AZr(PO 4) 3 ( A=Mg, Ni) phosphates present broad peaks in favor of the statistical distribution in the sites around PO 4 tetrahedra. Diffuse reflectance spectra indicate the presence of octahedrally coordinated Ni 2+ ions.

  20. Moessbauer and transport studies of amorphous and icosahedral Zr-Ni-Cu-Ag-Al alloys

    International Nuclear Information System (INIS)

    Stadnik, Z.M.; Rapp, O.; Srinivas, V.; Saida, J.; Inoue, A.

    2002-01-01

    The alloy Zr 65 Al 7.5 Ni 10 Cu 7.3 Fe 0.2 Ag 10 in the amorphous and icosahedral states, and the bulk amorphous alloy Zr 65 Al 7.5 Ni 10 Cu 7.5 Ag 10 , have been studied with 57 Fe Moessbauer spectroscopy, electrical resistance and magnetoresistance techniques. The average quadrupole splitting in both alloys decreases with temperature as T 3/2 . The average quadrupole splitting in the icosahedral alloy is the largest ever reported for a metallic system. The lattice vibrations of the Fe atoms in the amorphous and icosahedral alloys are well described by a simple Debye model, with the characteristic Moessbauer temperatures of 379(29) and 439(28) K, respectively. Amorphous alloys Zr 65 Al 7. )5Ni 10 Cu 7.5 Ag 10 and Zr 65 Al 7.5 Ni 10 Cu 7.3 Fe 0.2 Ag 10 have been found to be superconducting with the transition temperature, T c , of about 1.7 K. The magnitude of Tc and the critical field slope at Tc are in agreement with previous work on Zr-based amorphous superconductors, while the low-temperature normal state resistivity is larger than typical results for binary and ternary Zr-based alloys. The resistivity of icosahedral Zr 65 Al 7.5 Ni 10 Cu 7.3 Fe 0.2 Ag 10 is larger than that for the amorphous ribbon of the same composition, as inferred both from direct measurements on the ribbons and from the observed magnetoresistance. However the icosahedral sample is non-superconducting in the measurement range down to 1.5 K. The results for the resistivity and the superconducting T c both suggest a stronger electronic disorder in the icosahedral phase than in the amorphous phase. (author)

  1. Improving the tribocorrosion resistance of Ti6Al4V surface by laser surface cladding with TiNiZrO2 composite coating

    International Nuclear Information System (INIS)

    Obadele, Babatunde Abiodun; Andrews, Anthony; Mathew, Mathew T.; Olubambi, Peter Apata; Pityana, Sisa

    2015-01-01

    Highlights: • The tribocorrosion behaviour of TiNiZrO 2 composite is investigated. • The effect of ZrO 2 on the microstructure is discussed. • The effect of the combined action of wear and chemical process is reported. • ZrO 2 addition improved the tribocorrosion property of Ti6Al4V. - Abstract: Ti6Al4V alloy was laser cladded with titanium, nickel and zirconia powders in different ratio using a 2 kW CW ytterbium laser system (YLS). The microstructures of the cladded layers were examined using field emission scanning electron microscopy (FESEM) equipped with energy dispersive X-ray spectroscopy (EDS) and X-ray diffractometry (XRD). Corrosion and tribocorrosion tests were performed on the cladded surface in 1 M H 2 SO 4 solution. The microstructure revealed the transformation from a dense dendritic structure in TiNi coating to a flower-like structure observed in TiNiZrO 2 cladded layers. There was a significant increase in surface microindentation hardness values of the cladded layers due to the present of hard phase ZrO 2 particles. The results obtained show that addition of ZrO 2 improves the corrosion resistance property of TiNi coating but decrease the tribocorrosion resistance property. The surface hardening effect induced by ZrO 2 addition, combination of high hardness of Ti 2 Ni phase could be responsible for the mechanical degradation and chemical wear under sliding conditions

  2. High-pressure x-ray diffraction of icosahedral Zr-Al-Ni-Cu-Ag quasicrystals

    DEFF Research Database (Denmark)

    Jiang, Jianzhong; Saksl, Karel; Rasmussen, Helge Kildahl

    2001-01-01

    temperature using synchrotron radiation. The icosahedral quasicrystal structure is retained up to the highest hydrostatic pressure used (approximately 28 GPa) and is reversible after decompression. The bulk modulus at zero pressure and its pressure derivative of the icosahedral Zr-Al-Ni-Cu-Ag quasicrystal......The effect of pressure on the structural stability of icosahedral Zr-Al-Ni-Cu-Ag quasicrystals forming from a Zr65Al7.5Ni10Cu7.5Ag10 metallic glass with a supercooled liquid region of 44 K has been investigated by in situ high-pressure angle-dispersive x-ray powder diffraction at ambient......-Al-Ni-Cu-Ag quasicrystals induced by pressure....

  3. Zr 2Ir 6B with an eightfold superstructure of the cubic perovskite-like boride ZrIr 3B 0.5: Synthesis, crystal structure and bonding analysis

    Science.gov (United States)

    Hermus, Martin; Fokwa, Boniface P. T.

    2010-04-01

    Single phase powder samples and single crystals of Zr 2Ir 6B were successfully synthesized by arc-melting the elements in a water-cooled copper crucible under an argon atmosphere. Superstructure reflections were observed both on powder and on single crystal diffraction data, leading to an eightfold superstructure of ZrIr 3B x phase. The new phase, which has a metallic luster, crystallizes in space group Fm3¯m (no. 225) with the lattice parameters a=7.9903(4) Å, V=510.14(4) Å 3. Its crystal structure was refined on the basis of powder as well as single crystal data. The single crystal refinement converged to R1=0.0239 and w R2=0.0624 for all 88 unique reflections and 6 parameters. Zr 2Ir 6B is isotypic to Ti 2Rh 6B and its structure can be described as a defect double perovskite, A2BB' O6, where the A site is occupied by zirconium, the B site by boron, the O site by iridium but the B' site is vacant, leading to the formation of empty and boron-filled octahedral Ir 6 clusters. According to the result of tight-binding electronic structure calculations, Ir-B and Ir-Zr interactions are mainly responsible for the structural stability of the phase. According to COHP bonding analysis, the strongest bonding occurs for the Ir-B contacts, and the Ir-Ir bonding within the empty clusters is two times stronger than that in the BIr 6 octahedra.

  4. Partial oxidation of dimethyl ether using the structured catalyst Rh/Al2O3/Al prepared through the anodic oxidation of aluminum.

    Science.gov (United States)

    Yu, B Y; Lee, K H; Kim, K; Byun, D J; Ha, H P; Byun, J Y

    2011-07-01

    The partial oxidation of dimethyl ether (DME) was investigated using the structured catalyst Rh/Al2O3/Al. The porous Al2O3 layer was synthesized on the aluminum plate through anodic oxidation in an oxalic-acid solution. It was observed that about 20 nm nanopores were well developed in the Al2O3 layer. The thickness of Al2O3 layer can be adjusted by controlling the anodizing time and current density. After pore-widening and hot-water treatment, the Al2O3/Al plate was calcined at 500 degrees C for 3 h. The obtained delta-Al2O3 had a specific surface area of 160 m2/g, making it fit to be used as a catalyst support. A microchannel reactor was designed and fabricated to evaluate the catalytic activity of Rh/Al2O3/Al in the partial oxidation of DME. The structured catalyst showed an 86% maximum hydrogen yield at 450 degrees C. On the other hand, the maximum syngas yield by a pack-bed-type catalyst could be attained by using a more than fivefold Rh amount compared to that used in the structured Rh/Al2O3/Al catalyst.

  5. Effects of ZrB{sub 2} on substructure and wear properties of laser melted in situ ZrB{sub 2p}/6061Al composites

    Energy Technology Data Exchange (ETDEWEB)

    Zeng, Yida [School of Material Science and Engineering, Tianjin University, Tianjin 300072 (China); State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Chao, Yuhjin [School of Material Science and Engineering, Tianjin University, Tianjin 300072 (China); Department of Mechanical Engineering, University of South Carolina, Columbia, SC 29208 (United States); Luo, Zhen, E-mail: lz@tju.edu.cn [School of Material Science and Engineering, Tianjin University, Tianjin 300072 (China); State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Cai, Yangchuan [School of Material Science and Engineering, Tianjin University, Tianjin 300072 (China); State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Huang, Yongxian [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China)

    2016-03-01

    Graphical abstract: - Highlights: • Laser beam partly disperses ZrB{sub 2} particle clusters and showing dispersed particles state after matrix solidification. • Laser melting process narrower cellular spacing in composites than AA6061 matrix. • Compared with matrix alloy, crystal orientation near melted layer edge of the composites is almost random duo to heterogeneous nucleation in melt and pinning effect of laser dispersed ZrB{sub 2} nanoparticles at solidification front. • Laser melted layer shows better wear properties than matrix and composite without laser melting. - Abstract: Aluminum matrix composites reinforced by in situ ZrB{sub 2} particles were successfully fabricated from an Al-KBF{sub 4}-K{sub 2}ZrF{sub 6} system via a direct melt reaction. A laser surface melting strategy is used to improve the surface strength of the in situ ZrB{sub 2p}/6061Al composite, which includes a series of laser-melted composites with different laser power processed by a 2 kW YAG laser generator. XRD and EDS results demonstrated the existence of ZrB{sub 2} nanoparticles in the composite. After laser melting, the penetration depth of the molten pool increases with increasing power density. OM and SEM analysis indicate that the laser melting process yields narrower cellular spacing of the matrix and partly disperses the ZrB{sub 2} particle clusters. Compared with laser-melted matrix alloys, the crystal orientations near the melted layers edge of the composite are almost random due to heterogeneous nucleation in the melt and the pinning effect of laser-dispersed ZrB{sub 2} nanoparticles at the solidification front. Wear test results show that the laser melted layer performs better at wear resistance than both the substrate and the matrix AA6061 by measuring wear mass loss. Compared with composite samples prepared without laser melting, the wear mass loss of the laser melted composites decreased from 61 to 56 mg under a load of 98 N for 60 min.

  6. Dynamic grain growth in superplastic Y-TZP and Al2O3/YTZ

    International Nuclear Information System (INIS)

    Nieh, T.G.; Tomasello, C.M.; Wadsworth, J.

    1990-01-01

    This paper reports that both static and dynamic grain growth have been studied during superplastic deformation of fine-grained yttria-stabilized tetragonal zirconia (Y-TZP) and alumina reinforced yttria-stabilized tetragonal zirconia (Al 2 O 3 /YTZ). Grain growth was observed in both materials at temperatures above 1350 degrees C. In the case of Y-TZP, both static and dynamic grain growth were found to obey a similar equation of the form: D 3 -D 0 3 = kt where D is the instantaneous grain size, D 0 is the initial grain size, t is the time, and k is a kinetic constant which depends primarily on temperature and grain boundary energy. The activation energies for Y-TZP were approximately 580 and 520 kJ/mol, for static and dynamic grain growth, respectively. In the case of Al 2 O 3 /YTZ, it was found that the grain growth rate for the Al 2 O 3 phase was slower than that for the ZrO 2 phase. The growth rate of the ZrO 2 phase in Al 2 O 3 /YTZ is, however, similar to that in monolithic ZrO 2 i.e., Y-TZP

  7. Interface formation and defect structures in epitaxial La2Zr2O7 thin films on (111) Si

    International Nuclear Information System (INIS)

    Seo, J.W.; Fompeyrine, J.; Guiller, A.; Norga, G.; Marchiori, C.; Siegwart, H.; Locquet, J.-P.

    2003-01-01

    We have studied the growth of epitaxial La 2 Zr 2 O 7 thin films on (111) Si. Although the interface structure can be strongly affected by the Si oxidation during the deposition process, epitaxial growth of La 2 Zr 2 O 7 was obtained. A detailed study by means of transmission electron microscopy reveals two types of structures (pyrochlore and fluorite) with the same average chemical composition but strong differences in reactivity and interface formation. The structural complexity of the ordered pyrochlore structure seems to prevent excess oxygen diffusion and interfacial SiO 2 formation

  8. Electric Properties of Pb(Sb1/2Nb1/2)O3 PbTiO3 PbZrO3 Ceramics

    Science.gov (United States)

    Kawamura, Yasushi; Ohuchi, Hiromu

    1994-09-01

    Solid-solution ceramics of ternary system xPb(Sb1/2Nb1/2)O3 yPbTiO3 zPbZrO3 were prepared by the solid-state reaction of powder materials. Ceramic, electric, dielectric and piezoelectric properties and crystal structures of the system were studied. Sintering of the system xPb(Sb1/2Nb1/2)O3 yPbTiO3 zPbZrO3 is much easier than that of each end composition, and well-sintered high-density ceramics were obtained for the compositions near the morphotropic transformation. Piezoelectric ceramics with high relative dielectric constants, high radial coupling coefficient and low resonant resistance were obtained for the composition near the morphotropic transformation. The composition Pb(Sb1/2Nb1/2)0.075Ti0.45Zr0.475O3 showed the highest dielectric constant (ɛr=1690), and the composition Pb(Sb1/2Nb1/2)0.05Ti0.45Zr0.5O3 showed the highest radial coupling coefficient (kp=64%).

  9. Magnesium hexafluoridozirconates MgZrF{sub 6}.5H{sub 2}O, MgZrF{sub 6}.2H{sub 2}O, and MgZrF{sub 6}. Structures, phase transitions, and internal mobility of water molecules

    Energy Technology Data Exchange (ETDEWEB)

    Gerasimenko, Andrey V.; Gaivoronskaya, Kseniya A.; Slobodyuk, Arseny B.; Didenko, Nina A. [Institute of Chemistry, Russian Academy of Sciences, Vladivostok (Russian Federation)

    2017-12-04

    The MgZrF{sub 6}.nH{sub 2}O (n = 5, 2 and 0) compounds were studied by the methods of X-ray diffraction and {sup 19}F, MAS {sup 19}F, and {sup 1}H NMR spectroscopy. At room temperature, the compound MgZrF{sub 6}.5H{sub 2}O has a monoclinic C-centered unit cell and is composed of isolated chains of edge-sharing ZrF{sub 8} dodecahedra reinforced with MgF{sub 2}(H{sub 2}O){sub 4} octahedra and uncoordinated H{sub 2}O molecules and characterized by a disordered system of hydrogen bonds. In the temperature range 259 to 255 K, a reversible monoclinic <-> two-domain triclinic phase transition is observed. The phase transition is accompanied with ordering of hydrogen atoms positions and the system of hydrogen bonds. The structure of MgZrF{sub 6}.2H{sub 2}O comprises a three-dimensional framework consisting of chains of edge-sharing ZrF{sub 8} dodecahedra linked to each other through MgF{sub 4}(H{sub 2}O){sub 2} octahedra. The compound MgZrF{sub 6} belongs to the NaSbF{sub 6} type and is built from regular ZrF{sub 6} and MgF{sub 6} octahedra linked into a three-dimensional framework through linear Zr-F-Mg bridges. The peaks in {sup 19}F MAS spectra were attributed to the fluorine structural positions. The motions of structural water molecules were studied by variable-temperature {sup 1}H NMR spectroscopy. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  10. Time-temperature-transformation diagram of Zr-based Zr-Al-Cu-Ni metallic glasses

    International Nuclear Information System (INIS)

    Goh, T.T.; Li, Y.; Ng, S.C.

    1996-01-01

    The critical cooling rates R c for glass formation in four Zr-based Zr-Al-Cu-Ni alloys were determined using techniques developed by Uhlmann based on theories of homogeneous nucleation, crystal growth and transformation kinetics. It involves the construction of a time-temperature-transformation curve which requires the knowledge of the viscosity-temperature curve of the alloys. Two types of viscosity-temperature expressions, namely Andrade expression and Doolittle expression, were used to model the viscosity of the Zr-based alloys and the choice of the viscosity-temperature expression which gives the best estimate of the calculated time-temperature-transformation curve is discussed. (author)

  11. Pengaruh komposisi komposit al2o3/ysz dan variasi feed rate terhadap ketahanan termal dan kekuatan lekat pada Ysz-al2o3/ysz double layer tbc

    Directory of Open Access Journals (Sweden)

    Parindra Kusriantoko

    2014-03-01

    Full Text Available TBC (Thermal Barrier Coating dengan YSZ-Al2O3/YSZ top coat (TCdan MCrAlY sebagai bond coat (BC yang selanjutnya disebut sebagai YSZ-Al2O3/YSZ double layer TBC dibuat dengan menggunakan metode flame spray.Hasil pelapisan sebelum dan sesudah diuji termal dikarakterisasi menggunakan SEM, EDX dan XRD.Dari hasil penelitian didapatkan bahwa semakin tinggi powder feed rate akan berpengaruh pada morfologi permukaan lapisan. Feed rate makin rendah menyebabkan struktur yang cenderung kasar dan tidak padat dan cenderung berporos. Lapisan komposit Al2O3/YSZ juga sangat berpengaruh pada pertumbuhan TGO (Thermally Grown Oxide setelah dilakukan uji termal, dimana komposisi paling bagus dengan pertumbuhan TGO paling rendah adalah 15%Al2O3/8YSZ. Hasil pengujian TGA menunjukkan semua sampel mulai teroksidasi pada temperatur 1000-1030oC dan didapatkan sampel paling stabil adalah 15% Al2O3/8YSZ 14 dan 20 gr/min. Dari pengujian XRD sampel yang memiliki fasa yang paling stabil adalah 15%Al2O3/8YSZ dengan fasa t-ZrO2 dan m-ZrO2. Dari pengujian Thermal Torch dan Pull Off komposisi 15%Al2O3/8YSZjuga memiliki ketahanan terhadap pengerusakan yang paling baik dan kelekatan yang baik sebesar 10 MPa.

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

    Science.gov (United States)

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

    2015-07-01

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

  13. Crystallization behavior of Zr62Al8Ni13Cu17 Metallic Glass

    Directory of Open Access Journals (Sweden)

    Jo Mi Sun

    2017-06-01

    Full Text Available The crystallization behavior has been studied in Zr62Al8Ni13Cu17 metallic glass alloy. The Zr62Al8Ni13Cu17 metallic glass crystallized through two steps. The fcc Zr2Ni phase transformed from the amorphous matrix during first crystallization and then the Zr2Ni and residual amorphous matrix transformed into a mixture of tetragonal Zr2Cu and hexagonal Zr6Al2Ni phases. Johnson-Mehl-Avrami analysis of isothermal transformation data suggested that the formation of crystalline phase is primary crystallization by diffusion-controlled growth.

  14. Tribological behaviour at high temperature of hard CrAlN coatings doped with Y or Zr

    International Nuclear Information System (INIS)

    Sánchez-López, J.C.; Contreras, A.; Domínguez-Meister, S.; García-Luis, A.; Brizuela, M.

    2014-01-01

    The tribological properties of CrAlN, CrAlYN and CrAlZrN coatings deposited by direct current reactive magnetron sputtering are studied by means of pin-on-disc experiments at room temperature, 300, 500 and 650 °C using alumina balls as counterparts. The influence of the metallic composition (Al, Y and Zr) on the friction, wear properties and oxidation resistance is studied by means of scanning electron microscopy, energy dispersive X-ray analysis and Raman analysis of the contact region after the friction tests. The results obtained allow us to classify the tribological behaviour of the CrAl(Y,Zr)N coatings into three groups according to the nature of the dopant and aluminium content. The sliding wear mechanism is characterized by the formation of an overcoat rich in chromium and aluminium oxides whose particular composition is determined by the initial chemical characteristics of the coating and the testing temperature. The fraction of Cr 2 O 3 becomes more significant as the Al content decreases and the temperature increases. The addition of Y, and particularly Zr, favours the preferential formation of Cr 2 O 3 versus CrO 2 leading to a reduction of friction and wear of the counterpart. Conversely, the tribological behaviour of pure CrAlN coatings is characterized by higher friction but lower film wear rates as a result of higher hardness and major presence of aluminium oxides on the coating surface. - Highlights: • Comparative tribological study at high temperature of CrAlN, CrAlYN and CrAlZrN films • Fraction of Cr 2 O 3 raises as the Al content decreases and the temperature increases. • Zr doping favours lower and steady friction coefficient due to higher Cr 2 O 3 formation. • Sliding wear mechanism becomes predominantly abrasive as the Al content increases. • Excellent tribological performance of CrAlN doped with low Y contents (≈ 2 at.%)

  15. First-principles molecular dynamics investigation of thermal and mechanical stability of the TiN(001)/AlN and ZrN(001)/AlN heterostructures

    International Nuclear Information System (INIS)

    Ivashchenko, V.I.; Veprek, S.; Turchi, P.E.A.; Shevchenko, V.I.; Leszczynski, J.; Gorb, L.; Hill, F.

    2014-01-01

    First-principles quantum molecular dynamics investigations of TiN(001)/AlN and ZrN(001)/AlN heterostructures with one and two monolayers (1 ML and 2 ML) of AlN interfacial layers were carried out in the temperature range of 0–1400 K with subsequent static relaxation. It is shown that the epitaxially stabilized cubic B1-AlN interfacial layers are preserved in all TiN(001)/AlN heterostructures over the whole temperature range. In the ZrN(001)/AlN heterostructures, the B1-AlN(001) interfacial layer exists at 0 K, but it transforms into a distorted one at 10 K consisting of tetrahedral AlN 4 , octahedral AlN 6 , and AlN 5 units. The thermal stability of the interfaces was investigated by studying the phonon dynamic stability of the B1-AlN phase with different lattice parameters. The calculations showed that the B1-AlN interface should be unstable in ZrN(001)/AlN heterostructures and nanocomposites, and in those based on transition metal nitrides with lattice parameters larger than 4.4 Å. Electronic band structure calculations showed that energy gap forms around the Fermi energy for all interfaces. The formation of the interfacial AlN layer in TiN and ZrN crystals reduces their ideal tensile and shear strengths. Upon tensile load, decohesion occurs between Ti (Zr) and N atoms adjacent to the 1 ML AlN interfacial layer, whereas in the case of 2 ML AlN it occurs inside the TiN and ZrN slabs. The experimentally reported strength enhancement in the TiN/AlN and ZrN/AlN heterostructures is attributed to impeding effect of the interfacial layer on the plastic flow. - Highlights: • First-principles quantum molecular dynamics studies were conducted. • TiN- and ZrN-based heterostructures with one and two AlN interfacial layers. • Stability and structural transformation between 0 and 1400 K have been calculated. • Stress–strain relationships and ideal strengths determined. • Systems which may form stable superhard heterostructures are identified

  16. First-principles molecular dynamics investigation of thermal and mechanical stability of the TiN(001)/AlN and ZrN(001)/AlN heterostructures

    Energy Technology Data Exchange (ETDEWEB)

    Ivashchenko, V.I., E-mail: ivash@ipms.kiev.ua [Institute of Problems of Material Science, National Academy of Science of Ukraine, Krzhyzhanosky str. 3, 03142 Kyiv (Ukraine); Veprek, S., E-mail: stan.veprek@lrz.tum.de [Department of Chemistry, Technical University Munich, Lichtenbergstrasse 4, D-85747 Garching (Germany); Turchi, P.E.A. [Lawrence Livermore National Laboratory (L-352), P.O. Box 808, Livermore, CA 94551 (United States); Shevchenko, V.I. [Institute of Problems of Material Science, National Academy of Science of Ukraine, Krzhyzhanosky str. 3, 03142 Kyiv (Ukraine); Leszczynski, J. [Department of Chemistry and Biochemistry, Interdisciplinary Center for Nanotoxicity, Jackson State University, Jackson, MS 39217 (United States); Gorb, L. [Department of Chemistry and Biochemistry, Interdisciplinary Center for Nanotoxicity, Jackson State University, Jackson, MS 39217 (United States); U.S. Army ERDC, Vicksburg, MS 39180 (United States); Hill, F. [U.S. Army ERDC, Vicksburg, MS 39180 (United States)

    2014-08-01

    First-principles quantum molecular dynamics investigations of TiN(001)/AlN and ZrN(001)/AlN heterostructures with one and two monolayers (1 ML and 2 ML) of AlN interfacial layers were carried out in the temperature range of 0–1400 K with subsequent static relaxation. It is shown that the epitaxially stabilized cubic B1-AlN interfacial layers are preserved in all TiN(001)/AlN heterostructures over the whole temperature range. In the ZrN(001)/AlN heterostructures, the B1-AlN(001) interfacial layer exists at 0 K, but it transforms into a distorted one at 10 K consisting of tetrahedral AlN{sub 4}, octahedral AlN{sub 6}, and AlN{sub 5} units. The thermal stability of the interfaces was investigated by studying the phonon dynamic stability of the B1-AlN phase with different lattice parameters. The calculations showed that the B1-AlN interface should be unstable in ZrN(001)/AlN heterostructures and nanocomposites, and in those based on transition metal nitrides with lattice parameters larger than 4.4 Å. Electronic band structure calculations showed that energy gap forms around the Fermi energy for all interfaces. The formation of the interfacial AlN layer in TiN and ZrN crystals reduces their ideal tensile and shear strengths. Upon tensile load, decohesion occurs between Ti (Zr) and N atoms adjacent to the 1 ML AlN interfacial layer, whereas in the case of 2 ML AlN it occurs inside the TiN and ZrN slabs. The experimentally reported strength enhancement in the TiN/AlN and ZrN/AlN heterostructures is attributed to impeding effect of the interfacial layer on the plastic flow. - Highlights: • First-principles quantum molecular dynamics studies were conducted. • TiN- and ZrN-based heterostructures with one and two AlN interfacial layers. • Stability and structural transformation between 0 and 1400 K have been calculated. • Stress–strain relationships and ideal strengths determined. • Systems which may form stable superhard heterostructures are identified.

  17. Study of Pt–Rh/CeO2ZrO2–MxOy (M = Y, La)/Al2O3 three-way catalysts

    International Nuclear Information System (INIS)

    Jiaxiu, Guo; Zhonghua, Shi; Dongdong, Wu; Huaqiang, Yin; Maochu, Gong; Yaoqiang, Chen

    2013-01-01

    CeO 2ZrO 2 –M x O y (M = Y; La) mixed oxides, prepared by co-precipitation method and characterized by Brunauer-Emmett-Teller (BET), X-ray diffraction (XRD), Raman spectra (RM) and oxygen pulse reaction, were comparatively investigated to elucidate the combinational effects of Y and/or La oxide promoters on the catalytic activity and anti-aging performance of monolithic cordierite honeycomb catalysts with low Pt and Rh content. The catalytic activities, water-gas shift (WGS) and steam reforming reaction (SR) were studied under a simulated gas mixture. The catalysts were also characterized by H 2 -temperature-programmed reduction (H 2 -TPR) and O 2 -temperature-programmed desorption (O 2 -TPD). The results showed that the prepared CeO 2ZrO 2 –M x O y oxides have a face-centered cubic fluorite structure and are nanosize. La 3+ ions can significantly improve thermal stability and efficiently retard CeO 2ZrO 2 crystal sintering and growth. Doped CeO 2ZrO 2 with Y 3+ and La 3+ has 105 and 60 m 2 /g surface area and 460 and 390 μmol/g OSC before and after aging. The T 50 of fresh Pt–Rh/CZYL/LA is 170 °C for CO, 222 °C for C 3 H 8 and 189 °C for NO, and shift to 205, 262 and 228 °C after hydrothermal aging, which are better than those of Pt–Rh/CZY/LA or Pt–Rh/CZL/LA. WGS and SR are relate to the OSC of oxygen storage materials and absorbed oxygen species on the catalyst surface and affect the three-way catalytic activities of catalysts. The reductive property of noble metals and the dissociatively adsorbed O 2 on the surface of catalysts are closely related to the catalytic activities.

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

    Science.gov (United States)

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

    2016-10-01

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

  19. The effect of tungsten on mechanical properties of the Ti-9% Al-3% Zr alloy

    International Nuclear Information System (INIS)

    Nartova, T.T.; Grigor'ev, I.P.; Stepanov, Yu.N.; Tarasova, O.B.

    1979-01-01

    The effect of tungsten (from 0 to 10 %) on mechanical properties of the ternary Ti-9 %, Al-3 % Zr alloy, has been studied. The microstructure, tensile properties at 20 and 600 deg C and Vickers hardness in as-forged and as-annealed states have been studied. The experiments have shown that the ultimate strength increases with tungsten content. Titanium alloys with 9 % Al and 3 % Zr in the case of varying tungsten content at 20 deg C fracture by brittle mechanism. The dUctility of the annealed alloy does not rise at 20 deg C, but at the test temperature of 600 deg C the alloy becomes ductile

  20. Strain and strain-rate hardening characteristics of a superplastic Al-Li-Cu-Zr alloy

    International Nuclear Information System (INIS)

    Ash, B.A.; Hamilton, C.H.

    1988-01-01

    A number of alloys based on the composition of Al-Li-Zr have been shown to be superplastic under at least one of two different microstructural conditions: 1. fully recrystallized to a fine, stable grain size, and 2. warm- or cold-worked and unrecrystallized prior to superplastic deformation. For the latter case, static recrystallization was impaired by the presence of fine Al 3 Zr particles, and dynamic recrystallization was observed to occur during superplastic deformation in which the heavily worked microstructure evolved into a fine grained fully recrystallized microstructure. This process is observed in other Al alloys as well, such as the Al-Cu-Zr alloys (Supral alloys), Al-Zn-Mg-Zr alloys, Al-Mn-Zr alloys, and Al-Mg-Mn alloys where the dynamic recrystallization has been suggested to be a continuous reaction in which recrystallization occurs by a gradual and homogeneous process during deformation rather than by the more common nucleation and growth process. Experimental observations of continuous recrystallization show development of a subgrain structure which coarsens continuously while deformation proceeds, with a concurrent increase in the misorientation angle between adjacent subgrains which ultimately approaches that of a high-angle boundary, characteristic of a fully- recrystallized microstructure. During the first 50 to 300% deformation, the microstructure evolves from the heavily worked to a fully recrystallized microstructure after which the fully recrystallized microstructure apparently exhibits the typical micro-grain superplastic characteristics. Superplasticity under continuous dynamic recrystallization is of interest both from scientific and technological standpoints since the rates at which superplastic deformation can be obtained are often higher than those for the fully recrystallized microstructures

  1. Martensitic transformations and the shape memory effect in Ti-Zr-Nb-Al high-temperature shape memory alloys

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Fei; Yu, Zhiguo; Xiong, Chengyang [School of Materials Science and Engineering, Beihang University, Beijing 100191 (China); Key Laboratory of Aerospace Materials and Performance (Ministry of Education), Beihang University, Beijing 100191 (China); Qu, Wentao; Yuan, Bifei [School of Mechanical Engineering, Xi’an Shiyou University, Xi’an 710065 (China); Wang, Zhenguo [School of Materials Science and Engineering, Beihang University, Beijing 100191 (China); Key Laboratory of Aerospace Materials and Performance (Ministry of Education), Beihang University, Beijing 100191 (China); Li, Yan, E-mail: liyan@buaa.edu.cn [School of Materials Science and Engineering, Beihang University, Beijing 100191 (China); Key Laboratory of Aerospace Materials and Performance (Ministry of Education), Beihang University, Beijing 100191 (China)

    2017-01-02

    The microstructures, phase transformations, mechanical properties and shape memory effect of Ti-20Zr-10Nb-xAl (x=1, 2, 3, 4 at%) alloys were investigated. The X-ray diffraction results show that the alloys are composed of a single martensitic α″-phase and that the corresponding unit cell volume decreases with increasing Al content. The reverse martensitic transformation start temperature (A{sub s}) of the Ti-20Zr-10Nb-Al alloy is 534 K and decreases with increasing Al content. The addition of Al results in solid solution strengthening and grain refinement strengthening, thus improving the mechanical properties and the shape memory effect of the Ti-20Zr-10 Nb-xAl alloys. The Ti-20Zr-10Nb-3Al alloy shows the greatest shape memory strain (3.2%) and the largest tensile strain (17.6%) as well as a very high tensile strength (886 MPa).

  2. Tuning the sapphire EFG process to the growth of Al2O3/YAG/ZrO2:Y eutectic

    Science.gov (United States)

    Carroz, L.; Duffar, T.

    2018-05-01

    In this work, a model is proposed, in order to analytically study the working point of the Edge defined Film-fed Growth (EFG) pulling of crystal plates. The model takes into account the heat equilibrium at the interface and the pressure equilibrium across the meniscus. It is validated on an industrial device dedicated to the pulling of sapphire ribbons. Then, the model is applied to pulling ceramic alloy plates, of the ternary eutectic Al2O3/YAG/ZrO2:Y. This allowed understanding the experimental difficulties of pulling this new material and suggested improvements of the control software. From these results, pulling net shaped ceramic alloy plates was successful in the same industrial equipment as used for sapphire.

  3. Surface morphology of Al0.3Ga0.7N/Al2O3-high electron mobility transistor structure.

    Science.gov (United States)

    Cörekçi, S; Usanmaz, D; Tekeli, Z; Cakmak, M; Ozçelik, S; Ozbay, E

    2008-02-01

    We present surface properties of buffer films (AIN and GaN) and Al0.3Gao.zN/Al2O3-High Electron Mobility Transistor (HEMT) structures with/without AIN interlayer grown on High Temperature (HT)-AIN buffer/Al2O3 substrate and Al2O3 substrate. We have found that the GaN surface morphology is step-flow in character and the density of dislocations was about 10(8)-10(9) cm(-2). The AFM measurements also exhibited that the presence of atomic steps with large lateral step dimension and the surface of samples was smooth. The lateral step sizes are in the range of 100-250 nm. The typical rms values of HEMT structures were found as 0.27, 0.30, and 0.70 nm. HT-AIN buffer layer can have a significant impact on the surface morphology of Al0.3Ga0.7N/Al2O3-HEMT structures.

  4. Síntesis coloidal de materiales nanoestructurados de Al-ZrAl3: Propiedades mecánicas mediante el ensayo miniatura de punzonado

    Directory of Open Access Journals (Sweden)

    Díaz, L. A.

    2009-08-01

    Full Text Available This work describes a new method to obtain Al-Zr intermetallic nanostructured materials by using a colloidal processing technique. The combination of Al powders and zirconium IV-propoxide (C12H28O4Zr under controlled conditions results in a metal matrix composite with a homogeneous dispersion of intermetallics. Synthesis was carried out in a tubular furnace under argon and by hot pressing under the same atmospheric conditions. XDR and SEM were used to identify the intermetallic nanoparticles. The Vickers hardness of the ZrAl3 nanocomposites and the mechanical behaviour by small punch test were studied.

    En este trabajo se describe un nuevo método de procesamiento coloidal para obtener materiales nanoestructurados de base aluminio con partículas intermetálicas ZrAl3. A partir de una mezcla controlada en alcohol, de polvos de aluminio con un alcóxido precursor de zirconio (C12H28O4Zr se obtiene, mediante un tratamiento térmico en un horno convencional con atmósfera controlada o por prensado uniaxial en caliente, un polvo nanoestructurado formado por cristales de aluminio sobre los que cristalizan, de forma homogénea, nanopartículas intermetálicas de ZrAl3. La identificación del intermetálico se efectuó por difracción de rayos X y microscopía electrónica de barrido. El comportamiento mecánico de los materiales nanoestructurados desarrollados se evaluó a partir de ensayos de dureza y mediante el ensayo miniatura de punzonado (EMP. Los resultados muestran que la presencia del intermetálico de zirconio hasta un 1,0 % (en peso de zirconio aumenta la dureza y rigidez de la matriz de aluminio, al tiempo que incrementa su resistencia mecánica (límite elástico y resistencia a la tracción.

  5. The Study on Thermal Expansion of Ceramic Composites with Addition of ZrW[2]O]8

    OpenAIRE

    Dedova, Elena Sergeevna; Shadrin, V. S.; Petrushina, M. Y.; Kulkov, Sergey Nikolaevich

    2016-01-01

    The studies on structure, phase composition and thermal properties of (Al[2]O[3] - 20 wt% ZrO[2]) - ZrW[2]O[8] ceramic composites obtained using nanosized, initial powders were conducted. Homogeneously distributed white particles on the polished surface of composites were observed. Phase composition of the composites was represented with corundum, monoclinic ZrO[2] and two modifications of ZrW[2]O[8] (tetragonal and cubic). Linear thermal expansion coefficient values of the composites were de...

  6. Influences of hydrostatic pressure during casting and Pd content on as-cast phase in Zr-Al-Ni-Cu-Pd bulk alloys

    International Nuclear Information System (INIS)

    Kato, Hidemi; Inoue, Akihisa; Saida, Junji

    2004-01-01

    The influences of sample diameter (D), Pd content (x), and hydrostatic pressure (P) in a chamber during casting on the structure of as cast Zr 65 Al 7.5 Ni 10 Cu 17.5-x Pd x (x=10,17.5 at.%) bulk alloys were investigated. Zr 65 Al 7.5 Ni 10 Cu 7.5 Pd 10 and Zr 65 Al 7.5 Ni 10 Pd 17.5 alloys (D=3 mm) cast in a vacuum chamber (P∼4.0x10 -3 Pa) were mainly of the tetragonal-Zr 2 Ni equilibrium phase and nanosize icosahedral primary phase, respectively, while the same alloys cast in inert argon gas at atmospheric pressure (P∼0.1 MPa) were of the single glassy phase. Due to the higher cooling rate obtained by decreasing the sample diameter (D=2 mm) even in the vacuum chamber, the Zr 65 Al 7.5 Ni 10 Pd 17.5 alloy was still of the icosahedral phase, while the Zr 65 Al 7.5 Ni 10 Cu 7.5 Pd 10 alloy froze into a single glassy phase. These results indicate that the temperature- and time- transformation curves for the icosahedral and subsequent equilibrium phase formations in the alloy system shifts to a shorter time side with decreasing P, and the pressure sensitivity of the icosahedral phase formation increases with x

  7. A superplastic Al-Li-Cu-Mg-Zr powder alloy with high hardness and modulus

    International Nuclear Information System (INIS)

    Phillips, V.A.

    1986-01-01

    Structure/property studies were made on an experimental Al-3.18% Li-4.29% Cu-1.17% Mg-0.18% Zr powder alloy, which is of the low density/high modulus type. Alloy powder was made by the P and W/GPD rapid solidification rate (RSR) process, canned, and extruded to bar. The density was 2.458 x 10/sup 6/ g/m/sup 3/. The material was solution-treated, and aged at 149 0 C(300 0 F), 171 0 C(340 0 F), and 193 0 C(380 0 F), using hardness tests to determine the aging curves. Testpieces solution-treated at 516 0 C(961 0 F) showed an average yield strength (0.2% offset) of 43.3 ksi (299 MPa) and ultimate tensile strength of 50.0 ksi (345 MPa), with 1% elongation, which increased to 73.0 ksi (503 MPa) and 73.1 ksi (504 MPa), respectively, with only 0.2% elongation, on peak aging at 193 0 C(380 0 F), with a modulus of elasticity of 11.4 x 10/sup 6/ psi (78.3 GPa). Hardness values reached 90-92 R/sub B/ on aging at 149-193 0 C(300-380 0 F). The as-extruded alloy showed superplastic behavior at 400-500 0 C(752-932 0 F) with elongations of 80-185% on 25.6 mm, peaking at 450 0 C(842 0 F). An RSR Al-2.53% Li-2.82% Mn-0.02% Zr extruded allow showed only 18-23% elongation at 400-500 0 C(752-932 0 F)

  8. Fabrication of All-Solid-State Lithium-Ion Cells Using Three-Dimensionally Structured Solid Electrolyte Li7La3Zr2O12 Pellets

    International Nuclear Information System (INIS)

    Shoji, Mao; Munakata, Hirokazu; Kanamura, Kiyoshi

    2016-01-01

    All-solid-state lithium-ion batteries using Li + -ion conducting ceramic electrolytes have been focused on as attractive future batteries for electric vehicles and renewable energy conversion systems because high safety can be realized due to non-flammability of ceramic electrolytes. In addition, a higher volumetric energy density than that of current lithium-ion batteries is expected since the all-solid-state lithium-ion batteries can be made in bipolar cell configurations. However, the special ideas and techniques based on ceramic processing are required to construct the electrochemical interface for all-solid-state lithium-ion batteries since the battery development has been done so far based on liquid electrolyte system over 100 years. As one of the promising approaches to develop practical all-solid-state batteries, we have been focusing on three-dimensionally (3D) structured cell configurations such as an interdigitated combination of 3D pillars of cathode and anode, which can be realized by using solid electrolyte membranes with hole-array structures. The application of such kinds of 3D structures effectively increases the interface between solid electrode and solid electrolyte per unit volume, lowering the internal resistance of all-solid-state lithium-ion batteries. In this study, Li 6.25 Al 0.25 La 3 Zr 2 O 12 (LLZAl), which is a Al-doped Li 7 La 3 Zr 2 O 12 (LLZ) with Li + -ion conductivity of ~10 –4 S ⋅cm −1 at room temperature and high stability against lithium-metal, was used as a solid electrolyte, and its pellets with 700 μm depth holes in 700 μm × 700 μm area were fabricated to construct 3D-structured all-solid-state batteries with LiCoO 2 /LLZAl/lithium-metal configuration. It is expected that the LiCoO 2 –LLZAl interface is formed by point-to-point contact even when the LLZAl pellet with 3D hole-array structure is applied. Therefore, Li 3 BO 3 , which is a mechanically soft solid electrolyte with a low melting point at around 700

  9. Surface passivation of n-type doped black silicon by atomic-layer-deposited SiO2/Al2O3 stacks

    Science.gov (United States)

    van de Loo, B. W. H.; Ingenito, A.; Verheijen, M. A.; Isabella, O.; Zeman, M.; Kessels, W. M. M.

    2017-06-01

    Black silicon (b-Si) nanotextures can significantly enhance the light absorption of crystalline silicon solar cells. Nevertheless, for a successful application of b-Si textures in industrially relevant solar cell architectures, it is imperative that charge-carrier recombination at particularly highly n-type doped black Si surfaces is further suppressed. In this work, this issue is addressed through systematically studying lowly and highly doped b-Si surfaces, which are passivated by atomic-layer-deposited Al2O3 films or SiO2/Al2O3 stacks. In lowly doped b-Si textures, a very low surface recombination prefactor of 16 fA/cm2 was found after surface passivation by Al2O3. The excellent passivation was achieved after a dedicated wet-chemical treatment prior to surface passivation, which removed structural defects which resided below the b-Si surface. On highly n-type doped b-Si, the SiO2/Al2O3 stacks result in a considerable improvement in surface passivation compared to the Al2O3 single layers. The atomic-layer-deposited SiO2/Al2O3 stacks therefore provide a low-temperature, industrially viable passivation method, enabling the application of highly n- type doped b-Si nanotextures in industrial silicon solar cells.

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

    Energy Technology Data Exchange (ETDEWEB)

    Lin, Chung-Kwei [School of Dental Technology, Taipei Medical University, Taipei 110, Taiwan (China); Hsu, Cheng-Hsun, E-mail: chhsu@ttu.edu.tw [Department of Materials Engineering, Tatung University, Taipei 104, Taiwan (China); College of Oral Medicine, Taipei Medical University, Taipei 110, Taiwan (China); Cheng, Yin-Hwa [Department of Materials Engineering, Tatung University, Taipei 104, Taiwan (China); Ou, Keng-Liang [College of Oral Medicine, Taipei Medical University, Taipei 110, Taiwan (China); Department of Mechanical Engineering, National Central University, Taoyuan 320, Taiwan (China); Lee, Sheng-Long [Research Center for Biomedical Devices and Prototyping Production, Taipei Medical University, Taipei 110, Taiwan (China)

    2015-01-01

    Highlights: • Electroless nickel was used as an interlayer for TiAlZrN-coated ductile iron. • The duplex coatings evidently improved corrosion resistance of ductile iron. • The duplex coated ductile iron showed a good erosion resistance. - Abstract: This study utilized electroless nickel (EN) and cathodic arc evaporation (CAE) technologies to deposit protective coatings onto ductile iron. Polarization corrosion tests were performed in 3.5 wt.% sodium chloride, and also erosion tests were carried out by using Al{sub 2}O{sub 3} particles (∼177 μm in size and Mohr 7 scale) of about 5 g. Surface morphologies of the corroded and eroded specimens were observed separately. To further understand the coating effects on both the corrosive and erosive behavior of ductile iron, coating structure, morphology, and adhesion were analyzed using X-ray diffractormeter, scanning electron microscopy, and Rockwell-C indenter, respectively. The results showed that the EN exhibited an amorphous structure while the CAE-TiAlN/ZrN coating was a multilayered nanocrystalline. When the TiAlN/ZrN coated specimen with EN interlayer could effectively increase the adhesion strength between the CAE coating and substrate. Consequently, the combination of TiAlN/ZrN and EN delivered a better performance than did the monolithic EN or TiAlN/ZrN for both corrosion and erosion protection.

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

    International Nuclear Information System (INIS)

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

    2015-01-01

    Highlights: • Electroless nickel was used as an interlayer for TiAlZrN-coated ductile iron. • The duplex coatings evidently improved corrosion resistance of ductile iron. • The duplex coated ductile iron showed a good erosion resistance. - Abstract: This study utilized electroless nickel (EN) and cathodic arc evaporation (CAE) technologies to deposit protective coatings onto ductile iron. Polarization corrosion tests were performed in 3.5 wt.% sodium chloride, and also erosion tests were carried out by using Al 2 O 3 particles (∼177 μm in size and Mohr 7 scale) of about 5 g. Surface morphologies of the corroded and eroded specimens were observed separately. To further understand the coating effects on both the corrosive and erosive behavior of ductile iron, coating structure, morphology, and adhesion were analyzed using X-ray diffractormeter, scanning electron microscopy, and Rockwell-C indenter, respectively. The results showed that the EN exhibited an amorphous structure while the CAE-TiAlN/ZrN coating was a multilayered nanocrystalline. When the TiAlN/ZrN coated specimen with EN interlayer could effectively increase the adhesion strength between the CAE coating and substrate. Consequently, the combination of TiAlN/ZrN and EN delivered a better performance than did the monolithic EN or TiAlN/ZrN for both corrosion and erosion protection

  12. Deuterium absorption property of Al/Zr-V/Mo multifilms

    International Nuclear Information System (INIS)

    Wang Haifeng; Peng Shuming; Zhang Xiaohong; Long Xinggui; Yang Benfu

    2005-01-01

    Deuterium absorption property of Al/Zr-V/Mo multifilms was studied experimentally to explore the effect of Al film. There is only one desorption peak at 320 degree C for Al film, two desorption peaks at 220 degree C and 350 degree C for Zr-V film. When the average thickness of Al film is less than 0.6 μm, the desorption property of Al/Zr-V multifilms is just as Zr-V film, when it is more than 0.6 μm, just as Al film. Deuterium absorption by Al/Zr-V multifilms decreases as the thickness of Al film increases until 0.7 μm, then the deuterium absorption no longer changes significantly. The Al film of multifilms cracks on desorbing, so the absorption rate varies as Zr-V film when the thickness of Al film is less than 0.6 μ. When the thickness of Al film is more than 0.6 μm, the deuterium absorption rate of multifilm does not change with the thickness of Al film. (author)

  13. Effect of Si addition on the glass-forming ability of a NiTiZrAlCu alloy

    International Nuclear Information System (INIS)

    Liang, W.Z.; Shen, J.; Sun, J.F.

    2006-01-01

    The effect of Si addition on the glass-forming ability (GFA) of a NiTiZrAlCu alloy was investigated by using differential scanning calorimetry (DSC), differential thermal analysis (DTA), X-ray diffraction (XRD), scanning electron microscopy (SEM) and transmission electron microscopy (TEM). The maximum diameter of glassy rods increased from 0.5 mm for the Ni 42 Ti 20 Zr 25 Al 8 Cu 5 alloy (the base alloy) to 2.5 mm for the Ni 42 Ti 20 Zr 21.5 Al 8 Cu 5 Si 3.5 alloy and to 3 mm for the Ni 42 Ti 19 Zr 22.5 Al 8 Cu 5 Si 3.5 alloy, when prepared by using the copper mould casting. The GFA of the alloys can be assessed by the reduced glass transition temperature T rg (=T g /T l ) and a newly proposed parameter, δ(=T x /T l - T g ). An addition of a proper amount of Si and a minor substitution of Ti with Zr can enhance the GFA of the base alloy by suppressing the formation of primary Ni(TiZr) and (TiZr)(CuAl) 2 phases and inducing the composition close to eutectic

  14. Pumping of methane by an ionization assisted Zr/Al getter pump

    International Nuclear Information System (INIS)

    Shen, G.L.

    1987-01-01

    The pumping of methane by an ionization assisted Zr/Al getter pump has been investigated. This pump consists of 12 pieces of ring getters. A spiral shape W filament is located within the ring getters. A bias voltage is applied across the filament and the getter itself. The experiments have shown that (1) when the bias voltage is turned off, the pumping speed of the getter pump for methane increases exponentially with the filament temperature; (2) when the filament temperature is held constant, its pumping speed varies directly with the ionization electron current; (3) when the filament temperature is 2063 0 C and the electron current is 57 mA, the pumping speed of the Zr/Al getter pump is 475 ml/s, and the specific speed is 16.8 ml/s cm 2 ; and (4) an activation energy and critical temperature measured for methane molecules decomposition are, respectively, 47.4 kcal/mol and about 1700 0 C. Analysis of the results indicates that methane is pumped by an ionization assisted Zr/Al getter pump not because of the adsorption and the diffusion of methane molecules directly, but because methane molecules are decomposed as C and H 2 through a catalysis of the hot W filament, carbon is adsorbed on the surface of the W filament, and is diffused into the interior of the W lattice. H 2 is immediately absorbed by the Zr/Al getters. Besides, electron impact with CH 4 would result in the additional decomposition and ionization, then the effect of electron bombardment enhances methane pumping by the Zr/Al getters

  15. Potential of HfN, ZrN, and TiH as hot carrier absorber and Al2O3/Ge quantum well/Al2O3 and Al2O3/PbS quantum dots/Al2O3 as energy selective contacts

    Science.gov (United States)

    Shrestha, Santosh; Chung, Simon; Liao, Yuanxun; Wang, Pei; Cao, Wenkai; Wen, Xiaoming; Gupta, Neeti; Conibeer, Gavin

    2017-08-01

    The hot carrier (HC) solar cell is one of the most promising advanced photovoltaic concepts. It aims to minimise two major losses in single junction solar cells due to sub-band gap loss and thermalisation of above band gap photons by using a small bandgap absorber, and, importantly, collecting the photo-generated carriers before they thermalise. In this paper we will present recent development of the two critical components of the HC solar cell, i.e., the absorber and energy selective contacts (ESCs). For absorber, fabrication and carrier cooling rates in potential bulk materials — hafnium nitride, zirconium nitride, and titanium hydride are presented. Results of ESCs employing double barrier resonant tunneling structures Al2O3/Ge quantum well (QW)/Al2O3 and Al2O3/PbS quantum dots (QDs)/Al2O3 are also presented. These results are expected to guide further development of practical HC solar cell devices.

  16. Effect of Growth Temperature on the Structural and Electrical Properties of ZrO2 Films Fabricated by Atomic Layer Deposition Using a CpZr[N(CH32]3/C7H8 Cocktail Precursor

    Directory of Open Access Journals (Sweden)

    Jong-Ki An

    2018-03-01

    Full Text Available The effect of growth temperature on the atomic layer deposition of zirconium oxide (ZrO2 dielectric thin films that were fabricated using a CpZr[N(CH32]3/C7H8 cocktail precursor with ozone was investigated. The chemical, structural, and electrical properties of ZrO2 films grown at temperatures from 250 to 350 °C were characterized. Stoichiometric ZrO2 films formed at 250–350 °C with an atomic ratio of O to Zr of 1.8–1.9 and a low content of carbon impurities. The film formed at 300 °C was predominantly the tetragonal crystalline phase, whereas that formed at 350 °C was a mixture of tetragonal and monoclinic phases. Electrical properties, such as capacitance, leakage current, and voltage linearity of TiN/ZrO2/TiN capacitors fabricated using the thin ZrO2 films grown at different temperatures were compared capacitor applications. The ZrO2 film grown at 300 °C exhibited low impurity content, predominantly tetragonal crystalline structure, a high dielectric permittivity of 38.3, a low leakage current of below 10−7 A/cm2 at 2 V, and low-voltage linearity.

  17. Partial redetermination of the phase diagram of the system Al2O3 - ZrO2 - SiO2

    International Nuclear Information System (INIS)

    Greca, M.C.; Emiliano, J.V.; Segadaes, A.M.

    1990-01-01

    Current research on the mechanical behaviour of ceramic matrices reinforced by zirconia particles, and on the processing of mullite-zirconia via reaction-sintering, has brought about the need to update the phase diagram of the system Al 2 O 3 -ZrO 2 -SiO 2 , whose available version dates back to 1956. In the present work, selected compositions in this system were prepared from reagent-grade oxides, uniaxially pressed into 6 mm cylindrical pellets, fired at temperatures between 1550 and 1750 0 C for 6 to 24 h, water-quenched, and observed by X-ray diffraction and SEM, the composition of some of the phases identified being evaluated by EPMA. The data so obtained led to the relocation of the boundary curves neighbouring the ternary eutectic involving alumina, zirconia and mullite. This eutectic was found to occur at ∼ 1750 0 C, a temperature significantly lower than previously reported. (author) [pt

  18. Structure and Electrical-Transport Relations in Ba(Zr,Pr)O3-δ Perovskites.

    Science.gov (United States)

    Antunes, Isabel; Amador, Ulises; Alves, Adriana; Correia, Maria Rosário; Ritter, Clemens; Frade, Jorge Ribeiro; Pérez-Coll, Domingo; Mather, Glenn C; Fagg, Duncan Paul

    2017-08-07

    Members of the perovskite solid solution BaZr 1-x Pr x O 3-δ (0.2 ≤ x ≤ 0.8) with potential high-temperature electrochemical applications were synthesized via mechanical activation and high-temperature annealing at 1250 °C. Structural properties were examined by Rietveld analysis of neutron powder diffraction and Raman spectroscopy at room temperature, indicating rhombohedral symmetry (space group R3̅c) for members x = 0.2 and 0.4 and orthorhombic symmetry (Imma) for x = 0.6 and 0.8. The sequence of phase transitions for the complete solid solution from BaZrO 3 to BaPrO 3 is Pm3̅m → R3̅c → Imma → Pnma. The structural data indicate that Pr principally exists as Pr 4+ on the B site and that oxygen content increases with higher Pr content. Electrical-conductivity measurements in the temperature range of 250-900 °C in dry and humidified (pH 2 O ≈ 0.03 atm) N 2 and O 2 atmospheres revealed an increase of total conductivity by over 2 orders of magnitude in dry conditions from x = 0.2 to x = 0.8 (σ ≈ 0.08 S cm -1 at 920 °C in dry O 2 for x = 0.8). The conductivity for Pr contents x > 0.2 is attributable to positively charged electronic carriers, whereas for x = 0.2 transport in dry conditions is n-type. The change in conduction mechanism with composition is proposed to arise from the compensation regime for minor amounts of BaO loss changing from predominantly partitioning of Pr on the A site to vacancy formation with increasing Pr content. Conductivity is lower in wet conditions for x > 0.2 indicating that the positive defects are, to a large extent, charge compensated by less mobile protonic species. In contrast, the transport mechanism of the Zr-rich composition (x = 0.2), with much lower electronic conductivity, is essentially independent of moisture content.

  19. Structure and crystallization of B{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-SiO{sub 2} glasses

    Energy Technology Data Exchange (ETDEWEB)

    Cheng Yin, E-mail: zjbcy@126.co [College of Physics and Electronic Science, Changsha University of Science and Technology, Changsha 410114 (China); Xiao Hanning [College of Physics and Electronic Science, Changsha University of Science and Technology, Changsha 410114 (China); College of Materials Science and Engineering, Hunan University, Changsha 410082 (China); Shuguang Chen; Tang Bingzhong [College of Physics and Electronic Science, Changsha University of Science and Technology, Changsha 410114 (China)

    2009-05-01

    B{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-SiO{sub 2} glasses with different B{sub 2}O{sub 3}/Al{sub 2}O{sub 3} ratios of 0.4-1.3 were prepared by the melting-quenching method at 1500-1600 deg. C for 2 h. Fragility index F was used to estimate the glass-forming ability. The infrared (IR) absorption curves and differential scanning calorimetry (DSC) curves of the glasses have been investigated for estimating the influence of the B{sub 2}O{sub 3}/Al{sub 2}O{sub 3} ratio on glass structure and crystallization of the B{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-SiO{sub 2} glass system. The crystallization kinetics of the glasses were described by activation energy (E) for crystallization and calculated by the Kissinger method. X-ray diffraction (XRD) and SEM analyses were also used to describe the types and morphologies of the crystals precipitated from the B{sub 2}O{sub 3}-Al{sub 2}O{sub 3}-SiO{sub 2} glasses. The results show that with the increase of B{sub 2}O{sub 3}/Al{sub 2}O{sub 3} ratio, glass stability improves and the trend of crystallization decreases relatively. However, when the B{sub 2}O{sub 3}/Al{sub 2}O{sub 3} ratio reaches 1.3, boron-abnormal phenomenon appears and results in the raising trend of crystallization. Rod-like crystals of Al{sub 4}B{sub 2}O{sub 9} and Al{sub 20}B{sub 4}O{sub 36} were observed in the crystallized samples.

  20. An XRD technique for quantitative phase analysis of Al-U-Zr alloy

    International Nuclear Information System (INIS)

    Khan, K.B.; Kulkarni, N.K.; Jain, G.C.

    2003-01-01

    In several nuclear research reactors all over the world, Al-U alloy is used as fuel. To stabilise less brittle phase UAl 3 in Al-U alloy, a small amount of Zr (1 to 3 wt% ) is added. A rapid, non destructive and simple x-ray diffraction technique has been developed for quantitative phase analysis Al-U-Zr alloy system containing UAl 4 , UAl 3 and Al. (author)

  1. Synthesis and properties of γ-Ga2O3-Al2O3 solid solutions

    Science.gov (United States)

    Afonasenko, T. N.; Leont'eva, N. N.; Talzi, V. P.; Smirnova, N. S.; Savel'eva, G. G.; Shilova, A. V.; Tsyrul'nikov, P. G.

    2017-10-01

    The textural and structural properties of mixed oxides Ga2O3-Al2O3, obtained via impregnating γ-Al2O3 with a solution of Ga(NO3)3 and subsequent heat treatment, are studied. According to the results from X-ray powder diffraction, gallium ions are incorporated into the structure of aluminum oxide to form a solid solution of spinel-type γ-Ga2O3-Al2O3 up to a Ga2O3 content of 50 wt % of the total weight of the sample, accompanied by a reduction in the specific surface area, volume, and average pore diameter. It is concluded that when the Ga2O3 content exceeds 50 wt %, the β-Ga2O3 phase is observed along with γ-Ga2O3-Al2O3 solid solution. 71Ga and 27Al NMR spectroscopy shows that gallium replaces aluminum atoms from the tetrahedral position to the octahedral coordination in the structure of γ-Ga2O3-Al2O3.

  2. Efficient photoluminescence of Dy3+ at low concentrations in nanocrystalline ZrO2

    International Nuclear Information System (INIS)

    Diaz-Torres, L.A.; Rosa, E. de la; Salas, P.; Romero, V.H.; Angeles-Chavez, C.

    2008-01-01

    Nanocrystalline ZrO 2 :Dy 3+ were prepared by sol-gel and the structural and photoluminescence properties characterized. The crystallite size ranges from 20 to 50 nm and the crystalline phase is a mixture of tetragonal and monoclinic structure controlled by dopant concentration. Strong white light produced by the host emission band centered at ∼460 nm and two strong Dy 3+ emission bands, blue (488 nm) and yellow (580 nm), under direct excitation at 350 nm were observed. The highest efficiency was obtained for 0.5 mol% of Dy 3+ . Emission is explained in terms of high asymmetry of the host suggesting that Dy 3+ are substituted mainly into Zr 4+ lattice sites at the crystallite surface. Luminescence quenching is explained in terms of cross-relaxation of intermediate Dy 3+ levels. - Graphical abstract: White light emission from ∼70 nm ZrO 2 :Dy 3+ nanocrystals. The highest efficiency was obtained for 0.5 mol% of dopant and the dominant crystalline structure was monoclinic

  3. Improving the tribocorrosion resistance of Ti6Al4V surface by laser surface cladding with TiNiZrO{sub 2} composite coating

    Energy Technology Data Exchange (ETDEWEB)

    Obadele, Babatunde Abiodun, E-mail: obadele4@gmail.com [Institute for NanoEngineering Research, Department of Chemical, Metallurgical and Materials Engineering, Tshwane University of Technology, Pretoria (South Africa); Andrews, Anthony [Institute for NanoEngineering Research, Department of Chemical, Metallurgical and Materials Engineering, Tshwane University of Technology, Pretoria (South Africa); Department of Materials Engineering, Kwame Nkrumah University of Science and Technology, Kumasi-Ghana (Ghana); Mathew, Mathew T. [Institute for NanoEngineering Research, Department of Chemical, Metallurgical and Materials Engineering, Tshwane University of Technology, Pretoria (South Africa); Department of orthopedics, Rush University Medical Center, Chicago, IL 60612 (United States); Olubambi, Peter Apata [Institute for NanoEngineering Research, Department of Chemical, Metallurgical and Materials Engineering, Tshwane University of Technology, Pretoria (South Africa); Pityana, Sisa [Institute for NanoEngineering Research, Department of Chemical, Metallurgical and Materials Engineering, Tshwane University of Technology, Pretoria (South Africa); National Laser Center, Council for Scientific and Industrial Research, Pretoria (South Africa)

    2015-08-01

    Highlights: • The tribocorrosion behaviour of TiNiZrO{sub 2} composite is investigated. • The effect of ZrO{sub 2} on the microstructure is discussed. • The effect of the combined action of wear and chemical process is reported. • ZrO{sub 2} addition improved the tribocorrosion property of Ti6Al4V. - Abstract: Ti6Al4V alloy was laser cladded with titanium, nickel and zirconia powders in different ratio using a 2 kW CW ytterbium laser system (YLS). The microstructures of the cladded layers were examined using field emission scanning electron microscopy (FESEM) equipped with energy dispersive X-ray spectroscopy (EDS) and X-ray diffractometry (XRD). Corrosion and tribocorrosion tests were performed on the cladded surface in 1 M H{sub 2}SO{sub 4} solution. The microstructure revealed the transformation from a dense dendritic structure in TiNi coating to a flower-like structure observed in TiNiZrO{sub 2} cladded layers. There was a significant increase in surface microindentation hardness values of the cladded layers due to the present of hard phase ZrO{sub 2} particles. The results obtained show that addition of ZrO{sub 2} improves the corrosion resistance property of TiNi coating but decrease the tribocorrosion resistance property. The surface hardening effect induced by ZrO{sub 2} addition, combination of high hardness of Ti{sub 2}Ni phase could be responsible for the mechanical degradation and chemical wear under sliding conditions.

  4. A rocking chair type all-solid-state lithium ion battery adopting Li2O-ZrO2 coated LiNi0.8Co0.15Al0.05O2 and a sulfide based electrolyte

    Science.gov (United States)

    Ito, Seitaro; Fujiki, Satoshi; Yamada, Takanobu; Aihara, Yuichi; Park, Youngsin; Kim, Tae Young; Baek, Seung-Wook; Lee, Jae-Myung; Doo, Seokgwang; Machida, Nobuya

    2014-02-01

    An all-solid-state lithium-ion battery (ASSB) using non-flammable solid electrolytes is a candidate for a next-generation battery. Although the excellent cycle performance and its high energy density are suggested in the literature, a practical size battery has not been appeared yet. In this paper, we have adopted a sulfide based electrolyte, Li2S-P2S5 (80:20 mol%) to a rocking chair type lithium ion battery. The electrochemical cell consists of a Li2O-ZrO2 coated LiNi0.8Co0.15Al0.05O2 (NCA) cathode, an artificial graphite anode and the sulfide based electrolyte without any organic and inorganic liquids. The cathode charge transfer resistance is significantly reduced by the Li2O-ZrO2 coating. The total cell resistance of the Li2O-ZrO2 (LZO) coated NCA adopted cell is approximately one quarter of non-treated one. A standard type single cell with the nominal capacity of 100 mAh at 25 °C is fabricated by wet printing process, and its capacity retention is approximately 80% at 100 cycles. Also, a 1 Ah class battery was constructed by stacking the single cells, and demonstrated.

  5. Properties of lithium disilicate reinforced with ZrO_2 (3mol%Y_2O_3

    International Nuclear Information System (INIS)

    Alves, M.F.R.P.; Cossu, C.M.F.A.; Santos, C.; Simba, B.G.

    2016-01-01

    The new generation of dental ceramics based on lithium disilicate, Li_2Si_2O_5, allows the production of restorative prosthetic with reduced times compared to alumina and / or zirconia (Y-TZP). A great limitation of their use is related low fracture strength of such glass-ceramics, which reduces their use in unit fixed prosthesis. In this work, lithium disilicate reinforced with 10% ZrO_2 (3-mol% Y_2O_3) is characterized by relative density, crystalline phase, hardness, fracture toughness and microstructural aspects. Lithium metasilicate and tetragonal zirconia, prior to heat treatment. After thermal treatment under vacuum at 840 deg C-8min the lithium metasilicate is converted to lithium disilicate as the ZrO_2 phase remains in the tetragonal structure. This maintenance of the tetragonal phase ensures the material a good fracture toughness, reaching average values near 2MPam"1"/"2, while the average hardness of 600HV. Morphological analysis of the samples indicates that ZrO_2 particles are uniformly dispersed in the matrix composed of high aspect ratio lithium disilicate grains, which contributes to the results presented.. A critical analysis of the performance of toughening mechanisms such as cracks deflection, phase transformation of ZrO_2 (T-M), residual stress between the matrix and the reinforcement are presented, discussed and compared with other ceramic materials used in dentistry restorer. (author)

  6. Interfacial charge-induced polarization switching in Al{sub 2}O{sub 3}/Pb(Zr,Ti)O{sub 3} bi-layer

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Yu Jin; Park, Min Hyuk; Jeon, Woojin; Kim, Han Joon; Moon, Taehwan; Lee, Young Hwan; Kim, Keum Do; Hyun, Seung Dam; Hwang, Cheol Seong, E-mail: cheolsh@snu.ac.kr [Department of Materials Science & Engineering and Inter-University Semiconductor Research Center, College of Engineering, Seoul National University, Seoul 151-744 (Korea, Republic of)

    2015-12-14

    Detailed polarization switching behavior of an Al{sub 2}O{sub 3}/Pb(Zr,Ti)O{sub 3} (AO/PZT) structure is examined by comparing the phenomenological thermodynamic model to the experimental polarization–voltage (P-V) results. Amorphous AO films with various thicknesses (2–10 nm) were deposited on the polycrystalline 150-nm-thick PZT film. The thermodynamic calculation showed that the transition from the ferroelectric-like state to the paraelectric-like state with increasing AO thickness occurs at ∼3 nm thickness. This paraelectric-like state should have exhibited a negative capacitance effect without permanent polarization switching if no other adverse effects are involved. However, experiments showed typical ferroelectric-like hysteresis loops where the coercive voltage increased with the increasing AO thickness, which could be explained by the carrier injection through the thin AO layer and trapping of the carriers at the AO/PZT interface. The fitting of the experimental P-V loops using the thermodynamic model considering the depolarization energy effect showed that trapped charge density was ∼±0.1 Cm{sup −2} and critical electric field at the Pt electrode/AO interface, at which the carrier transport occurs, was ∼±10 MV/cm irrespective of the AO thickness. Energy band model at each electrostatic state along the P-V loop was provided to elucidate correlation between macroscopic polarization and internal charge state of the stacked films.

  7. Creep behavior and threshold stress of an extruded Al-6Mg-2Sc-1Zr alloy

    International Nuclear Information System (INIS)

    Deshmukh, S.P.; Mishra, R.S.; Kendig, K.L.

    2004-01-01

    Creep experiments were performed on extruded Al-6Mg-2Sc-1Zr (wt.%) alloy in a temperature range of 423-533 K. A threshold type creep behavior was measured and explained by observed dislocation-particle interactions. The experimental threshold stress values at various temperatures were compared with existing theoretical models. None of the available models could account for the decrease in threshold creep strength with increasing temperature

  8. Fabrication and Thermophysical Properties of La(2-x)Zr(2-y)O7 Nanocrystal by a Sol-Gel Method.

    Science.gov (United States)

    Li, Hui; Che, Ping; Zhao, Ziqiang; Liu, Shixiang; Li, Wenjun

    2016-03-01

    Non-Stoichiometric La2Zr2O7 (La(2-x)Zr(2-y)O7) Nanocrystal was synthesized by a simple sol-gel method. The crystalline structure, oxygen vacancy concentration, thermal expansion coefficient, as well as the fracture toughness of as-prepared materials were charactered by XRD, TG-DSC, PL spectra, dilatometer, and electronic universal testing machine respectively. The crystal structure of La2Zr2O7 is of the cubic type while lattice parameter increases with the deviatation of Zr4+ and La3+ from Stoichiometric La2Zr2O7 increasing. The average linear thermal expansion coefficient of non-stoichiometric La2Zr2O7 is obviously bigger than that of La2Zr2O7 in the temperature range between 150 degrees C and 950 degrees C. The fracture toughness of La(2-x)Zr(2-y)O7 increases with x and y increasing up to x = 0.3 and y = 0.25.

  9. Remote plasma-assisted nitridation (RPN): applications to Zr and Hf silicate alloys and Al2O3

    International Nuclear Information System (INIS)

    Hinkle, Chris; Lucovsky, Gerry

    2003-01-01

    Remote plasma-assisted nitridation or RPN is demonstrated to be a processing pathway for nitridation of Zr and Hf silicate alloys, and for Al 2 O 3 , as well. The dependence of nitrogen incorporation on the process pressure is qualitatively similar to what has been reported for the plasma-assisted nitridation of SiO 2 , the lower the process pressure the greater the nitrogen incorporation in the film. The increased incorporation of nitrogen has been correlated with the penetration of the plasma-glow into the process chamber, and the accompanying increase in the concentration of N 2 + ions that participate in the reactions leading to bulk incorporation. The nitrogen incorporation as been studied by Auger electron spectroscopy (AES), secondary ion mass spectrometry (SIMS) and X-ray absorption spectroscopy (XAS)

  10. Crystalline and electronic structure of epitaxial γ-Al2O3 films

    International Nuclear Information System (INIS)

    Wu, Huiyan; Lu, Dawei; Zhu, Kerong; Xu, Guoyong; Wang, Hu

    2013-01-01

    Epitaxial γ-Al 2 O 3 films were fabricated on SrTiO 3 (1 0 0) substrates using pulsed laser deposition (PLD) technique. The high quality of epitaxial growth γ-Al 2 O 3 films was confirmed by X-ray diffraction (XRD). Atomic force microscopy (AFM) images indicated the smooth surfaces and the step-flow growth of the films. In order to illuminate the electronic properties and the local structure of the epitaxial γ-Al 2 O 3 , we experimentally measured the X-ray absorption near-edge structure (XANES) spectrum at the O K-edge and compared the spectrum with the theoretical simulations by using various structure models. Our results based on XANES spectrum analysis indicated that the structure of the epitaxial γ-Al 2 O 3 film was a defective spinel with Al vacancies, which prefer to be located at the octahedral sites

  11. High-temperature deformation behavior and mechanical properties of rapidly solidified Al-Li-Co and Al-Li-Zr alloys

    International Nuclear Information System (INIS)

    Sastry, S.M.L.; Oneal, J.E.

    1984-01-01

    The deformation behavior at 25-300 C of rapidly solidified Al-3Li-0.6Co and Al-3Li-0.3Zr alloys was studied by tensile property measurements and transmission electron microscopic examination of dislocation substructures. In binary Al-3Li and Al-3Li-Co alloys, the modulus normalized yield stress increases with an increase in temperature up to 150 C and then decreases. The yield stress at 25 C of Al-3Li-0.3Zr alloys is 180-200 MPa higher than that of Al-3Li alloys. However, the yield stress of the Zr-containing alloy decreases drastically with increasing temperatures above 75 C. The short-term yield stresses at 100-200 C of the Al-3Li-based alloys are higher than that of the conventional high-temperature Al alloys. The temperature dependences of the flow stresses of the alloys were analyzed in terms of the magnitudes and temperature dependences of the various strengthening contributions in the two alloys. The dislocation substructures at 25-300 C were correlated with mechanical properties. 19 references

  12. A comparative UV-vis-diffuse reflectance study on the location and interaction of cerium ions in Al- and Zr-pillared montmorillonite clays

    International Nuclear Information System (INIS)

    Rao, G. Ranga; Mishra, Braja Gopal

    2005-01-01

    The environment, location and interaction of the Ce 3+ ions in the micropores of Al- and Zr-pillared clays have been studied by UV-vis-diffuse reflectance spectroscopy (UV-vis-DRS). The DRS spectra show that the chemical environment of the Ce 3+ ions in cerium exchanged clay is different from that of the Al- and Zr-pillared clays. The Al-Ce pillared clays (Al-Ce-PM) show four distinct absorption bands at 224, 263, 294 and 342 nm in the UV region which are attributed to 4f → 5d interconfigurational transitions of Ce 3+ ions associated with alumina pillars. The O 2- → Ce 3+ charge transfer band observed at 263 nm for Ce-exchanged and Al-Ce-PM clays is blue shifted by 10 nm for Ce-Zr-pillared clays (Ce-Zr-PM) due to fully hydrated Ce 3+ ions. The Ce 3+ ions are incorporated in the Al- and Zr-pillars possibly as AlCeO 3 and Ce x Zr 1-x O 2 particles upon heat treatment

  13. Superconductivity in Ti3P-type compounds

    International Nuclear Information System (INIS)

    Wills, J.O.; Hein, R.A.; Waterstrat, R.M.

    1978-01-01

    A study of 12 intermetallic A 3 B compounds which crsytallize in the tetragonal Ti 3 P-type structure has revealed five new superconductors with transition temperatures below 1 K: Zr 3 Si, Zr 3 Ge, Zr 3 P, V 3 P, and Nb 3 Ge (extrapolated from the alloy series Nb-Ge-As). In addition, two compounds, Zr 3 Sb and Ta 3 Ge, having the Ni 3 P structure type are found to be superconducting below 1 K. Within the Ti 3 P-type compounds, those with the lighter ''B'' elements in a given column of the Periodic Table have the higher transition temperatures. Critical-magnetic-field and electrical-resistivity data are reported for the superconducting Ti 2 P-type compound Nb 3 P, which permit one to estimate the Ginzburg-Landau kappa parameter and the electronic-specific-heat coefficient γ. The kappa value of 8.4 indicates that this material is type II, and the γ value of 1.3 mJ/mole K 2 for Nb 3 P is probably related to its low transition temperature relative to many A15 compounds

  14. Mechanical Properties and Wear Characteristics Al-ZrO2-SiCp and Graphite Hybrid Metal Matrix Composites

    Science.gov (United States)

    Nayak, S. K.; Mahanta, T.; Sahoo, J. K.; Mishra, A.

    2018-03-01

    Development of Aluminum Metal Matrix Co mposites (AMMCs) has been one of the major requirements in engineering applicat ions due to their excellent mechanical properties, light weight and high strength. In the present investigation, Stir casting technique has been used for fabrication of co mposites, taking Alu miniu m as parent metal, Silicon Carbide (SiCp) of 7 vol. % of 220 mesh size and 1.75 vol. % of graphite as reinforcements. The Zirconia content was varied as 2.75, 4.5 and 6 vol. % to fabricate three d ifferent types of hybrid composites. The tensile strength and hardness were measured in UTM and Vickers hardness tester respectively and the wear characteristics were studied in a pin on disc friction monitor under dry sliding condition against steel counter face. The tensile strength was found to be 90 MPa, 120 MPa, 130 MPa and hardness 80.25 VHN, 103.22 VHN, 103.77 VHN for 2.75, 4.5 and 6vol. % of Zirconia respectively. Fro m the above investigation, it is recommended that composition with Al, 7 %-SiCp, 1.75 % -Gr and 6 vol %-ZrO2 showed better mechanical p roperties i.e . h igh tensile strength (130MPa) and reasonably good hardness (103.77 VHN) . The co mposite with Al, 7 % - SiCp, 1.75 % -Gr and 6 %-ZrO2 is good for short run frictional applicat ion and the composite with Al, 7 %- SiCp, 1.75 % -Gr and 4.5 %- ZrO2 may be used for long run frictional applicat ions after testing.

  15. Effect of ZrO{sub 2} particle on the performance of micro-arc oxidation coatings on Ti6Al4V

    Energy Technology Data Exchange (ETDEWEB)

    Li, Hong; Sun, Yezi; Zhang, Jin, E-mail: zhangjin@ustb.edu.cn

    2015-07-01

    Highlights: • An anti-oxidation TiO{sub 2}/ZrO{sub 2} composite coating on Ti6Al4V alloy was prepared using micro-arc oxidation technology by adding ZrO{sub 2} particles in single phosphoric acid solution. • The composite coating displays excellent anti-oxidation characteristic at 700 °C in the air. • The concentration of ZrO{sub 2} particles not only influences the roughness and thickness of the coating, but the morphologies, phase composition, oxidation resistance and wear resistance. - Abstract: This paper investigates the effect of ZrO{sub 2} particle on the oxidation resistance and wear properties of coatings on a Ti6Al4V alloy generated using the micro-arc oxidation (MAO) technique. Different concentrations micron ZrO{sub 2} particles were added in phosphate electrolyte and dispersed by magnetic stirring apparatus. The composition of coating was characterized using X-ray diffraction and energy dispersive spectrum, and the morphology was examined using SEM. The high temperature oxidation resistance of the coating sample at 700 °C was investigated. Sliding wear behaviour was tested by a wear tester. The results showed that the coating consisted of ZrTiO{sub 4}, ZrO{sub 2}, TiO{sub 2}. With ZrO{sub 2} particle addition, the ceramic coating's forming time reduced by the current dynamic curve. It was shown that the addition of ZrO{sub 2} particles (3 g/L, 6 g/L) expressed an excellent oxidation resistance at 700 °C and wear resistance.

  16. Structure of orthorhombic SrZrO/sub 3/ by neutron powder diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Ahtee, A; Ahtee, M [Helsinki Univ. (Finland). Dept. of Physics; Glazer, A M [Cambridge Univ. (UK). Cavendish Lab.; Hewat, A W [Institut Max von Laue - Paul Langevin, 38 - Grenoble (France)

    1976-12-15

    The room-temperature structure of SrZrO/sub 3/ has been established by neutron powder-profile refinement. The space group is Pbnm and SrZrO/sub 3/ is isostructural with other perovskites, such as CaTiO/sub 3/.

  17. Rapid rate sintering of nanocrystalline ZrO2-3 mol% Y2O3

    International Nuclear Information System (INIS)

    Chen, D.J.; Mayo, M.J.

    1996-01-01

    Conventional ramp-and-hold sintering with a wide range of heating rates was conducted on submicrometer and nanocrystalline ZrO 2 -3 mol% Y 2 O 3 powder compacts. Although rapid heating rates have been reported to produce high density/fine grain size products for many submicrometer and smaller starting powders, the application of this technique to ZrO 2 -3 mol% Y 2 O 3 produced mixed results. In the case of submicrometer ZrO 2 -3 mol% Y 2 O 3 , neither densification nor grain growth was affected by the heating rate used. In the case of nanocrystalline ZrO 2 -3 mol% Y 2 O 3 , fast heating rates severely retarded densification and had a minimal effect on grain growth. The large adverse effect of fast heating rates on the densification of the nanocrystalline powder was traced to a thermal gradient/differential densification effect. Microstructural evidence suggests that the rate of densification greatly exceeded the rate of heat transfer in this material; consequently, the sample interior was not able to densify before being geometrically constrained by a fully dense shell which formed at the sample exterior. This finding implies that rapid rate sintering will meet severe practical constraints in the manufacture of bulk nanocrystalline ZrO 2 -3 mol% Y 2 O 3 specimens

  18. Mononuclear Amido and Binuclear Imido Zirconium Complexes Supported by Dibenzotetraaza[14]annulene Ligands. X-ray Structure of [(Me(4)taa)Zr(&mgr;-NR)(2)Zr(NHR)(2)] (R = Bu(t) or 2,6-C(6)H(3)Me(2)).

    Science.gov (United States)

    Nikonov, Georgii I.; Blake, Alexander J.; Mountford, Philip

    1997-03-12

    Reaction of 2 equiv of Li[NH-2,6-C(6)H(3)R(2)] with [(Me(4)taa)ZrCl(2)] (Me(4)taaH(2) = tetramethyldibenzotetraaza[14]annulene) gives the bis(amido) derivatives [(Me(4)taa)Zr(NH-2,6-C(6)H(3)R(2))(2)] [R = Pr(i) (1) and Me (2)]. Addition of Me(4)taaH(2) to [Zr(N-2,6-C(6)H(3)Pr(i)(2))(NH-2,6-C(6)H(3)Pr(i)(2))(2)(py)(2)] also affords 1. The reaction of 2 equiv of aryl or alkyl amines H(2)NR with the bis(alkyl) complex [(Me(4)taa)Zr(CH(2)SiMe(3))(2)] is the most versatile method for preparing [(Me(4)taa)Zr(NHR)(2)] (R = 2,6-C(6)H(3)Pr(i)(2), 2,6-C(6)H(3)Me(2), Ph, or Bu(t)). Reaction of 1 equiv of Me(4)taaH(2) with the binuclear complexes [(Bu(t)NH)(2)Zr(&mgr;-NBu(t))(2)Zr(NHBu(t))(2)] or [(py)(HN-2,6-C(6)H(3)Me(2))(2)Zr(&mgr;-N-2,6-C(6)H(3)Me(2))(2)Zr(NH-2,6-C(6)H(3)Me(2))(2)(py)] gives the asymmetrically substituted derivatives [(Me(4)taa)Zr(&mgr;-NR)(2)Zr(NHR)(2)] [R = Bu(t) (6) or 2,6-C(6)H(3)Me(2) (8)], which have been crystallographically characterized.

  19. Crystal structure of the Al2CuIr phase

    International Nuclear Information System (INIS)

    Meshi, L.; Ezersky, V.; Kapush, D.; Grushko, B.

    2010-01-01

    A new ternary Al 2 CuIr phase was revealed in the Al-Cu-Ir system. It is formed below 1063 o C from the β-phase (CsCl-type structure) extending at elevated temperatures from AlIr. The crystal structure of the Al 2 CuIr phase was determined using a combination of precession electron diffraction and X-ray powder diffraction techniques. The phase has an orthorhombic C-centered unit cell with lattice parameters a = 8.1196(7) A, b = 5.0646(2) A and c = 5.18513(3) A; its crystal symmetry can be described by the Cmme (no. 67) space group (Pearson symbol oC16). The unit cell of the new phase contains 8 Al, 4 Cu and 4 Ir atoms and exhibits a new structure type. The reliability factors characterizing the Rietveld refinement procedure are: R p = 4.45%, R wp = 6.45%, R B = 3.69% and R f = 2.41%.

  20. Neutron irradiation damage in Al2O3 and Y2O3

    International Nuclear Information System (INIS)

    Clinard, F.W. Jr.; Bunch, J.M.; Ranken, W.A.

    1975-01-01

    Two ceramics under consideration for use in fusion reactors, Al 2 O 3 and Y 2 O 3 , were irradiated in the EBR-II fission reactor at 650, 875, and 1025 0 K to fluences between 2 and 6 x 10 21 n/cm 2 (E greater than 0.1 MeV). Samples evaluated include sapphire, Lucalox, alumina, Y 2 O 3 , and Y 2 O 3 -10 percent ZrO 2 (Yttralox). All Al 2 O 3 specimens swelled significantly (1 to 3 percent), with most of the growth observed in sapphire along the c-axis at the higher temperatures. Al 2 O 3 samples irradiated at 875 to 1025 0 K contained a high density of small aligned ''pores''. Irradiated Y 2 O 3 -based ceramics exhibited dimensional stability and a defect content consisting primarily of unresolved damage and/or dislocation loops. The behavior of these ceramics under irradiation is discussed, and the relevance of fission neutron damage studies to fusion reactor applications is considered. (auth)

  1. Ceramic powders of CaZrO3. Preparation and sintering

    International Nuclear Information System (INIS)

    Tamborenea, S.; Coronel, A.; Mazzoni, A.D.; Aglietti, E.F.

    2003-01-01

    Calcium zirconate (CaZrO 3 ) is a compound belonging to the perovskite family of the A 2+ B 4+ O 3 6- type with orthorhombic crystalline structure (distorted perovskite).CaZrO 3 is used in the manufacture of sensors of oxygen, humidity, hydrogen and hydrocarbides.Additionally, it is also being studied for the manufacture of thermistors.The calcium zirconate preparation by solid state reaction from stoichiometric mixtures of CaCO 3 and ZrO 2 is studied.The formation reaction was followed by thermal analysis techniques (DTA-TG-DTG) and X-ray diffraction (XRD).The different behaviour of the mixtures was studied according to the milling type employed.It could be observed a shift of some peaks, mainly of TG (gravimetry) with a tendency to a temperature decrease.These changes are mainly influenced by the amorphization effects on the carbonate and by the mixing caused by the milling type used.The powder (CaZrO 3 ) was isostatically pressed obtaining then green densities of 50% of the theoretical one.Sintering was made in air between 1300 and 1600degC at times between 0 and 240.Densities reached were between 90 and 95% increasing with the temperature and the sintering time

  2. The detailed orbital-decomposed electronic structures of tetragonal ZrO2

    International Nuclear Information System (INIS)

    Zhang, Yan; Ji, Vincent; Xu, Ke-Wei

    2013-01-01

    The detailed orbital-decomposed electronic structures of the tetragonal zirconia have been investigated by using the first-principles projector augmented wave (PAW) potential within the generalized gradient approximation (GGA) as well as taking into account the on-site Coulomb repulsive interaction (GGA+U). The deviation of the minimization energy from d z =0 to d z =±0.032 for experimental lattice constants (a=3.605 Å and c=5.180 Å) confirms the alternating displacement of the oxygen atoms, which causes half of the Zr---O bonds stronger and the other half weaker compared with the bonds in symmetric (d z =0) zirconia. The distorted tetragonal environment of the eight oxygen anions around Zr site splits the five-fold degenerate d states of a free Zr atom into triply degenerate t 2g (d xy , d yz and d zx ) states and doubly degenerate e g (d z 2 and d x 2 -y 2 ) states. The additional covalent character upon Zr-O ionic bonds are resulted from the hybridization between the O(2s), O(2p) and Zr(5s), triply degenerate t 2g (d xy , d yz and d zx ) states of Zr(4d). The O(2s) and O(2p) states are clearly separated and no hybrid bonding states are formed

  3. Negative thermal expansion up to 1000 C of ZrTiO4-Al2TiO5 ceramics for high-temperature applications

    International Nuclear Information System (INIS)

    Kim, I.J.; Kim, H.C.; Han, I.S.; Aneziris, C.G.

    2005-01-01

    High temperature structural ceramics based on Al 2 TiO 5 -ZrTiO 4 (ZAT) having excellent thermal-shock-resistance were synthesized by a reaction sintering. The ZAT ceramics sintered at 1600 C had a negative thermal expansions up to 1000 C and a much lower thermal expansion coefficient (0.3 ∝ 1.3 x 10 -6 /K) than that of polycrystalline Al 2 TiO 5 (1.5 x 10 -6 /K). These low thermal expansion are apparently due to a combination of microcracking caused by the large thermal expansion anisotropy of the crystal axes of the Al 2 TiO 5 phase. The microstructural degradation of the composites after various thermal treatment for high temperature applications were analyzed by scanning electron microscopy, X-ray diffraction, ultrasonic and dilatometer. (orig.)

  4. Valence electron structure and properties of the ZrO2

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    To reveal the properties of ZrO2 at the atom and electron levels, the valence elec- tron structures of three ZrO2 phases were analyzed on the basis of the empirical electron theory of solids and molecules. The results showed that the hybridization levels of Zr and O atoms in the m-ZrO2 were the same as those in the t-ZrO2, while those in the c-ZrO2 rose markedly. The electron numbers and bond energies on the strongest covalent bonds in the m-ZrO2 phase were the greatest, the values were 0.901106 and 157.5933 kJ/mol, respectively. Those in the t-ZrO2 phase took second place, which were 0.722182 and 123.9304 kJ/mol, and those in the c-ZrO2 phase were the smallest, which were 0.469323 and 79.0289 kJ/mol. According to the product of the bond energy on the strongest covalent bond and equivalent bond number (this value reflected the crystal cohesive energy), the order from the greatness to smallness was the c-ZrO2> t-ZrO2 > m-ZrO2. This showed that the m-phase bonds were the tightest, their energy was the smallest, the crystal cohe- sive energy of the m-phase was the largest, and the m-phase existed most stably at room temperature. So it must need energy or higher temperature to take apart the stronger covalent bonds to form a new phase.

  5. Valence electron structure and properties of the ZrO2

    Institute of Scientific and Technical Information of China (English)

    LI JinPing; MENG SongHe; HAN JieCai; ZHANG XingHong

    2008-01-01

    To reveal the properties of ZrO2 at the atom and electron levels, the valence elec-tron structures of three ZrO2 phases were analyzed on the basis of the empirical electron theory of solids and molecules. The results showed that the hybridization levels of Zr and O atoms in the m-ZrO2 were the same as those in the t-ZrO2, while those in the c-ZrO2 rose markedly. The electron numbers and bond energies on the strongest covalent bonds in the m-ZrO2 phase were the greatest, the values were 0.901106 and 157.5933 kJ/mol, respectively. Those in the t-ZrO2 phase took second place, which were 0.722182 and 123.9304 kJ/mol, and those in the c-ZrO2 phase were the smallest, which were 0.469323 and 79.0289 kJ/mol. According to the product of the bond energy on the strongest covalent bond and equivalent bond number (this value reflected the crystal cohesive energy), the order from the greatness to smallness was the c-ZrO2 t-ZrO2 m-ZrO2. This showed that the m-phase bonds were the tightest, their energy was the smallest, the crystal cohe-sive energy of the m-phase was the largest, and the m-phase existed most stably at room temperature. So it must need energy or higher temperature to take apart the stronger covalent bonds to form a new phase.

  6. Electron density distribution and disordered crystal structure of 8H-SiAlON, Si3−xAl1+xOxN5−x (x∼2.2)

    International Nuclear Information System (INIS)

    Banno, Hiroki; Asaka, Toru; Fukuda, Koichiro

    2014-01-01

    The 8H-SiAlON crystal with general formula Si 3−x Al 1+x O x N 5−x was characterized using laboratory X-ray powder diffraction (CuKα 1 ), transmission electron microscopy and energy dispersive X-ray spectroscopy. The [Si: Al] molar ratios were determined to be [0.21(1): 0.79(1)], corresponding to x=2.2(1). The Si 0.8(1) Al 3.2(1) O 2.2(1) N 2.8(1) compound is hexagonal with space group P6 3 /mmc (Z=2). The unit-cell dimensions are a=0.298877(8) nm, c=2.30872(5) nm and V=0.178602(8) nm 3 . The initial structural model was successfully derived by the charge-flipping method and further refined by the Rietveld method. The final structural model showed the positional disordering of two of the three (Si,Al) sites. The maximum-entropy method-based pattern fitting (MPF) method was used to confirm the validity of the split-atom model, in which conventional structure bias caused by assuming intensity partitioning was minimized. The reliability indices calculated from the MPF were R wp =4.74%, S (=R wp /R e )=1.30, R p =3.40%, R B =1.04% and R F =0.74%. The disordered crystal structure was successfully described by overlapping four types of domains with ordered atom arrangements. The distribution of atomic positions in each of the domains can be achieved in the space group P6 3 mc. Two of the four types of domains are related by a pseudo-symmetry inversion, and the two remaining domains also have each other the inversion pseudo-symmetry. - Graphical abstract: Bird's eye view of electron densities up to 49.3% (0.071 nm −3 ) of the maximum on the plane parallel to (110) with the corresponding atomic arrangements of Si 0.8 Al 3.2 O 2.2 N 2.8 . - Highlights: • Crystal structure of Si 0.8 Al 3.2 O 2.2 N 2.8 is determined by laboratory X-ray powder diffraction. • The atom arrangements are represented by the split-atom model. • The maximum-entropy method-based pattern fitting method is used to confirm the validity of the model. • The disordered structure is described

  7. Structural and photoluminescence study of Er-Yb codoped nanocrystalline ZrO{sub 2}-B{sub 2}O{sub 3} solid solution

    Energy Technology Data Exchange (ETDEWEB)

    Salas, P. [Centro de Fisica Aplicada y Tecnologia Avanzada, Universidad Nacional Autonoma de Mexico, A.P. 1-1010, Queretaro 76000 (Mexico); Borja-Urby, R. [Grupo de Espectroscopia de Materiales Avanzados y nanoestructurados (EMANA), Centro de Investigaciones en Optica, A. C., Loma del Bosque 115, Col. Lomas del Campestre, C.P. 37150 Leon, Gto. (Mexico); Diaz-Torres, L.A., E-mail: ditlacio@cio.mx [Grupo de Espectroscopia de Materiales Avanzados y nanoestructurados (EMANA), Centro de Investigaciones en Optica, A. C., Loma del Bosque 115, Col. Lomas del Campestre, C.P. 37150 Leon, Gto. (Mexico); Rodriguez, G. [Centro de Fisica Aplicada y Tecnologia Avanzada, Universidad Nacional Autonoma de Mexico, A.P. 1-1010, Queretaro 76000 (Mexico); Vega, M. [Centro de Geociencias, Universidad Nacional Autonoma de Mexico, A.P. 1-1010, Queretaro 76000 (Mexico); Angeles-Chavez, C. [Instituto Mexicano del Petroleo, Programa de Ingenieria Molecular, Eje Central Lazaro Cardenas 152, A.P. 14-805, 07730 Mexico, DF (Mexico)

    2012-09-20

    Codoped Er{sup 3+} and Yb{sup 3+} nanocrystalline ZrO{sub 2}-B{sub 2}O{sub 3} phosphor obtained by a modified sol-gel method is demonstrated. The addition of up to 2.5 mol% B{sub 2}O{sub 3} to nanocrystalline ZrO{sub 2}:Yb(2%), Er(1%) keep the tetragonal rare-earth stabilized ZrO{sub 2} phase; whereas higher B{sub 2}O{sub 3} content destabilize the tetragonal phase, leading to the tetragonal to monoclinic transition with no tetragonal ZrO{sub 2} phase segregation. Visible upconversion of the luminescent active ions, Er{sup 3+} and Yb{sup 3+}, depend strongly on B{sub 2}O{sub 3} content. The PL intensity is strongly quenched for high B{sub 2}O{sub 3} content due to increasing multiphonon relaxation processes related to B-O and B-O-B vibronic modes.

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

    Science.gov (United States)

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

    2016-05-01

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

  9. Growth and characterization of acentric BaHf(BO{sub 3}){sub 2} and BaZr(BO{sub 3}){sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Mączka, Mirosław, E-mail: m.maczka@int.pan.wroc.pl [Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, 50-950 Wrocław 2 (Poland); Szymborska-Małek, Katarzyna; Gągor, Anna [Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, 50-950 Wrocław 2 (Poland); Majchrowski, Andrzej [Institute of Applied Physics, Military University of Technology, 2 Kaliskiego Str., 00-908 Warszawa (Poland)

    2015-05-15

    Growth, single crystal X-ray diffraction, polarized Raman and infrared (IR) studies of BaHf(BO{sub 3}){sub 2} are presented. Raman and IR spectra of polycrystalline BaZr(BO{sub 3}){sub 2} are also reported to facilitate assignment of modes. BaHf(BO{sub 3}){sub 2} borate crystallizes in trigonal system, space group R3c, with lattice parameters: a=5.1540(4) Å, c=33.901(3) Å. It accommodates dolomite-like structure doubled in the c direction, which is built of alternating layers of HfO{sub 6} octahedra and BaO{sub 6} distorted trigonal prisms that are connected through borate groups. The obtained structural as well as spectroscopic data show that BaHf(BO{sub 3}){sub 2} is isostructural with BaZr(BO{sub 3}){sub 2} and the deviations from centrosymmetry is small. - Graphical abstract: Arrangement of BO{sub 3} groups in BaHf(BO{sub 3}){sub 2} along the c direction in one unit cell. Dark and light blue denote different borate groups. - Highlights: • BaHf(BO{sub 3}){sub 2} single crystals were grown. • X-ray diffraction showed that this borate crystallizes in the acentric R3c structure. • Raman and IR spectra were measured for BaHf(BO{sub 3}){sub 2} and BaZr(BO{sub 3}){sub 2}, respectively. • Assignment of modes is proposed.

  10. Thermal phase separation of ZrSiO4 thin films and frequency- dependent electrical characteristics of the Al/ZrSiO4/p-Si/Al MOS capacitors

    Science.gov (United States)

    Lok, R.; Kaya, S.; Yilmaz, E.

    2018-05-01

    In this work, the thermal phase separation and annealing optimization of ZrSiO4 thin films have been carried out. Following annealing optimization, the frequency-dependent electrical characteristics of the Al/ZrSiO4/p-Si/Al MOS capacitors were investigated in detail. The chemical evolution of the films under various annealing temperatures was determined by Fourier transform infrared spectroscopy (FTIR) measurements. The phase separation was determined by x-ray diffraction (XRD) measurements. The electrical parameters were determined via the capacitance–voltage (C–V), conductance–voltage (G/ω) and leakage-current–voltage (Ig–Vg ). The results demonstrate that zirconium silicate formations are present at 1000 °C annealing with the SiO2 interfacial layer. The film was in amorphous form after annealing at 250 °C. The tetragonal phases of ZrO2 were obtained after annealing at 500 °C. When the temperature approaches 750 °C, transitions from the tetragonal phase to the monoclinic phase were observed. The obtained XRD peaks after 1000 °C annealing matched the crystalline peaks of ZrSiO4. This means that the crystalline zirconium dioxide in the structure has been converted into a crystalline silicate phase. The interface states increased to 5.71 × 1010 and the number of border traps decreased to 7.18 × 1010 cm‑2 with the increasing temperature. These results indicate that an excellent ZrSiO4/Si interface has been fabricated. The order of the leakage current varied from 10‑9 Acm‑2 to 10‑6 Acm‑2. The MOS capacitor fabricated with the films annealed at 1000 °C shows better behavior in terms of its structural, chemical and electrical properties. Hence, detailed frequency-dependent electrical characteristics were performed for the ZrSiO4 thin film annealed at 1000 °C. Very slight capacitance variations were observed under the frequency variations. This shows that the density of frequency-dependent charges is very low at the ZrSiO4/Si interface. The

  11. Ab initio investigations of the electronic structure and chemical bonding of Li2ZrN2

    International Nuclear Information System (INIS)

    Matar, S.F.; Pöttgen, R.; Al Alam, A.F.; Ouaini, N.

    2012-01-01

    The electronic structure of the ternary nitride Li 2 ZrN 2 is examined from ab initio with DFT computations for an assessment of the properties of chemical bonding. The compound is found insulating with 1.8 eV band gap; it becomes metallic and less ionic upon removal of one equivalent of Li. The chemical interaction is found mainly between Zr and N on one hand and Li and N on the other hand. While all pair interactions are bonding, antibonding N–N interactions are found dominant at the top of the valence band of Li 2 ZrN 2 and they become less intense upon removal of Li. From energy differences the partial delithiation leading to Li 2−x ZrN 2 (x=∼1) is favored. - Graphical abstract: Trigonal structure of Li 2 ZrN 2 showing the Zr–N–Li layers along the c-axis. Highlights: ► Li 2 ZrN 2 calculated insulating with a 1.8 eV gap in agreement with its light green color. ► Lithium de-intercalation is energetically favored for one out of two Li equivalents. ► Li plays little role in the change of the structure, ensured by Zr and N binding. ► Similar changes in the electronic structure as for various intercalated phases of ZrN.

  12. Study on surface defect structures of ZrO2 and some doped ZrO2 by means of work function measurement

    International Nuclear Information System (INIS)

    Yamawaki, M.; Suzuki, A.; Ono, F.; Yamaguchi, K.

    1997-01-01

    The work function change of the ZrO 2 +2%Y 2 O 3 sintered pellet, caused by a change of the composition of the sweep gas, was measured using a high temperature Kelvin probe. The Pt reference electrode was calibrated by using ZrO 2 +2%Y 2 O 3 as a standard material. Work function changes of undoped ZrO 2 and Nb-doped ZrO 2 (2%Nb 2 O 5 ) were measured as a function of equilibrium oxygen partial pressure, P O 2 . The thus obtained exponents of P O 2 , 1/n, were 1/6.2 and 1/33.6 for ZrO 2 and ZrO 2 +2%Nb 2 O 5 , respectively. These exponent values were discussed in terms of defect chemistry of the surface layer. (orig.)

  13. Thermodynamic modeling of the Pt-Zr system

    International Nuclear Information System (INIS)

    Gao Yongliang; Guo Cuiping; Li Changrong; Du Zhenmin

    2010-01-01

    By means of the CALPHAD (CALculation of PHAse Diagram) technique, the Pt-Zr system was critically assessed. The solution phases (liquid, bcc, fcc and hcp) are described with the substitutional model. The intermetallic compounds Pt 4 Zr, Pt 4 Zr 3 , αPtZr and Pt 3 Zr 5 are treated as the formula (Pt,Zr) m (Pt,Zr) n by a two-sublattice model with the elements Pt and Zr on the first and the second sublattices, respectively. A two-sublattice model (Pt,Zr) 0.5 (Pt,Zr) 0.5 is applied to describe the compound βPtZr with CsCl-type structure (B2) in order to cope with the order-disorder transition between bcc solution (A2) and βPtZr (B2). Another two-sublattice model (Pt,Zr) 0.75 (Pt,Zr) 0.25 with Ni 3 Ti-type structure (D0 24 ) is applied to describe the compound Pt 3 Zr in order to cope with the order-disorder transition between hexagonal close-packed (A3) and Pt 3 Zr (D0 24 ). The compound Pt 10 Zr 7 is treated as a stoichiometric compound. A set of self-consistent thermodynamic parameters of the Pt-Zr system was obtained. (orig.)

  14. The solubility and site preference of Fe3+ in Li7−3xFexLa3Zr2O12 garnets

    International Nuclear Information System (INIS)

    Rettenwander, D.; Geiger, C.A.; Tribus, M.; Tropper, P.; Wagner, R.; Tippelt, G.; Lottermoser, W.; Amthauer, G.

    2015-01-01

    A series of Fe 3+ -bearing Li 7 La 3 Zr 2 O 12 (LLZO) garnets was synthesized using solid-state synthesis methods. The synthetic products were characterized compositionally using electron microprobe analysis and inductively coupled plasma optical emission spectroscopy (ICP-OES) and structurally using X-ray powder diffraction and 57 Fe Mössbauer spectroscopy. A maximum of about 0.25 Fe 3+ pfu could be incorporated in Li 7−3x Fe x La 3 Zr 2 O 12 garnet solid solutions. At Fe 3+ concentrations lower than about 0.16 pfu, both tetragonal and cubic garnets were obtained in the synthesis experiments. X-ray powder diffraction analysis showed only a garnet phase for syntheses with starting materials having intended Fe 3+ contents lower than 0.52 Fe 3+ pfu. Back-scattered electron images made with an electron microprobe also showed no phase other than garnet for these compositions. The lattice parameter, a 0 , for all solid-solution garnets is similar with a value of a 0 ≈12.98 Å regardless of the amount of Fe 3+ . 57 Fe Mössbauer spectroscopic measurements indicate the presence of poorly- or nano-crystalline FeLaO 3 in syntheses with Fe 3+ contents greater than 0.16 Fe 3+ pfu. The composition of different phase pure Li 7−3x Fe x La 3 Zr 2 O 12 garnets, as determined by electron microprobe (Fe, La, Zr) and ICP-OES (Li) measurements, give Li 6.89 Fe 0.03 La 3.05 Zr 2.01 O 12 , Li 6.66 Fe 0.06 La 3.06 Zr 2.01 O 12 , Li 6.54 Fe 0.12 La 3.01 Zr 1.98 O 12 , and Li 6.19 Fe 0.19 La 3.02 Zr 2.04 O 12 . The 57 Fe Mössbauer spectrum of cubic Li 6.54 Fe 0.12 La 3.01 Zr 1.98 O 12 garnet indicates that most Fe 3+ occurs at the special crystallographic 24d position, which is the standard tetrahedrally coordinated site in garnet. Fe 3+ in smaller amounts occurs at a general 96h site, which is only present for certain Li-oxide garnets, and in Li 6.54 Fe 0.12 La 3.01 Zr 1.98 O 12 this Fe 3+ has a distorted 4-fold coordination. - Graphical abstract: Cubic nominally Li 7 La 3 Zr 2 O

  15. Effect of Zr Additions on Thermal Stability of Al-Cu Precipitates in As-Cast and Cold Worked Samples

    Directory of Open Access Journals (Sweden)

    Kyle Deane

    2018-05-01

    Full Text Available While Zr is frequently added to Al alloys to control grain size with the formation of large (>1 μm primary precipitates, little research has been conducted on the effect of nanoscale Al3Zr precipitates on Al alloys. By comparing the precipitation and corresponding strength evolution between Al-Cu-Zr alloys with different Zr concentrations, the effects of Zr on Al-Cu precipitation with and without primary Al3Zr precipitates can be observed. In the absence of these large precipitates, all Al3Zr phases can be formed, through high temperature aging treatments, as a dispersion of nanoprecipaites inside the Al grains. In this study, Al-Cu-Zr ternary alloys were produced and heat treated to determine whether an increase in the coarsening resistance of Al-Cu precipitate phases would be observed with a distribution of the more thermally stable Al3Zr nanoprecipitates. Generally, properly aged Al-Cu alloys will coarsen when encountering elevated temperatures higher than ~473 K (~200 °C. Diluted Al-Zr alloys (<0.07 at % Zr resist coarsening behavior until the significantly higher temperatures of ~673 K (~400 °C, but are comparatively limited in strength because of a limited solubility of Zr in the Al matrix. Hardness testing and transmission electron microscope (TEM results are discussed, in which it is found that even very small additions of Zr, when properly accounted for during heat treating, produce a finer microstructure and higher strength than in similar Al-Cu binary alloys. No significant change in the thermal stability of strengthening was observed, indicating that the finer precipitate microstructure is resultant from a higher nucleation density, as opposed to a decrease in coarsening behavior.

  16. Band alignment studies of Al2O3/CuGaO2 and ZnO/CuGaO2 hetero-structures grown by pulsed laser deposition

    International Nuclear Information System (INIS)

    Ajimsha, R.S.; Das, Amit K.; Joshi, M.P.; Kukreja, L.M.

    2014-01-01

    Highlights: • Band offset studies at the interface of Al 2 O 3 /CuGaO 2 and ZnO/CuGaO 2 hetero-structures were performed using X-ray photoelectron spectroscopy. • Valance band offsets (VBO) of these hetero-structures were obtained from respective XPS peak positions and VB spectra using Kraut's equation. • Al 2 O 3 /CuGaO 2 interface exhibited a type I band alignment with valance band offset (VBO) of 4.05 eV whereas type II band alignment was observed in ZnO/CuGaO 2 hetero-structure with a VBO of 2.32 eV. • Schematic band alignment diagram for the interface of these hetero-structures has been constructed. • Band offset and alignment studies of these heterojunctions are important for gaining insight to the design of various optoelectronic devices based on such hetero-structures. - Abstract: We have studied the band offset and alignment of pulsed laser deposited Al 2 O 3 /CuGaO 2 and ZnO/CuGaO 2 hetero-structures using photoelectron spectroscopy. Al 2 O 3 /CuGaO 2 interface exhibited a type I band alignment with valance band offset (VBO) of 4.05 eV whereas type II band alignment was observed in ZnO/CuGaO 2 hetero-structure with a VBO of 2.32 eV. Schematic band alignment diagram for the interface of these hetero-structures has been constructed. Band offset and alignment studies of these heterojunctions are important for gaining insight to the design of various optoelectronic devices based on such hetero-structures

  17. Nd{sup 3+}-substituted (Zr{sub 1−x}Ce{sub x})O{sub 2} (0.0 ≤ x ≤ 1.0) system: Synthesis, structural and thermophysical investigations

    Energy Technology Data Exchange (ETDEWEB)

    Nandi, Chiranjit [Radiometallurgy Division, Bhabha Atomic Research Centre, HBNI, Mumbai 400085 (India); Grover, V., E-mail: Vinita@barc.gov.in [Chemistry Division, Bhabha Atomic Research Centre, HBNI, Mumbai 400085 (India); Sahu, M. [Radioanalytical Chemistry Division, Bhabha Atomic Research Centre, Mumbai 400085 (India); Krishnan, K. [Fuel Chemistry Division, Bhabha Atomic Research Centre, Mumbai 400085 (India); Guleria, A. [Radiation and Photochemistry Division, Bhabha Atomic Research Centre, Mumbai 400085 (India); Kaity, Santu; Prakash, Amrit [Radiometallurgy Division, Bhabha Atomic Research Centre, HBNI, Mumbai 400085 (India); Tyagi, A.K. [Chemistry Division, Bhabha Atomic Research Centre, HBNI, Mumbai 400085 (India)

    2016-10-15

    In order to mimic co-loading of Pu and Am in zirconia, Nd{sub 0.20}[Zr{sub 1−x}Ce{sub x}]{sub 0.80}O{sub 1.90} (0.0 ≤ x ≤ 1.0) system was synthesized and thoroughly characterized by X-ray diffraction (XRD) and Raman spectroscopy. The entire system was found to be single-phasic fluorite-type and most interesting result is stabilization of multi-phasic ceria-zirconia system in a single-phasic system by substituting Nd{sup 3+}. Raman spectroscopy revealed entirely different nature of defects prevalent in the solid solutions possessing F-type structure across the composition range. The heat capacity of representative compositions was measured by heat flux-type differential scanning calorimeter. Specific heat capacity of the solid solutions was found to increase with decreasing CeO{sub 2} content. Different thermodynamic functions such as enthalpy increment, entropy and Gibbs energy functions were determined using heat capacity values. The lattice thermal expansion (298–1273 K) behaviour of the few selected compositions revealed a gradual increase in thermal expansion coefficient with increasing CeO{sub 2} content. - Highlights: • Single-phasic fluorite-type solid solution obtained across the composition range. • Multi-phasic CeO{sub 2}-ZrO{sub 2} system converted into single-phasic by Nd{sup 3+} substitution. • Different local structures and defects in Ce-rich and Zr-rich regions. • Lattice thermal expansion coefficient increases with increasing CeO{sub 2} content. • Thermal expansion behaviour is a manifestation of decreasing melting point.

  18. Isothermal sections of Eu(Ca, Zr, Ba)-Mn-Al ternary phase diagrams at 770 K

    International Nuclear Information System (INIS)

    Manyako, N.B.; Yanson, T.I.; Zarechnyuk, O.S.

    1988-01-01

    Isothermal cross sections of Eu(Ca, Sr, Ba)-Mn-Al state diagrams at 770 K are plotted by means of X-ray structural analysis. EuMn 2.3-3.6 Al 9.7-8.4 (ThMn 12 structure type) and Eu 2 Mn 5 Al 12 (eigenstructure type) two compound are found within Eu-Mn-Al system. Existance of CaMn 0.16- 0 .32 Al 1.84-1.68 compound (MgNi 2 structure type) is proved and CaMn 3.2-2.1 Al 8.8-9.9 compound (ThMn 12 type partially ordered structure) is found within Ca-Mn-Al system. Ternary compounds are not formed within Sr(Ba)-Mn-Al systems. Regions of stratification, occurring within Eu(Ca, Sr, Ba)-Mn systems, penetrate in ternary system

  19. Effect of zirconia morphology on sulfur-resistant methanation performance of MoO3/ZrO2 catalyst

    Science.gov (United States)

    Liu, Chen; Wang, Weihan; Xu, Yan; Li, Zhenhua; Wang, Baowei; Ma, Xinbin

    2018-05-01

    Two kinds of ZrO2 support with different morphologies were prepared by facile solvothermal method in different solvents. The obtained two supports showed monoclinic zirconia (m-ZrO2) and tetragonal zirconia (t-ZrO2) phase with similar crystalline size. Their supported Mo-based catalysts were prepared by impregnation method and the effect of zirconia morphology on the performance of sulfur-resistant methanation was examined. The results indicated that the MoO3/m-ZrO2 has higher CO conversion than the MoO3/t-ZrO2 catalyst. Characterizations by XRD, Raman, H2-TPR and IR confirmed that the m-ZrO2 is superior to t-ZrO2 for dispersing molybdenum species. In addition, the MoO3/m-ZrO2 catalyst has weaker interaction between support and active Mo speices than the MoO3/t-ZrO2 catalyst, which facilitates to forming active species of nanocrystalline MoS2 layers for sulfur-resistant methanation. The weaker interaction of molybdenum species with m-ZrO2 is related with the more covalent character of the Zrsbnd O bond and more oxygen defective structure of m-ZrO2. A larger number of Lewis acid centers appear on the surface of m-ZrO2, which verified the substantial vacancies on m-ZrO2 exposing coordinately unsaturated Zr3+ and Zr4+ cations. Meanwhile, the less Lewis acid of t-ZrO2 result in stronger interaction between support and molybdenum species and trigger crystalline phase MoO3 and Mosbnd Osbnd Zr linkages.

  20. Nanocrystallization in Cu-Zr-Al-Sm Bulk Metallic Glasses

    Science.gov (United States)

    Sikan, Fatih; Yasar, Bengisu; Kalay, Ilkay

    2018-04-01

    The effect of rare-earth element (Sm) microalloying on the thermal stability and crystallization kinetics of melt-spun ribbons and suction-cast rods of Zr48Cu38.4Al9.6Sm4 alloy were investigated using differential scanning calorimetry (DSC), X-ray diffraction (XRD), transmission electron microscopy (TEM), and atom probe tomography (APT). The XRD results of constant heating rate annealing indicated that amorphous Zr48Cu38.4Al9.6Sm4 melt-spun ribbons devitrifies into Cu2Sm at 673 K (400 °C). The sequence continues with the precipitation of Cu10Zr7 and then these two phases coexist. XRD and TEM studies on 1 mm diameter as suction-cast rods indicated the precipitation of 30-nm-mean size Cu2Sm crystals during solidification. TEM investigation of the isothermal crystallization sequence of melt-spun ribbons and 1-mm-diameter suction-cast rods revealed the precipitation of Cu2Sm nanocrystals at the onset of crystallization and the restriction of the growth of these nanocrystals up to 10 nm diameter with further annealing. APT analysis of 1-mm-diameter suction-cast rods showed that the limited growth of Cu2Sm nanocrystals is due to sluggish diffusion of Sm and Al-Zr pile up at the interface.

  1. Study the structural and optical behaviour of polyaniline/ZrO2 nanocomposites

    Science.gov (United States)

    Sidhu, Gaganpreet Kaur; Kumar, Naresh; Kumar, Rajesh

    2018-05-01

    In nanoscience, hybrid material based on polymer and nanoparticles are of great interest because of much improved properties of components. Polymers are of enormous interest because of their various properties like flexibility, low weight and easy processing. Here, we studied the influence of ZrO2 nanoparticles on the structural and optical properties of Polyaniline (PANI). ZrO2 mixed with PANI, improve its structural and optical properties. XRD studies reveal that ZrO2 nanoparticles exist in the tetragonal phase in ZrO2/PANI nanocomposites. UV-Vis spectroscopic studies have been carried out to understand the presence of various energy levels and their involvement in absorbance of light. In PANI nanocomposites, aniline monomer attach with ZrO2 nanoparticles through p-p stacking interaction, Vander waal force and hydrogen bonding interaction.

  2. Síntesis de nanocomposites NTC-13%ZrO2 – (87-xAl2O3-xFe

    Directory of Open Access Journals (Sweden)

    Legorreta García, F.

    2014-04-01

    Full Text Available Carbon nanotubes (CNT in a ceramic matrix – Fe, NTC-13%ZrO2 – (87-xAl2O3-xFe, (x = 1.9, 4.6 y 6.4%, were obtained using a combustion synthesis urea-nitrate, calcination treatment and chemical vapor deposition (CCVD in H2-CH4 atmosphere. The effect of the addition of Fe ions on the ceramic matrix was studied and presented. The ceramic powder obtained was calcined at 1200 °C for 2 h to modify the phases present in the solid solution. Subsequently it was introduced in a H2-CH4 reducing atmosphere at 1000 °C in order to promote the formation of CNT in the matrix. Both, the solid solution obtained and the composite materials were characterized by X-ray diffraction (XRD and high resolution scanning electron microscopy (HRSEM. Carbon content and specific surface also were determined. The quality and quantity of CNT present in the nanocomposite powder were related to the concentration of Fe, which significantly modifies their carbon content and specific surface.Mediante una síntesis por combustión ureica-nitratos, calcinación y la aplicación de un tratamiento de deposición química catalítica de vapor (CCVD en una atmósfera H2-CH4, se obtuvieron polvos nanocomposites: nanotubos de carbono (NTC en una matriz cerámica –Fe, NTC-13%ZrO2 – (87-xAl2O3-xFe, (x = 1.9, 4.6 y 6.4 %. El efecto de la adición de iones Fe sobre la matriz cerámica es estudiado y presentado. El polvo cerámico obtenido es calcinado a 1200 °C durante 2 h para modificar las fases presentes del composite. Posteriormente es sometido a una atmósfera reductora H2-CH4 a 1000 °C con la finalidad de promover la formación de NTC in situ en la matriz. Tanto el composite obtenido, como el material nanocomposite fueron caracterizados por difracción de rayos X (DRX y microscopía electrónica de barrido de alta resolución (MEB. También se determinó el contenido de carbono y la superficie específica. Se observó que la calidad y cantidad de NTC presentes en los polvos

  3. Investigation of nanostructured Al-10 wt.% Zr material prepared by ball milling for high temperature applications

    International Nuclear Information System (INIS)

    Prosviryakov, A.S.; Shcherbachev, K.D.; Tabachkova, N.Yu.

    2017-01-01

    Ground chips of as-cast Al-10 wt.% Zr alloy were subjected to mechanical alloying (MA) with 5 vol.% of nanodiamond addition in a high energy planetary ball-mill. The aim of this work was to investigate the microstructure, phase transformation and mechanical properties of the material both after MA and after subsequent annealing. Optical and transmission electron microscopes were used for morphological and microstructural analysis. The effect of milling time on powder microhardness, Al lattice parameter, lattice microstrain and crystallite size was determined. It was shown that mechanical alloying of as-cast Al-10wt.%Zr alloy during 20 h leads to a complete dissolution of the primary tetragonal Al 3 Zr crystals in aluminum. At the same time, the powder microhardness increases to 370 HV. Metastable cubic Al 3 Zr phase nanoparticles precipitate from the Al solution due to its decomposition after annealing, however, the Al solid solution remains supersaturated and nanocrystalline. Compression tests at room temperature and at 300 °C showed that the strength values of the hot-pressed samples reach 822 MPa and 344 MPa, respectively. - Highlights: •As-cast Al-10 wt.% Zr alloy was mechanically alloyed with 5 vol.% nanodiamond. •The primary tetragonal Al 3 Zr crystals were completely dissolved in Al after 20 h. •Cubic Al 3 Zr phase nanoparticles precipitated from Al solution after aging. •The aged bulk material showed a high strength at room and elevated temperatures.

  4. Investigation of nanostructured Al-10 wt.% Zr material prepared by ball milling for high temperature applications

    Energy Technology Data Exchange (ETDEWEB)

    Prosviryakov, A.S., E-mail: pro.alex@mail.ru; Shcherbachev, K.D.; Tabachkova, N.Yu.

    2017-01-15

    Ground chips of as-cast Al-10 wt.% Zr alloy were subjected to mechanical alloying (MA) with 5 vol.% of nanodiamond addition in a high energy planetary ball-mill. The aim of this work was to investigate the microstructure, phase transformation and mechanical properties of the material both after MA and after subsequent annealing. Optical and transmission electron microscopes were used for morphological and microstructural analysis. The effect of milling time on powder microhardness, Al lattice parameter, lattice microstrain and crystallite size was determined. It was shown that mechanical alloying of as-cast Al-10wt.%Zr alloy during 20 h leads to a complete dissolution of the primary tetragonal Al{sub 3}Zr crystals in aluminum. At the same time, the powder microhardness increases to 370 HV. Metastable cubic Al{sub 3}Zr phase nanoparticles precipitate from the Al solution due to its decomposition after annealing, however, the Al solid solution remains supersaturated and nanocrystalline. Compression tests at room temperature and at 300 °C showed that the strength values of the hot-pressed samples reach 822 MPa and 344 MPa, respectively. - Highlights: •As-cast Al-10 wt.% Zr alloy was mechanically alloyed with 5 vol.% nanodiamond. •The primary tetragonal Al{sub 3}Zr crystals were completely dissolved in Al after 20 h. •Cubic Al{sub 3}Zr phase nanoparticles precipitated from Al solution after aging. •The aged bulk material showed a high strength at room and elevated temperatures.

  5. Wear studies on ZrO2-filled PEEK as coating bearing materials for artificial cervical discs of Ti6Al4V

    International Nuclear Information System (INIS)

    Song, Jian; Liu, Yuhong; Liao, Zhenhua; Wang, Song; Tyagi, Rajnesh; Liu, Weiqiang

    2016-01-01

    Polyetheretherketone (PEEK) and its composite coatings are believed to be the potential candidates' bio-implant materials. However, these coatings have not yet been used on the surface of titanium-based orthopedics and joint products and very few investigations on the tribological characteristics could be found in the published literature till date. In this study, the wettabilities, composition and micro-hardness were characterized using contact angle measurement, scanning electron microscopy (SEM) and hardness tester. The tribological tests were conducted using a ball-on-disc contact pair under 25% newborn calf serum (NCS) lubricated condition. For comparison, bare Ti6Al4V was studied. The obtained results revealed that those PEEK/ZrO 2 composite coatings could improve the tribological properties of Ti6Al4V significantly. Adhesive wear and mild abrasive wear might be the dominant wear and failure mechanisms for PEEK/ZrO 2 composite coatings in NCS lubricated condition. After comprehensive evaluation in the present study, 5 wt.% ZrO 2 nanoparticles filled PEEK coating displayed the optimum tribological characteristics and could be taken as a potential candidate for the bearing material of artificial cervical disc. - Graphical abstract: Polyetheretherketone (PEEK) is a type of biomaterial which might be used in surface modification. In this study, the wettabilities, composition, hardness, friction and wear characteristics of PEEK/ZrO 2 coatings were investigated, compared with bare Ti6Al4V sample. After comprehensive evaluation, 5 wt.% ZrO 2 nanoparticles filled PEEK coating displayed the optimum tribological characteristics and could be taken as a potential candidate for the bearing material of artificial cervical disc. - Highlights: • PEEK coating were filled by ZrO 2 nanoparticles with different weight percentage. • The lubrication regime of all the tested samples are boundary lubrication. • Adhesive wear and mild abrasive wear were the dominant wear

  6. Model development of UO_2-Zr dispersion plate-type fuel behavior at early phase of severe accident and molten fuel meat relocation

    International Nuclear Information System (INIS)

    Zhang Zhuohua; Yu Junchong; Peng Shinian

    2014-01-01

    According to former study on oxygen diffusion, Nb-Zr solid reaction and UO_2-Zr solid reaction, the models of oxidation, solid reaction in fuel meat and relocation of molten fuel meat are developed based on structure and material properties of UO_2-Zr dispersion plate-type fuel, The new models can supply theoretical elements for the safety analysis of the core assembled with dispersion plate-type fuel under severe accident. (authors)

  7. Synthesis and electrical properties of the pyrochlore-type Gd2-yLayZr2O7 solid solution

    Directory of Open Access Journals (Sweden)

    León, C.

    2008-06-01

    Full Text Available Different compositions in the pyrochlore-type Gd2-yLayZr2O7 solid solution (0 ≤ y ≤ 1 were prepared at room-temperature by mechanically milling stoichiometric mixtures of the corresponding oxides. Irrespective of their lanthanum content, as-prepared powder samples consist of single-phase anion deficient fluorite materials, although long-range ordering of cations and anion vacancies characteristic of pyrochlores was observed in all cases after firing the samples at 1500°C. Interestingly, activation energy for oxygen migration in the series decreases as La-content increases, from 1.13 eV for Gd2Zr2O7 to 0.81 eV for GdLaZr2O7, whereas ionic conductivity was found to be almost La-content independent, at least for y ≤ 0.8 at T = 500°C and y ≤ 0.4 at T = 800°C. These results are explained in terms of weaker ion-ion interactions in better ordered structures (i.e., as La-content increases and highlight the importance of structural ordering/disordering in determining the dynamics of mobile oxygen ions.Partiendo de mezclas estequiométricas de los óxidos correspondientes, se prepararon por molienda mecánica y a temperatura ambiente diferentes composiciones en la solución sólida Gd2-yLayZr2O7 (0 ≤ y ≤ 1 con estructura de tipo pirocloro y conductora de iones oxígeno. Independientemente del contenido de lantano, los polvos extraídos del molino presentaron difractogramas similares al de una fluorita no estequiométrica aunque en todos los casos, el tratamiento térmico a 1500°C indujo la aparición del ordenamiento de largo alcance de cationes y vacancias aniónicas característico de pirocloros. La energía de activación para el proceso de migración de iones oxígeno en la serie disminuye a medida que se incrementa el contenido de lantano, desde 1.13 eV de Gd2Zr2O7 hasta 0.81 eV de GdLaZr2O7, mientras que la conductividad resultó ser prácticamente independiente del mismo hasta y ≤ 0.8 para T = 500°C e y ≤ 0.4 para T = 800

  8. Investigation and modeling of Al3(Sc, Zr) precipitation strengthening in the presence of enhanced supersaturation and within Al-Cu binary alloys

    Science.gov (United States)

    Deane, Kyle

    Diffuse Al-Sc and Al-Zr alloys have been demonstrated in literature to be relatively coarsening resistant at higher temperatures when compared with commonly used precipitation strengthening alloys (e.g. 2000 series, 6000 series). However, because of a limited strengthening due to the low solubility of scandium and zirconium in aluminum, and owing to the scarcity and therefore sizeable price tag attached to scandium, little research has been done in the way of optimizing these alloys for commercial applications. With this in mind, this dissertation describes research which aims to tackle several important areas of Al-Sc-Zr research that have been yet unresolved. In Chapter 4, rapid solidification was utilized to enhance the achievable supersaturation of the alloy in an effort to increase the achievable precipitate strengthening. In Chapter 5, Additive Friction Stir processing (AFS), a novel method of mechanically combining materials without melting, was employed in an attempt to pass the benefits of supersaturation from melt spun ribbon into a more structurally useful bulk material. In Chapter 6, a Matlab program written to predict precipitate nucleation, growth, and coarsening with a modified Kampmann and Wagner Numerical (KWN) model, was used to predict heat treatment regimens for more efficient strengthening. Those predictions were then tested experimentally to test the validity of the results. And lastly, in Chapter 7, the effect of zirconium on Al-Cu secondary precipitates was studied in an attempt to increase their thermal stability, as much higher phase fractions of Al-Cu precipitates are achievable than Al-Zr precipitates.

  9. Effect of thermal strain on structure and polarization fatigue of CSD-derived PbZr0.53Ti0.47O3/LaNiO3 hetero-structures

    International Nuclear Information System (INIS)

    Wang, G.S.; Remiens, D.; Dogheche, E.; Dong, X.L.

    2007-01-01

    PbZr 0.53 Ti 0.47 O 3 /LaNiO 3 (PZT/LNO) hetero-structures have been successfully deposited on MgO, SrTiO 3 , Al 2 O 3 and Si substrate by chemical solution routes, respectively. The X-ray diffraction measurements show that out-of-plane lattice parameters of PZT increase as increase of thermal expansion coefficient of substrate. Polarization fatigues of Pt/PZT/LNO capacitors are strongly affected by the thermal strain caused by difference of thermal expansion coefficient between PZT and substrate materials. High fatigue resistance of Pt/PZT/LNO can be obtained by using substrate with similar thermal expansion coefficient as PZT. (orig.)

  10. Properties of lithium disilicate reinforced with ZrO{sub 2} (3mol%Y{sub 2}O{sub 3}; Propriedades de dissilicato de litio reforcado com ZrO{sub 2} (3mol%Y{sub 2}O{sub 3})

    Energy Technology Data Exchange (ETDEWEB)

    Alves, M.F.R.P.; Cossu, C.M.F.A.; Santos, C., E-mail: manuelfellipealves@gmail.com [Universidade do Estado do Rio de Janeiro (UERJ), Resende, RJ (Brazil). Faculdade de Tecnologia; Silva, C.L.M. [Centro Universitario de Volta Redonda (UniFOA), Volta Redonda, RJ (Brazil); Simba, B.G. [Universidade Estadual Paulista Julio de Mesquita Filho (UNESP), Guaratingueta, SP (Brazil). Faculdade de Engenharia; Fernandes, M.H.F. [Universidade de Aveiro (Portugal)

    2016-07-01

    The new generation of dental ceramics based on lithium disilicate, Li{sub 2}Si{sub 2}O{sub 5}, allows the production of restorative prosthetic with reduced times compared to alumina and / or zirconia (Y-TZP). A great limitation of their use is related low fracture strength of such glass-ceramics, which reduces their use in unit fixed prosthesis. In this work, lithium disilicate reinforced with 10% ZrO{sub 2} (3-mol% Y{sub 2}O{sub 3}) is characterized by relative density, crystalline phase, hardness, fracture toughness and microstructural aspects. Lithium metasilicate and tetragonal zirconia, prior to heat treatment. After thermal treatment under vacuum at 840 deg C-8min the lithium metasilicate is converted to lithium disilicate as the ZrO{sub 2} phase remains in the tetragonal structure. This maintenance of the tetragonal phase ensures the material a good fracture toughness, reaching average values near 2MPam{sup 1/2}, while the average hardness of 600HV. Morphological analysis of the samples indicates that ZrO{sub 2} particles are uniformly dispersed in the matrix composed of high aspect ratio lithium disilicate grains, which contributes to the results presented.. A critical analysis of the performance of toughening mechanisms such as cracks deflection, phase transformation of ZrO{sub 2} (T-M), residual stress between the matrix and the reinforcement are presented, discussed and compared with other ceramic materials used in dentistry restorer. (author)

  11. Crystallization and sintering characteristics of CaO-Al2O3-SiO2 glasses in the presence of TiO2, CaF2 and ZrO2

    International Nuclear Information System (INIS)

    Banijamali, S.; Eftekhari Yekta, B.; Rezaie, H.R.; Marghussian, V.K.

    2009-01-01

    In this study, the effects of different amounts of TiO 2 , ZrO 2 and CaF 2 nucleating agents on sinterability, crystallization, mechanical properties and chemical resistance of glass-ceramics belonging to the CaO-Al 2 O 3 -SiO 2 system were investigated, using differential thermal analysis (DTA), X-ray diffractometry (XRD), scanning electron microscopy (SEM), mechanical and chemical resistance measurements. It was found that in CaF 2 containing samples, the sinterability, crystallization and mechanical properties were improved by increasing of CaF 2 amount. However, addition of ZrO 2 and TiO 2 increases the firing temperature required for complete densification of specimens. Our experiments showed that fluctuations of chemical composition of the residual glass phases during sintering were responsible for these dissimilar trends and greatly influenced mechanical and chemical properties. According to the obtained results, appropriate sinterability, acceptable mechanical and chemical properties, as well as desirable whiteness of the most promising specimens make them suitable choices for floor tile applications. The main crystallization phases in all fully sintered glass-ceramics were wollastonite, anorthite and calcium aluminum silicate.

  12. Synthesis, structural and morphological characterization of Ca0.45Eu0.05Zr2(PO4)3 nano phosphors

    International Nuclear Information System (INIS)

    Alcaraz, L.; Isasi, J.; Peiteado, M.; Cabalero, A.

    2015-01-01

    Ca 0 .45Eu 0 .05Zr 2 (PO 4 ) 3 samples were synthesized by a preparation process in two step: a sol-gel method using two pH values, acid (pH ∼ 2) and basic pH (∼ 10), and a subsequent treatment of the precursor powders in a N 2 :H 2 (90:10) flow in order to stabilized 2+ oxidation state of europium. X-ray diffraction patterns exhibit diffraction maxima typical of NASICON type structure of rhombohedral symmetry and space group R-3. Most intense diffraction maxima are seen for the samples prepared in a basic reaction medium. Magnetic measurements confirm 2+ oxidation state of europium cations in the synthesized samples. Microscopy images show particles of spherical shape and nano metric size according to X-ray diffraction results, indicating that these samples may be useful in certain luminescent devices. (Author)

  13. Synthesis, crystal structure, and ionic conductivity of a new layered metal phosphate, Li2Sr2Al(PO4)3

    International Nuclear Information System (INIS)

    Kim, Sung-Chul; Kwak, Hyun-Jung; Yoo, Chung-Yul; Yun, Hoseop; Kim, Seung-Joo

    2016-01-01

    A new layered metal phosphate, Li 2 Sr 2 Al(PO 4 ) 3 , was synthesized in the form of either a single-crystal or polycrystalline powder using the molten hydroxide flux method or a solid-state reaction, respectively. Li 2 Sr 2 Al(PO 4 ) 3 crystallizes to the P2 1 /n (Z=4) monoclinic space group with lattice parameters a≈4.95 Å, b≈22.06 Å, c≈8.63 Å, and β≈91.5°. The structure is composed of stacked [LiSrAl(PO 4 ) 2 ] layers alternating regularly with [LiSrPO 4 ] layers. In the [LiSrAl(PO 4 ) 2 ] sublattice, the AlO 6 octahedra and PO 4 tetrahedra are tilted cooperatively to form an anionic, corrugated, two-dimensional [Al(PO 4 ) 2 ] 3− framework that can be regarded as a “distorted-glaserite” structure. The [LiSrPO 4 ] sublattice is that of a layered block containing a six-membered ring formed from alternating linkages of LiO 4 and PO 4 tetrahedra. The six-membered rings show a boat-type arrangement with the up(U) or down(D) pointing sequence, UUDUUD. The interspace between the two sublattices generates a two-dimensional pathway for Li + ion conduction. The impedance measurement indicated that Li 2 Sr 2 Al(PO 4 ) 3 had a moderate ion conductivity (σ≈1.30×10 −4 S cm −1 at 667 K), with an activation energy E a ≈1.02 eV. - Graphical abstract: Polyhedral view of Li 2 Sr 2 Al(PO 4 ) 3 . Li + ions are represented by green spheres, Sr atoms by white spheres, AlO 6 groups by octahedra, and PO 4 groups by tetrahedra. - Highlights: • New compound Li 2 Sr 2 Al(PO 4 ) 3 is reported. • The crystal structure is investigated by single-crystal XRD analysis. • The structure is formed by the alternate stacking of two different sublattices. • Correlation between the crystal structure and ionic conductivity is discussed.

  14. NIR luminescent Er{sup 3+}/Yb{sup 3+} co-doped SiO{sub 2}-ZrO{sub 2} nanostructured planar and channel waveguides: Optical and structural properties

    Energy Technology Data Exchange (ETDEWEB)

    Cunha, Cesar dos Santos [Departamento de Quimica, Faculdade de Filosofia, Ciencias e Letras de Ribeirao Preto, Universidade de Sao Paulo, Av. Bandeirantes, 3900, 14040-901, Ribeirao Preto/SP (Brazil); Ferrari, Jefferson Luis [Grupo de Pesquisa em Quimica de Materiais - (GPQM), Departamento de Ciencias Naturais, Universidade Federal de Sao Joao Del Rei, Campus Dom Bosco, Praca Dom Helvecio, 74, 36301-160, Sao Joao Del Rei, MG (Brazil); Oliveira, Drielly Cristina de [Departamento de Quimica, Faculdade de Filosofia, Ciencias e Letras de Ribeirao Preto, Universidade de Sao Paulo, Av. Bandeirantes, 3900, 14040-901, Ribeirao Preto/SP (Brazil); Maia, Lauro June Queiroz [Grupo Fisica de Materiais, Instituto de Fisica, UFG, Campus Samambaia, Caixa Postal 131, 74001-970, Goiania/GO (Brazil); Gomes, Anderson Stevens Leonidas [Departamento de Fisica, Universidade Federal de Pernambuco, Cidade Universitaria, Recife/PE, 50670-901 (Brazil); Ribeiro, Sidney Jose Lima [Laboratorio de Materiais Fotonicos, Instituto de Quimica, UNESP, Caixa Postal 355, 14801-970, Araraquara/SP (Brazil); and others

    2012-09-14

    Optical and structural properties of planar and channel waveguides based on sol-gel Er{sup 3+} and Yb{sup 3+} co-doped SiO{sub 2}-ZrO{sub 2} are reported. Microstructured channels with high homogeneous surface profile were written onto the surface of multilayered densified films deposited on SiO{sub 2}/Si substrates by a femtosecond laser etching technique. The densification of the planar waveguides was evaluated from changes in the refractive index and thickness, with full densification being achieved at 900 Degree-Sign C after annealing from 23 up to 500 min, depending on the ZrO{sub 2} content. Crystal nucleation and growth took place together with densification, thereby producing transparent glass ceramic planar waveguides containing rare earth-doped ZrO{sub 2} nanocrystals dispersed in a silica-based glassy host. Low roughness and crack-free surface as well as high confinement coefficient were achieved for all the compositions. Enhanced NIR luminescence of the Er{sup 3+} ions was observed for the Yb{sup 3+}-codoped planar waveguides, denoting an efficient energy transfer from the Yb{sup 3+} to the Er{sup 3+} ion. Highlights: Black-Right-Pointing-Pointer Sol-gel high NIR luminescent nanostructured planar and channel waveguides. Black-Right-Pointing-Pointer Microstructured channels written by a femtosecond laser etching technique. Black-Right-Pointing-Pointer Transparent glass ceramic with rare earth-doped ZrO{sub 2} nanocrystals in a silica host. Black-Right-Pointing-Pointer Enhanced NIR luminescence, efficient energy transfer from the Yb{sup 3+} to the Er{sup 3+} ion. Black-Right-Pointing-Pointer New planar channel waveguides to be applied as EDWA in the C telecommunication band.

  15. Thermodynamic study on co-deposition of ZrB2–SiC from ZrCl4–BCl3–CH3SiCl3–H2–Ar system

    International Nuclear Information System (INIS)

    Deng, Juanli; Cheng, Laifei; Zheng, Guopeng; Su, Kehe; Zhang, Litong

    2012-01-01

    Thermodynamics phase diagram of ZrB 2 –SiC co-deposited from precursors of ZrCl 4 –BCl 3 –CH 3 SiCl 3 (methyltrichlorosilane, MTS)–H 2 –Ar has been investigated in detail by using the FactSage code and its embedded database (130 species being involved). The yields of condensed phases in the co-deposition process have been examined as the functions of the inject reactant ratios of BCl 3 / (BCl 3 + MTS) and H 2 / (ZrCl 4 + BCl 3 + MTS), and the temperature at a fixed pressure of 5 kPa. The results show that their yields strongly depend on the molar ratios of the inject reactants and the temperature. Consequently, the pure ZrB 2 –SiC composite without free C, B 4 C, ZrC and ZrSi can be co-deposited under the ideal condition by adjusting the reactant ratios and the temperature. The gas-phase equilibrium concentration distribution shows that the high input amount of H 2 is favorable for the co-deposition of ZrB 2 and SiC at a fixed ratio of ZrCl 4 :BCl 3 :MTS:Ar. In the end, the theoretical results can lay down guidelines for increasing the experimental yields of ZrB 2 and SiC. - Highlights: ► The exact ratio of ZrB 2 and SiC could be obtained by adjusting input gas ratios. ► The other condensed phase species could appear under some suitable conditions ► The H 2 acting as reaction species directly influences the deposition process. ► The high H 2 input amount is favorable for the co-deposition of ZrB 2 and SiC. ► The flow rate range of the H 2 pump should be increased in the experimental study.

  16. The new insight into the structure-activity relation of Pd/CeO2-ZrO2-Nd2O3 catalysts by Raman, in situ DRIFTS and XRD Rietveld analysis.

    Science.gov (United States)

    Yang, X; Yang, L; Lin, J; Zhou, R

    2016-01-28

    Pd/CeO2-ZrO2-Nd2O3 (CZN) catalysts with different CeO2/ZrO2 molar ratios were synthesized and have been characterized by multiple techniques, e.g. XRD in combination with Rietveld refinement, UV-Raman, XPS and in situ DRIFTS. The XRD pattern of CZN with CeO2/ZrO2 molar ratios ≥1/2 can be indexed satisfactorily to the fluorite structure with a space group Fm3̄m, while the XRD patterns of CZ12 only display diffraction peaks of the tetragonal phase (S.G. P42/nmc). Nd addition can effectively stabilize the cubic structure of the CZN support and increase the enrichment of defect sites on the surface, which may be related to the better catalytic activity of Pd/CZN12 catalysts compared with Pd/CZ12. The presence of moderate ZrO2 can increase the concentration of O* active species, leading to accelerate the formation of nitrate species and thus enhance the catalytic activity of NOx and HC elimination. The Pd-dispersion decreases with the increasing Zr content, leading to the decreased CO catalytic activity, especially for the aged catalysts. The change regularity of the OSC value is almost the same with the in situ dynamic operational window, demonstrating that the in situ dynamic operational window is basically affected by the OSC value.

  17. Ni-free Zr-Cu-Al-Nb-Pd bulk metallic glasses with different Zr/Cu ratios for biomedical applications.

    Science.gov (United States)

    Huang, Lu; Yokoyama, Yoshihiko; Wu, Wei; Liaw, Peter K; Pang, Shujie; Inoue, Akihisa; Zhang, Tao; He, Wei

    2012-08-01

    Zr-based bulk metallic glasses (BMGs) possess attractive properties for prospective biomedical applications. The present study designs Ni-free Zr-Cu-Al-Nb-Pd BMGs and investigates their in vitro biocompatibility by studying mechanical properties, bio-corrosion resistance, and cellular responses. The Ti-6Al-4V alloy is used as a reference material. It is found that the Zr-based BMGs exhibit good mechanical properties, including high strengths above 1600 MPa, high hardness over 4700 MPa, and low elastic moduli of 85-90 GPa. The Zr-based BMGs are corrosion resistant in a simulated body environment, as revealed by wide passive regions, low passive current densities, and high pitting overpotentials. The formation of ZrO(2)-rich surface passive films of the Zr-based BMGs contributes to their high corrosion resistance, whereas their pitting corrosion in the phosphate buffered saline solution can be attributed to the sensitivity of the ZrO(2) films to the chloride ion. The general biosafety of the Zr-based BMGs is revealed by normal cell adhesions and cell morphologies. Moreover, the Zr/Cu content ratio in the alloy composition affects the biocompatibility of the Zr-based BMGs, by increasing their corrosion resistance and surface wettability with the increase of the Zr/Cu ratio. Effects of Zr/Cu ratios can be used to guide the future design of biocompatible Zr-based BMGs. Copyright © 2012 Wiley Periodicals, Inc.

  18. The fluorite-pyrochlore transformation of Ho2-yNdyZr2O7

    International Nuclear Information System (INIS)

    Clements, Richard; Hester, James R.; Kennedy, Brendan J.; Ling, Chris D.; Stampfl, Anton P.J.

    2011-01-01

    Twelve members of the Ho 2-y Nd y Zr 2 O 7 series, prepared using conventional solid state methods, have been characterised by neutron powder diffraction. Ho 2 Zr 2 O 7 has a defect fluorite structure whereas Nd 2 Zr 2 O 7 is found to adopt the ordered pyrochlore structure with the composition induced fluorite-pyrochlore transformation occurring near y=1. Rietveld analysis on the neutron data for all the compositions reveals an increase in lattice parameter as a function of y across the entire series, with a small discontinuity associated with the transformation. The neutron profile results suggest that domains of pyrochlore-type initially begin to form before crystallising into a separate phase, and therefore that anion and cation ordering processes are distinct. There is a strong correlation between the extent of disorder in the anion sublattice and the x-parameter of 48f oxygen. These results point the way to a better understanding of the stability observed in pyrochlore structures. - Graphical abstract: Neutron diffraction profiles for Nd 2-y Ho y Zr 2 O 7 type oxides reveal details of the transformation from the ordered pyrochlore structure (y=0) to the disordered fluorite structure (y=2). Highlights: → Structures of twelve members of the Ho 2-y Nd y Zr 2 O 7 series studied using neutron powder diffraction. → Domains of pyrochlore-type materials form at low doping levels. → Higher doping stabilises the pyrochlore. → Anion and cation ordering processes are distinct.

  19. Effect of Cu2+ ion incorporation on the phase development of ZrO2-type solid solutions during the thermal treatments

    International Nuclear Information System (INIS)

    Stefanic, Goran; Music, Svetozar; Ivanda, Mile

    2010-01-01

    The amorphous precursors of the ZrO 2 -CuO system at the ZrO 2 -rich side of the concentration range were prepared by co-precipitation from aqueous solutions of the corresponding salts. Thermal behavior of the amorphous precursors was monitored using X-ray powder diffraction, Raman spectroscopy, field emission scanning electron microscopy, energy dispersive X-ray spectrometry, differential scanning calorimetry and thermogravimetric analysis. The crystallization temperature of the amorphous precursors rose with an increase in the CuO content for ∼180 o C. Maximum solubility of Cu 2+ ions in the ZrO 2 lattice (∼23 mol%) occurs in the metastable products obtained upon crystallization of the amorphous precursors. The results of Raman spectroscopy indicate that the incorporation of Cu 2+ ions stabilize the tetragonal ZrO 2 polymorph. A precise determination of lattice parameters, using both Rietveld and Le Bail refinements of the powder diffraction patterns, showed that the axial ratio c/a in the ZrO 2 -type solid solutions with a Cu 2+ content ≥20 mol% approach 1 (formation of t''-form of tetragonal phase). The terminal solid solubility limit of Cu 2+ ions in the ZrO 2 lattice rapidly drops with an increase in treatment temperature (up to 1000 o C) that is followed by the formation of and increase in phases structurally closely related to tenorite and monoclinic ZrO 2 . Low thermal stability of the t-ZrO 2 -type phase was attributed to the reduction of the sintering temperature in the presence of CuO and a significant difference in size and shape of zirconia and tenorite particles, which prevent surface interactions.

  20. Obtaining and characterizing the binary compound Zr3Pt

    International Nuclear Information System (INIS)

    Tanoni, Diego; Arico, Sergio F; Alonso, Paula R

    2006-01-01

    The equilibrium phases in the Zr - Pt binary system are not fully defined. Experiences carried out from 0% to 50% at. Pt in the equilibrium diagram of Zr-Pt phases in 2001 revealed the presence of the intermetallic compounds Zr 2 Pt, Zr 5 Pt 3 , ZrPt (already previously identified by other authors) and a compound of 25% composition at Pt with an unidentified crystalline structure. This experimental work aims to fill out the information on this compound by characterizing its crystallography. An alloy was produced in the binary system Zr-Pt with a composition close to the stoichiometry by casting in an arc furnace, and was studied by optic and electronic metallography. The identification and crystallographic characterization of the phase is based on measurements of composition in electronic microwave and on analysis of spectrums obtained by X-ray diffraction. The results are presented, showing the presence in the cast structure of the solid solution zircon phases (hexagonal) and of the inter-metallic compound Zr 5 Pt 3 . These two phases were identified in the X-ray diffraction diagrams as well as the presence of other reflections that are associated with the inter-metallic Zr 3 Pt. The measurements of composition consistently reveal the presence of a phase of 25%at Pt composition. The structure's morphology shown in metallographies reveals the occurrence of a eutectic type transformation during cooling. We conclude that the formation of the phase sought in a composition 25 % at Pt should occur at temperatures below the eutectic transformation, and could be a peritectoid formation as was previously proposed. Therefore, the sample needs to be homogenized with thermal treatments that favor the formation and stabilization of the compound (CW)

  1. Fatigue in artificially layered Pb(Zr,Ti)O3 ferroelectric films

    Science.gov (United States)

    Jiang, A. Q.; Scott, J. F.; Dawber, M.; Wang, C.

    2002-12-01

    We have performed fatigue tests on lead zirconate titanate (PZT) multilayers having stacks of Pb(Zr0.8Ti0.2)O3/Pb(Zr0.2Ti0.8)O3 with repeated distances of 12 formula groups. The results are compared with single-layer n-type (0.5 at. % Ta-doped) PZT films. We conclude that fatigue is dominated by space-charge layers in each case, but that in the multilayer such space charge accumulates at the layer interfaces, rather than at the electrode-dielectric interface. The model, which includes both drift and diffusion, is quantitative and yields a rate-limiting mobility of 6.9±0.9×10-12 cm2/V s, in excellent agreement with the oxygen vacancy mobility for perovskite oxides obtained from Zafar et al.

  2. In vitro bio-functional performances of the novel superelastic beta-type Ti-23Nb-0.7Ta-2Zr-0.5N alloy.

    Science.gov (United States)

    Ion, Raluca; Gordin, Doina-Margareta; Mitran, Valentina; Osiceanu, Petre; Dinescu, Sorina; Gloriant, Thierry; Cimpean, Anisoara

    2014-02-01

    The materials used for internal fracture fixations and joint replacements are mainly made of metals which still face problems ranging from higher rigidity than that of natural bone to leaching cytotoxic metallic ions. Beta (β)-type titanium alloys with low elastic modulus made from non-toxic and non-allergenic elements are desirable to reduce stress shielding effect and enhance bone remodeling. In this work, a new β-type Ti-23Nb-0.7Ta-2Zr-0.5N alloy with a Young's modulus of approximately 50 GPa was designed and characterized. The behavior of MC3T3-E1 pre-osteoblasts on the new alloy, including adhesion, proliferation and differentiation, was evaluated by examining the cytoskeleton, focal adhesion formation, metabolic activity and extracellular matrix mineralization. Results indicated that the pre-osteoblast cells exhibited a similar degree of attachment and growth on Ti-23Nb-0.7Ta-2Zr-0.5N and Ti-6Al-4V. However, the novel alloy proved to be significantly more efficient in sustaining mineralized matrix deposition upon osteogenic induction of the cells than Ti-6Al-4V control. Further, the analysis of RAW 264.7 macrophages cytokine gene and protein expression indicated no significant inflammatory response. Collectively, these findings suggest that the Ti-23Nb-0.7Ta-2Zr-0.5N alloy, which has an increased mechanical biocompatibility with bone, allows a better osteogenic differentiation of osteoblast precursor cells than Ti-6Al-4V and holds great potential for future clinical prosthetic applications. Copyright © 2013 Elsevier B.V. All rights reserved.

  3. The structural properties of Zr-based bulk metallic glasses subjected to high pressure torsion at different temperatures

    International Nuclear Information System (INIS)

    Boltynjuk, E. V.; Ubyivovk, E. V.; Kshumanev, A. M.; Gunderov, D. V.; Lukianov, A. V.; Bednarz, A.; Valiev, R. Z.

    2016-01-01

    The structural properties of a Zr_6_2Cu_2_2Al_1_0Fe_5Dy_1 bulk metallic glasses were investigated. Cylindrical rods of the Zr_6_2Cu_2_2Al_1_0Fe_5Dy_1 BMG were subjected to high pressure torsion at temperatures of 20°C and 150°C. X-ray diffraction, transmission electron microscopy were used to determine peculiarities of the modified structure. Analysis of fracture surfaces, nanohardness measurements were conducted to investigate the influence of structural changes on mechanical behavior of processed samples.

  4. Non-isothermal crystallization kinetics and fragility of (Cu46Zr47Al7)97Ti3 bulk metallic glass investigated by differential scanning calorimetry

    International Nuclear Information System (INIS)

    Zhu, Man; Li, Junjie; Yao, Lijuan; Jian, Zengyun; Chang, Fang’e; Yang, Gencang

    2013-01-01

    Highlights: • Non-isothermal crystallization kinetics of (Cu 46 Zr 47 Al 7 ) 97 Ti 3 BMGs was studied. • Two-stage of crystallization process is confirmed by DSC. • The nucleation process is difficult than growth process during crystallization. • The second crystallization process is the most sensitive to heating rate. • Kinetic fragility index is evaluated suggesting it is an intermediate glass. - Abstract: In this paper, bulk metallic glasses with the composition of (Cu 46 Zr 47 Al 7 ) 97 Ti 3 were prepared by copper mold casting technique. X-ray diffraction (XRD) and differential scanning calorimetry (DSC) were used to investigate its structure and non-isothermal crystallization kinetics. DSC traces revealed that it undergoes two-stage crystallization. The activation energies corresponding to the characteristic temperatures have been calculated, and the results reveal that the as-cast alloys have a good thermal stability in thermodynamics. Based on Kissinger equation, the activation energies for glass transition, the first and second crystallization processes were obtained as 485 ± 16 kJ/mol, 331 ± 7 kJ/mol and 210 ± 3 kJ/mol, respectively, suggesting that the nucleation process is more difficult than the grain growth process. The fitting curves using Lasocka's empirical relation show that the influence of the heating rate for crystallization is larger than glass transition. Furthermore, the kinetic fragility for (Cu 46 Zr 47 Al 7 ) 97 Ti 3 bulk metallic glasses is evaluated. Depending on the fragility index, (Cu 46 Zr 47 Al 7 ) 97 Ti 3 bulk metallic glasses should be considered as “intermediate glasses”

  5. Porosity and biocompatibility study of ceramic implants based on ZrO{sub 2} and Al{sub 2}O{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Litvinova, Larisa, E-mail: larisalitvinova@yandex.ru, E-mail: vshupletsova@mail.ru, E-mail: leitsin@mail.ru; Shupletsova, Valeria, E-mail: larisalitvinova@yandex.ru, E-mail: vshupletsova@mail.ru, E-mail: leitsin@mail.ru; Leitsin, Vladimir, E-mail: larisalitvinova@yandex.ru, E-mail: vshupletsova@mail.ru, E-mail: leitsin@mail.ru [Immanuel Kant Baltic Federal University, Kaliningrad (Russian Federation); Vasyliev, Roman, E-mail: rvasiliev@ukr.net, E-mail: zoubov77@yahoo.com; Zubov, Dmitry, E-mail: rvasiliev@ukr.net, E-mail: zoubov77@yahoo.com [State Institute of Genetic and Regenerative Medicine, National Academy of Medical Sciences of Ukraine, Kiev (Ukraine); Buyakov, Ales, E-mail: kulkov@ms.tsc.ru, E-mail: kulkov@ms.tsc.ru; Kulkov, Sergey, E-mail: kulkov@ms.tsc.ru, E-mail: kulkov@ms.tsc.ru [Institute of Strength Physics and Materials Science SB RAS, Tomsk, 634055 (Russian Federation); National Research Tomsk State University, Tomsk, 634050 (Russian Federation); National Research Tomsk Polytechnic University, Tomsk, 634050 (Russian Federation)

    2014-11-14

    The work studies ZrO{sub 2}(Me{sub x}O{sub y})-based porous ceramics produced from the powders consisting of hollow spherical particles. It was shown that the structure is represented by a cellular framework with bimodal porosity consisting of sphere-like large pores and pores that were not filled with the powder particles during the compaction. For such ceramics, the increase of pore volume is accompanied by the increased strain in an elastic area. It was also shown that the porous ZrO{sub 2} ceramics had no acute or chronic cytotoxicity. At the same time, ceramics possess the following osteoconductive properties: adhesion support, spreading, proliferation and osteogenic differentiation of MSCs.

  6. Erosion-corrosion and surface protection of A356 Al/ZrO2 composites produced by vortex and squeeze casting

    International Nuclear Information System (INIS)

    El-Khair, M.T. Abou; Aal, A. Abdel

    2007-01-01

    Erosive-corrosive wear behavior of Al-Si-Mg (A356 Al) alloy and its composite reinforced by ZrO 2 and produced by vortex and squeeze techniques has been studied in water containing 40% sand slurry. The worn surfaces of investigated alloys have been studied and the mechanism of material removal from the specimen surface was examined to be associated with number of subsequent and repetitive stages. The possibility of Ni coating for Al composites by electrochemical deposition is investigated. The surface layer was characterized by microhardness measurements, optical microscope, scanning electron microscopy (SEM) and energy dispersive X-ray analysis (EDX) analysis. The electrochemical results obtained from polarization studies for Ni-coated, A356 Al alloy and composites in 3.5% sodium chloride solution indicated higher protection exhibited by Ni coatings due to the nickel properties. The squeezed cast composite is characterized by high corrosion and wear resistance comparing the composite produced by vortex process. This study revealed that the Ni-coated materials provide higher abrasive resistance and therefore a longer service life compared to A356 Al-ZrO 2

  7. Enhanced flux pinning by BaZrO3 and (Gd,y)2O3 nano-structures in metal organic chemical vapor deposited GdYBCO high temperature superconductor tapes

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Y [SuperPower Incorporated, Schenectady, New York; Selvamanickam, V. [SuperPower Incorporated, Schenectady, New York; Paranthaman, Mariappan Parans [ORNL; Cantoni, Claudia [ORNL; Aytug, Tolga [ORNL; Goyal, Amit [ORNL; Lee, Dominic F [ORNL; Specht, Eliot D [ORNL; Zuev, Yuri L [ORNL; Zhang, Yifei [ORNL

    2009-01-01

    We have formed BaZrO3 nano-columns and (Gd,Y)2O3 nano-precipitates in reel-to-reel MOCVD processed (Gd,Y)Ba2Cu3O7-x coated conductors and increased the critical currents (Ic) of the conductors in applied magnetic fields to remarkable levels. A (Gd,Y)Ba2Cu3O7-x tape of 1m length with 6.5% Zr-additions and 30% composition rich in both Gd and Y showed Ic values of 813 A/cm-width at (self-field, 77K) and above 186 A/cm-width at (1T, 77K). The strongly enhanced flux pinning over a wide range of magnetic field orientations can be attributed to the bidirectionally aligned defect structures of BaZrO3 and (Gd,Y)2O3 created by optimized MOCVD conditions.

  8. Physical properties of Zr50Cu40-xAl10Pdx bulk glassy alloys

    International Nuclear Information System (INIS)

    Wencka, M.; Jagodic, M.; Gradisek, A.; Kocjan, A.; Jaglicic, Z.; McGuiness, P.J.; Apih, T.; Yokoyama, Y.; Dolinsek, J.

    2010-01-01

    It was shown recently (Yokoyama et al. ) that the addition of a small amount of Pd to the Zr 50 Cu 40 Al 10 bulk glassy alloy (BGA) has a beneficial effect on fatigue-strength enhancement, where the composition Zr 50 Cu 37 Al 10 Pd 3 behaved in a resonant-like way by showing the highest fatigue limit of 1050 MPa and the minimum Vickers hardness. We performed a study of the magnetic properties, the specific heat, the electrical resistivity and the hydrogen-diffusion constant for a series of compositions Zr 50 Cu 40-x Al 10 Pd x (x = 0-7 at.%), in order to determine their physical properties and to check for the influence of the Pd content on these properties. The Zr 50 Cu 40-x Al 10 Pd x BGAs are nonmagnetic, conducting alloys, where the Pauli spin susceptibility of the conduction electrons is the only source of paramagnetism. The low-temperature specific heat indicates an enhancement of the conduction-electron effective mass m* below 5 K, suggesting that the Zr 50 Cu 40-x Al 10 Pd x BGAs are not free-electron-like compounds. The electrical resistivities of the Zr 50 Cu 40-x Al 10 Pd x BGAs amount to about 200 μΩ cm and show a small, negative temperature coefficient (NTC) with an increase from 300 to 2 K of 4%. The hydrogen self-diffusion constant D in hydrogen-loaded samples shows classical over-barrier-hopping temperature dependence and is of comparable magnitude to the related icosahedral and amorphous Zr 69.5 Cu 12 Ni 11 Al 7.5 hydrogen-storage alloys. No correlation between the investigated physical parameters and the Pd content of the samples could be observed.

  9. Synthesis and cathodoluminescence characterization of ZrO2:Er3+ films

    International Nuclear Information System (INIS)

    Martínez-Hernández, A.; Guzmán-Mendoza, J.; Rivera-Montalvo, T.; Sánchez-Guzmán, D.; Guzmán-Olguín, J.C.; García-Hipólito, M.; Falcony, C.

    2014-01-01

    Trivalent erbium doped zirconium oxide films were deposited by the ultrasonic spray pyrolysis technique. Films were deposited using zirconium tetrachloride octahydrate (ZrCl 4 O·8H 2 O) and erbium nitrate hexahydrate ((NO 3 ) 3 Er·6H 2 O) as precursors and deionized water as solvent. The dopant concentrations in the spray solution were 1, 3, 5, 10 and 15 at% in ratio to zirconium content. The films were deposited on corning glass substrates at different temperatures from 400 up to 550 °C. Films deposited at temperatures lower than 400 °C were amorphous, however, as substrate temperatures are increased, the ZrO 2 films presented a better crystallinity and showed a tetragonal phase. Cathodoluminescence (CL) emission spectra showed bands centred at 524, 544 and 655 nm associated with the electronic transition of Er 3+ . - Highlights: • The films of ZrO 2 :Er 3+ were obtained by spray pyrolysis. • Emission spectra of ZrO 2 :Er 3+ films were reported. • Cathodoluminescence of ZrO 2 :Er 3+ films was analyzed. • Cathodoluminescence of ZrO 2 :Er 3+ films showed strong dependence on substrate temperature and electron voltage

  10. Wear studies on ZrO{sub 2}-filled PEEK as coating bearing materials for artificial cervical discs of Ti6Al4V

    Energy Technology Data Exchange (ETDEWEB)

    Song, Jian [State Key Laboratory of Tribology, Tsinghua University, Beijing 100084 (China); Department of Mechanical Engineering, Tsinghua University, Beijing 100084 (China); Liu, Yuhong, E-mail: liuyuhong@tsinghua.edu.cn [State Key Laboratory of Tribology, Tsinghua University, Beijing 100084 (China); Department of Mechanical Engineering, Tsinghua University, Beijing 100084 (China); Liao, Zhenhua; Wang, Song [Department of Mechanical Engineering, Tsinghua University, Beijing 100084 (China); Biomechanics and Biotechnology Lab, Research Institute of Tsinghua University in Shenzhen, Shenzhen 518057 (China); Tyagi, Rajnesh [Department of Mechanical Engineering, Indian Institute of Technology (BHU) Varanasi, Varanasi 221005 (India); Liu, Weiqiang, E-mail: weiqliu@hotmail.com [State Key Laboratory of Tribology, Tsinghua University, Beijing 100084 (China); Biomechanics and Biotechnology Lab, Research Institute of Tsinghua University in Shenzhen, Shenzhen 518057 (China)

    2016-12-01

    Polyetheretherketone (PEEK) and its composite coatings are believed to be the potential candidates' bio-implant materials. However, these coatings have not yet been used on the surface of titanium-based orthopedics and joint products and very few investigations on the tribological characteristics could be found in the published literature till date. In this study, the wettabilities, composition and micro-hardness were characterized using contact angle measurement, scanning electron microscopy (SEM) and hardness tester. The tribological tests were conducted using a ball-on-disc contact pair under 25% newborn calf serum (NCS) lubricated condition. For comparison, bare Ti6Al4V was studied. The obtained results revealed that those PEEK/ZrO{sub 2} composite coatings could improve the tribological properties of Ti6Al4V significantly. Adhesive wear and mild abrasive wear might be the dominant wear and failure mechanisms for PEEK/ZrO{sub 2} composite coatings in NCS lubricated condition. After comprehensive evaluation in the present study, 5 wt.% ZrO{sub 2} nanoparticles filled PEEK coating displayed the optimum tribological characteristics and could be taken as a potential candidate for the bearing material of artificial cervical disc. - Graphical abstract: Polyetheretherketone (PEEK) is a type of biomaterial which might be used in surface modification. In this study, the wettabilities, composition, hardness, friction and wear characteristics of PEEK/ZrO{sub 2} coatings were investigated, compared with bare Ti6Al4V sample. After comprehensive evaluation, 5 wt.% ZrO{sub 2} nanoparticles filled PEEK coating displayed the optimum tribological characteristics and could be taken as a potential candidate for the bearing material of artificial cervical disc. - Highlights: • PEEK coating were filled by ZrO{sub 2} nanoparticles with different weight percentage. • The lubrication regime of all the tested samples are boundary lubrication. • Adhesive wear and mild abrasive

  11. Electronic structure and optical absorption spectra of Y2 and Zr2 dimers

    International Nuclear Information System (INIS)

    Gutsev, G.L.

    1989-01-01

    The electron structure, ionization potentials from valent levels and energies of optic transitions of Y 2 and Zr 2 dimers are calculated within the framework of discrete-variatin X α -method. It is shown that the symmetry state 1 Σ g + is the main state of Y 2 and Zr 2 dimers, and the atoms in dimers have high-spin 4d n+1 5s 1 configuration. The chemical binding in Y 2 has the dominating 5s-5s nature which is revealed in a considerable interatomic distance; binding of 4d-electrons brings about a significant decrease in the bond length in Zr 2 dimer. The theoretical spectrum of optical absorption of Zr 2 agrees well with the obtained experimental spectrum of this molecule isolated in the organ matrix

  12. Glass forming ability and mechanical properties of the NiZrTiSi amorphous alloys modified with Al, Cu and Nb additions

    International Nuclear Information System (INIS)

    Czeppe, Tomasz; Ochin, Patrick; Sypien, Anna

    2007-01-01

    The composition of the amorphous alloy Ni 59 Zr 20 Ti 16 Si 5 was modified with 2-9 at.% additions of Cu, Al and Nb. The ribbons and the bars 2.7 mm in diameter were prepared by melt spinning and injection casting from the alloys of the compositions: Ni 56 Zr 18 Ti 16 Si 5 Al 3 Cu 2 , Ni 56 Zr 18 Ti 13 Al 6 Si 5 Cu 2 , Ni 56 Zr 16 Ti 12 Nb 9 Al 3 Cu 2 Si 2 and Ni 56 Zr 16 Ti 12 Nb 6 Al 6 Cu 2 Si 2 . All ribbons were amorphous up to the resolution of the X-ray diffraction and conventional transmission electron microscopy, however rods were partially crystalline. Increase of Al content lowered and Nb content slightly increased crystallization start temperature T x and glass transition temperature T g . The influence of composition changes on the overcooled liquid range ΔT was more complicated. The increase of Nb and decrease of Ti and Zr content led to the remarkable increase of the liquidus temperature T l . As a result GFA calculated as T g /T l was lowered to the values about 0.63 for 6 and 9 at.% Nb addition. The activation energies for primary crystallization in alloy with 6 at.% Al and 6 at.% of Nb, were determined. The changes of tensile test strength and microhardness with Al and Nb additions showed hardening effect caused by Nb additions and increase in fracture strength with increasing Al content

  13. Local atomic structure in tetragonal pure ZrO{sub 2} nanopowders

    Energy Technology Data Exchange (ETDEWEB)

    Acuna, Leandro M.; Lamas, Diego G.; Fuentes, Rodolfo O.; Fabregas, Ismael O. [CITEFA-CONICET, Villa Martelli, Provincia de Buenos Aires (AR). CINSO (Centro de Investigaciones en Solidos); Fantini, Marcia C.A.; Craievich, Aldo F. [Universidade de Sao Paulo (Brazil). Inst. de Fisica; Prado, Rogerio J. [Universidade Federal de Mato Grosso (UFMT), Cuiaba (Brazil). Inst. de Fisica

    2010-04-15

    The local atomic structures around the Zr atom of pure (undoped) ZrO{sub 2} nanopowders with different average crystallite sizes, ranging from 7 to 40 nm, have been investigated. The nanopowders were synthesized by different wetchemical routes, but all exhibit the high-temperature tetragonal phase stabilized at room temperature, as established by synchrotron radiation X-ray diffraction. The extended X-ray absorption fine structure (EXAFS) technique was applied to analyze the local structure around the Zr atoms. Several authors have studied this system using the EXAFS technique without obtaining a good agreement between crystallographic and EXAFS data. In this work, it is shown that the local structure of ZrO{sub 2} nanopowders can be described by a model consisting of two oxygen subshells (4+4 atoms) with different Zr-O distances, in agreement with those independently determined by X-ray diffraction. However, the EXAFS study shows that the second oxygen subshell exhibits a Debye-Waller (DW) parameter much higher than that of the first oxygen subshell, a result that cannot be explained by the crystallographic model accepted for the tetragonal phase of zirconia-based materials. However, as proposed by other authors, the difference in the DW parameters between the two oxygen subshells around the Zr atoms can be explained by the existence of oxygen displacements perpendicular to the z direction; these mainly affect the second oxygen subshell because of the directional character of the EXAFS DW parameter, in contradiction to the crystallographic value. It is also established that this model is similar to another model having three oxygen subshells, with a 4+2+2 distribution of atoms, with only one DW parameter for all oxygen subshells. Both models are in good agreement with the crystal structure determined by X-ray diffraction experiments. (orig.)

  14. Disordered crystal structure of 20H-AlON, Al10O3N8

    International Nuclear Information System (INIS)

    Banno, Hiroki; Funahashi, Shiro; Asaka, Toru; Hirosaki, Naoto; Fukuda, Koichiro

    2015-01-01

    The disordered crystal structure of 20H-AlON (Al 10 O 3 N 8 ) was determined by combined use of X-ray powder diffraction and transmission electron microscopy. The title compound is hexagonal with space group P6 3 /mmc (Z=2) and the unit-cell dimensions are a=0.307082(5) nm, c=5.29447(8) nm and V=0.432376(12) nm 3 . The structural model showed the positional disordering of three of the six Al sites in the unit cell. The reliability indices calculated from the Rietveld method were R wp =6.97%, S (=R wp /R e )=1.68, R p =5.45%, R B =5.13% and R F =4.56%. We interpreted the disordered structure of 20H-AlON as a statistical average of six different types of ordered structural configurations, which are composed of an octahedral [Al(O, N) 6 ] layer and tetrahedral [Al(O, N) 4 ] layers. We demonstrated the high correlations between the hexagonal unit-cell dimensions and the octahedral layer concentrations for AlON and SiAlON polytypoids. - Graphical abstract: Variations of a and c/(n O +n T ) with n O /(n O +n T ). The a and c are the hexagonal unit-cell dimensions of AlON, SiAlON and AlN. The n O and n T are, respectively, the numbers of octahedral and tetrahedral layers in the unit cells. The unit-cell dimensions in literature are plotted in black plus for AlON and black cross for SiAlON. The unit-cell dimensions of AlN are a=0.3110 nm and c=0.4980 nm. - Highlights: • Crystal structure of Al10O3N8 is determined by laboratory X-ray powder diffraction. • The atom arrangements are represented by the split-atom model. • Six types of ordered atom arrangements are derived from the disordered structure. • Hexagonal unit-cell dimensions changed systematically for AlON and SiAlON compounds

  15. Magnetic and structural behavior of Sr2ZrMnO6 double perovskite

    International Nuclear Information System (INIS)

    Llamosa, D.P.; Landinez Tellez, D.A.; Roa-Rojas, J.

    2009-01-01

    We report synthesis and characterization of new Sr 2 ZrMnO 6 manganite-like material. Samples were produced by the solid state reaction method with sinterization temperatures up to 1400 deg. C. X-ray diffraction experiments reveal that structure belongs to the perovskite system, space group Fm3-barm(no. 225). Lattice parameter a=7.86A was obtained by means of Rietveld-type refinement, through the GSAS code. Magnetic properties were studied by using an MPMS Quantum Design SQUID. From measurements of magnetization as a function of temperature, we determine the occurrence of a paramagnetic-antiferromagnetic transition with Neel temperature 50 K. Curie-Weiss fitting permitted to obtain the magnetic characteristic parameters. At temperature regimes below the Neel temperature, strong evidences of frustration and an irreversibility temperature between zero field cooling (ZFC) and field cooling (FC) measurements were observed. Curves of magnetization as a function of applied field were performed at T=4K. Results show a hysteretic feature for Sr 2 ZrMnO 6 magnetic material. This response is attributed to formation of magnetic clusters as a consequence of cationic (magnetic and no magnetic) disorder along the double perovskite structure.

  16. Synergetic effects of Sc and Zr microalloying and heat treatment on mechanical properties and exfoliation corrosion behavior of Al-Mg-Mn alloys

    International Nuclear Information System (INIS)

    Peng, Yongyi; Li, Shu; Deng, Ying; Zhou, Hua; Xu, Guofu; Yin, Zhimin

    2016-01-01

    Mechanical properties, exfoliation corrosion behavior and microstructure of Al-5.98Mg-0.47Mn and Al-6.01Mg-0.45Mn-0.25Sc-0.10Zr (wt%) alloy sheets under various homogenizing and annealing processes were investigated comparatively by tensile tests, electrochemical measurements, X-ray diffraction technique and microscopy methods. The as-cast alloys mainly consist of Fe and Mn enriched impurity phases, Mg and Mn enriched non-equilibrium aluminides and Mg 3 Al 2 phases. During homogenization treatment, solvable intermetallics firstly precipitate and then dissolve into matrix. The optimized homogenization processes for removing micro-segregation and obtaining maximum precipitation strengthening of secondary Al 3 (Sc, Zr) particles are 440 °C×8 h and 300 °C×8 h, respectively. Sc and Zr additions can make the yield strength of Al-Mg-Mn alloy increase by 21 MPa (6.9%), 120 MPa (61.2%) and 127 MPa (68.3%), when annealed at 270 °C, 300 °C and 330 °C, respectively, indicating that Orowan precipitation strengthening caused by secondary Al 3 (Sc, Zr) nano-particles is much greater than grain boundary strengthening from primary Al 3 (Sc, Zr) micro-particles. Increasing homogenization and annealing degrees and adding Sc and Zr all can decrease corrosion current density and improve exfoliation corrosion resistance. The exfoliation corrosion behavior is dominant by anodic dissolution occurring at the interface between intermetallics and α(Al) matrix. After homogenizing at 440 °C for 8 h and annealing at 300 °C for 1 h, yield strength, ultimate strength, elongation to failure and exfoliation corrosion rank are 196 MPa, 360 MPa, 20.2% and PA (slight pitting corrosion) in Al-Mg-Mn alloy, and reach to 316 MPa, 440 MPa, 17.0% and PA in Al-Mg-Mn-Sc-Zr alloy, respectively, revealing that high strength, high ductility and admirable corrosion resistance of Al-Mg-Mn alloys can be achieved by the synergetic effects of Sc and Zr microalloying and heat treatment.

  17. Ordering of calcium and vacancies in calcium catapleiite CaZr[Si3O9] • 2H2O

    International Nuclear Information System (INIS)

    Aksenov, S. M.; Portnov, A. M.; Chukanov, N. V.; Rastsvetaeva, R. K.; Nelyubina, Yu. V.; Kononkova, N. N.; Akimenko, M. I.

    2016-01-01

    A sample of holotypic calcium catapleiite from the Burpala alkaline massif (Northern Baikal, Russia) is studied by single crystal X-ray analysis at 120 K and IR spectroscopy. The empirical formula of calcium catapleiite is Ca 0.97 Na 0.02 Zr 1.01 Si 3 O 9 • 2H 2 O (Z = 4). The X-ray diffraction study confirms the orthorhombic unit cell with the following parameters: a = 7.406(1), b = 12.687(1), and c = 10.112(1) Å; V = 950.1(2) Å 3 ; space group Pbnn. The crystal structure is refined in the anisotropic approximation of atomic displacement parameters using 1177 reflections with I > 2σ(I) to the final R = 2.91%. The structure of calcium catapleiite under study is based on the microporous heteropolyhedral framework formed by ZrO 6 octahedra and threemembered silicon–oxygen rings [Si 3 O 9 ]. It is on the whole analogous to the structures of the samples studied earlier, but differs from them by a high degree of ordering of calcium and vacancies at extraframework positions. The distribution of calcium over Ca1 and Ca2 positions in the calcium catapleiite structure leads to the formation of zigzag chains of the …Ca1–Zr–Ca1–Zr… and …Ca2–h–Ca2–□… types. Low occupancy of the Ca2 position and its alternation with the vacancy are prerequisites for potential Ca 2+ cationic conduction.

  18. Performance of cubic ZrO{sub 2} doped CeO{sub 2}: First-principles investigation on elastic, electronic and optical properties of Ce{sub 1−x} Zr{sub x}O{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Tian, Dong [State Key Laboratory of Complex Nonferrous Metal Resources Clean Utilization, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Zeng, Chunhua, E-mail: zchh2009@126.com [State Key Laboratory of Complex Nonferrous Metal Resources Clean Utilization, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Faculty of Science, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Wang, Hua, E-mail: wanghuaheat@hotmail.com [State Key Laboratory of Complex Nonferrous Metal Resources Clean Utilization, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Luo, Hongchun [Faculty of Science, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Cheng, Xianming [State Key Laboratory of Complex Nonferrous Metal Resources Clean Utilization, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Xiang, Chao [College of Mechanical and Electrical Engineering, Yangtze Normal University, Fuling 408100, Chongqing (China); Wei, Yonggang; Li, Kongzhai; Zhu, Xing [State Key Laboratory of Complex Nonferrous Metal Resources Clean Utilization, Kunming University of Science and Technology, Kunming 650093, Yunnan (China); Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming 650093, Yunnan (China)

    2016-06-25

    The structural, elastic, electronic and optical properties of Ce{sub 1−x} Zr{sub x}O{sub 2} (x = 0, 0.25, 0.5, 0.75, 1) fluorite type oxides are studied by researchers using the method of density functional theory (DFT) + U method. The calculated equilibrium lattice parameter, cell volume, elastic and optical properties for CeO{sub 2} and ZrO{sub 2} are all in good agreement with the available experimental data and other theoretical results. It is found that Ce substituted by Zr leads to the formation of the pseudo-cubic fluorite-type structure. With doping concentration × increasing, the lattice parameter, cell volume and the bond length of d{sub Ce−O} and d{sub Zr−O} decrease linearly. It is interesting to find that the hardness of materials increase with Zr concentration increasing. For Ce{sub 0.75} Zr{sub 0.25} O{sub 2}, we also find that its ductility is good. Meanwhile, the range of the conduction band energy in the doped system becomes wider than that in the undoped system. The overlapping band phenomenon occur for all substitutions in Ce{sub 1−x} Zr{sub x}O{sub 2} (from x = 0.25 to x = 0.75), especially for the structure of Ce{sub 0.5} Zr{sub 0.5} O{sub 2} and Ce{sub 0.25} Zr{sub 0.75} O{sub 2}, its second band gaps almost disappear. Based on the dielectric functions obtained, it is shown that the static dielectric constant ε{sub 0} and refractive index n{sub 0} obviously decrease with Zr concentration increasing. After discussing, we know that CeO{sub 2} is suitable as a useful high-refractive index film material in single and multilayered optical coatings, whereas ZrO{sub 2} can be used as gate-dielectric materials in metal-oxide semiconductor (MOS) devices, in metallurgy and as a thermal barrier coating in engines. - Highlights: • Structural, and optical properties of fluorite type oxides are studied; • Ce substituted by Zr leads to formation of pseudo-cubic fluorite-type structure; • Hardness of materials are increased with Zr

  19. Improving the tribocorrosion resistance of Ti6Al4V surface by laser surface cladding with TiNiZrO2 composite coating

    Science.gov (United States)

    Obadele, Babatunde Abiodun; Andrews, Anthony; Mathew, Mathew T.; Olubambi, Peter Apata; Pityana, Sisa

    2015-08-01

    Ti6Al4V alloy was laser cladded with titanium, nickel and zirconia powders in different ratio using a 2 kW CW ytterbium laser system (YLS). The microstructures of the cladded layers were examined using field emission scanning electron microscopy (FESEM) equipped with energy dispersive X-ray spectroscopy (EDS) and X-ray diffractometry (XRD). Corrosion and tribocorrosion tests were performed on the cladded surface in 1 M H2SO4 solution. The microstructure revealed the transformation from a dense dendritic structure in TiNi coating to a flower-like structure observed in TiNiZrO2 cladded layers. There was a significant increase in surface microindentation hardness values of the cladded layers due to the present of hard phase ZrO2 particles. The results obtained show that addition of ZrO2 improves the corrosion resistance property of TiNi coating but decrease the tribocorrosion resistance property. The surface hardening effect induced by ZrO2 addition, combination of high hardness of Ti2Ni phase could be responsible for the mechanical degradation and chemical wear under sliding conditions.

  20. Orange-red emitting Gd2Zr2O7:Sm3+: Structure-property correlation, optical properties and defect spectroscopy

    Science.gov (United States)

    Gupta, Santosh K.; Reghukumar, C.; Sudarshan, K.; Ghosh, P. S.; Pathak, Nimai; Kadam, R. M.

    2018-05-01

    Local structure analysis of dopant ion, understanding host to dopant energy transfer dynamics and defects characterization in a doped material which plays an important role in the designing a highly efficient opto-electronic material. In this connection a new Sm3+ doped Gd2Zr2O7 pyrochlore material was synthesized using gel-combustion technique and was characterized systematically using X-ray diffraction (XRD), time resolved photoluminescence spectroscopy (TRPLS), positron annihilation lifetime spectroscopy (PALS) and density functional theory (DFT) based ab-initio calculation. Based on DFT site selective energetics calculation and luminescence decay measurement, it was observed that the Sm3+ was distributed at both Gd3+ and Zr4+ site with higher Sm3+ fraction at the Gd3+ site. PALS was used to probe the presence of defects in the phosphor. In this work intense orange-red emission is realized through manipulating the energy transfer from host defect emission (oxygen vacancies) to Sm3+ which allows color emission from green in undoped to orange-red in doped samples. Effect of dopant concentration and annealing temperature was probed using TRPLS and PALS. These all information is highly important for researcher looking to achieve pyrochlore based phosphor materials with high quantum yield.

  1. Effect of ion nitriding on the crystal structure of 3 mol% Y2O3-doped ZrO2 thin-films prepared by the sol-gel method

    International Nuclear Information System (INIS)

    Ortiz, A.L.; Diaz-Parralejo, A.; Borrero-Lopez, O.; Guiberteau, F.

    2006-01-01

    We investigated the effect of ion nitriding on the crystal structure of 3 mol% Y 2 O 3 -doped ZrO 2 (3YSZ) thin-films prepared by the sol-gel method. For this purpose, we used X-ray diffractometry to determine the crystalline phases, the lattice parameters, the crystal sizes, and the lattice microstrains, and glow discharge-optical emission spectroscopy to obtain the depth profiles of the elemental chemical composition. We found that nitrogen atoms substitute oxygen atoms in the 3YSZ crystal, thus leading to the formation of unsaturated-substitutional solid solutions with reduced lattice parameters and Zr 0.94 Y 0.06 O 1.72 N 0.17 stoichiometric formula. We also found that ion nitriding does not affect the grain size, but does generate lattice microstrains due to the increase in point defects in the crystalline lattice

  2. Ab initio investigations of the electronic structure and chemical bonding of Li{sub 2}ZrN{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Matar, S.F., E-mail: matar@icmcb-bordeaux.cnrs.fr [CNRS, Universite de Bordeaux, ICMCB, 87 Avenue du Docteur Albert Schweitzer, 33600 Pessac (France); Poettgen, R., E-mail: pottgen@uni-muenster.de [Institut fuer Anorganische und Analytische Chemie, Universitaet Muenster, Corrensstrasse 30, D-48149 Muenster (Germany); Al Alam, A.F., E-mail: adelalalam@usek.edu.lb [Universite Saint Esprit de Kaslik (USEK), Faculte des Sciences, URA GREVE (CNRS/USEK/UL), Jounieh (Lebanon); Ouaini, N., E-mail: naimouaini@usek.edu.lb [Universite Saint Esprit de Kaslik (USEK), Faculte des Sciences, URA GREVE (CNRS/USEK/UL), Jounieh (Lebanon)

    2012-06-15

    The electronic structure of the ternary nitride Li{sub 2}ZrN{sub 2} is examined from ab initio with DFT computations for an assessment of the properties of chemical bonding. The compound is found insulating with 1.8 eV band gap; it becomes metallic and less ionic upon removal of one equivalent of Li. The chemical interaction is found mainly between Zr and N on one hand and Li and N on the other hand. While all pair interactions are bonding, antibonding N-N interactions are found dominant at the top of the valence band of Li{sub 2}ZrN{sub 2} and they become less intense upon removal of Li. From energy differences the partial delithiation leading to Li{sub 2-x}ZrN{sub 2} (x={approx}1) is favored. - Graphical abstract: Trigonal structure of Li{sub 2}ZrN{sub 2} showing the Zr-N-Li layers along the c-axis. Highlights: Black-Right-Pointing-Pointer Li{sub 2}ZrN{sub 2} calculated insulating with a 1.8 eV gap in agreement with its light green color. Black-Right-Pointing-Pointer Lithium de-intercalation is energetically favored for one out of two Li equivalents. Black-Right-Pointing-Pointer Li plays little role in the change of the structure, ensured by Zr and N binding. Black-Right-Pointing-Pointer Similar changes in the electronic structure as for various intercalated phases of ZrN.

  3. Influence of Zr doping on structure and morphology of TiO2 nanorods prepared using hydrothermal method

    Science.gov (United States)

    Muslimin, Masliana; Jumali, Mohammad Hafizuddin; Tee, Tan Sin; Beng, Lee Hock; Hui, Tan Chun; Chin, Yap Chi

    2018-04-01

    The aim of this work is to investigate the effect of Zr doping on TiO2 nanostructure. TiO2 nanorods thin films with different Zr-doping concentrations (6 × 10-3 M, 13 × 10-3 M and 25 × 10-3 M) were successfully prepared using a simple hydrothermal method. The structural and morphological properties of the samples were evaluated using XRD and FESEM respectively. The XRD results revealed that the TiO2 in all samples stabilized as rutile phase. The FESEM micrographs confirmed that TiO2 exist as square like nanorods with blunt tips. Although the crystallographic nature remains unchanged, the introduction of Zr has altered the surface density, structure and morphology of TiO2 which subsequently will have significant effect on its properties.

  4. Experimental investigation of the Zr corner of the ternary Zr-Nb-Fe phase diagram

    Energy Technology Data Exchange (ETDEWEB)

    Granovsky, M.S. E-mail: granovsk@cnea.gov.ar; Canay, M.; Lena, E.; Arias, D

    2002-04-01

    Intermediate phases in the Zr-rich region of the Zr-Nb-Fe system have been investigated by X-ray diffraction, optical and electron microscopy and electron microprobe analysis. The chemical composition ranges covered by the alloys studied here are: (41-97) at.% Zr, (32-0.9) at.% Nb and (0.6-38) at.% Fe. The phases found in this region were: the solid solutions {alpha}-Zr and {beta}-Zr, the intermetallic Zr{sub 3}Fe with less than 0.2 at.% Nb in solution, two new ternary intermetallic compounds (Zr+Nb){sub 2}Fe '{lambda}{sub 1}' with a cubic Ti{sub 2}Ni-type structure in the composition range (2.4-13) at.% Nb and (31-33) at.% Fe, and (Fe+Nb){sub 2}Zr '{lambda}{sub 2}' indexed as hexagonal Laves phase MgZn{sub 2} type (C14) with a wide range of compositions close to (35-37) at.% Zr, (12-31) at.% Nb and (32-53) at.% Fe.

  5. Experimental investigation of the Zr corner of the ternary Zr-Nb-Fe phase diagram

    International Nuclear Information System (INIS)

    Granovsky, M.S.; Canay, M.; Lena, E.; Arias, D.

    2002-01-01

    Intermediate phases in the Zr-rich region of the Zr-Nb-Fe system have been investigated by X-ray diffraction, optical and electron microscopy and electron microprobe analysis. The chemical composition ranges covered by the alloys studied here are: (41-97) at.% Zr, (32-0.9) at.% Nb and (0.6-38) at.% Fe. The phases found in this region were: the solid solutions α-Zr and β-Zr, the intermetallic Zr 3 Fe with less than 0.2 at.% Nb in solution, two new ternary intermetallic compounds (Zr+Nb) 2 Fe 'λ 1 ' with a cubic Ti 2 Ni-type structure in the composition range (2.4-13) at.% Nb and (31-33) at.% Fe, and (Fe+Nb) 2 Zr2 ' indexed as hexagonal Laves phase MgZn 2 type (C14) with a wide range of compositions close to (35-37) at.% Zr, (12-31) at.% Nb and (32-53) at.% Fe

  6. Effect of processing variables on microstructure and properties of two Al-Li-Cu-Mg-Zr alloys

    International Nuclear Information System (INIS)

    Palmer, I.G.; Lewis, R.E.; Crooks, D.D.

    1984-01-01

    Two Al-Li-Cu-Mg-Zr alloys have been prepared in the form of both powder metallurgy (PM) and ingot metallurgy (IM) alloys. The compositions were selected to meet certain program goals based on the results of an alloy development phase, the details of which have been previously published. The target compositions were Al-3Li-1.5Cu-1Mg-0.2Zr and Al-3Cu-2Li-1Mg-0.2Zr. The PM alloys were prepared from chill cast remelt stock by centrifugal atomization in helium, followed by screening, degassing, and extrusion. The IM alloys were prepared by direct chill (DC) casting, homogenization and extrusion. Full details of the production of the alloys are given. The effects of various processing conditions on microstructure and properties were evaluated, including different heat treatments and stretching conditions. These effects are described in detail with particular emphasis on a comparison of the PM and IM alloys. 10 references

  7. Preparation, characterization and thermodynamic properties of Zr-containing Cl-bearing layered double hydroxides (LDHs)

    Energy Technology Data Exchange (ETDEWEB)

    Rozov, Konstantin; Curtius, Hilde; Bosbach, Dirk [Forschungszentrum Juelich GmbH (Germany). Inst. of Energy and Climate Research (IEK-6) Nuclear Waste Management and Reactor Safety

    2015-07-01

    Zr-containing layered double hydroxides (LDHs) with variable xZr{sub solid} = Zr/(Zr + Al) mole fractions were synthesized by a co-precipitation method at ambient conditions. The chemical compositions of samples and corresponding aqueous solutions after syntheses were analyzed by ICP-OES, EDX (Mg, Al, Zr) and ion chromatography (Cl{sup -}). Results of PXRD technique demonstrated that solids with 0 ≤ x Zr{sub solid} ≤ 0.5 show only X-ray reflexes typical for pure LDH compositions, while products of syntheses with xZr{sub solid} > 0.5 display additional patterns attributed to brucite. ICP-OES and EDX techniques shown that in pure Zr-containing LDHs the Mg/(Al + Zr) ratio is reducing with increase of xZr{sub solid} and the stoichiometry of brucite-like layers corresponds to [Mg{sub 3-2x}Al{sub 1-x}Zr{sub x}]. This fact may indicate that the incorporation of 1 Zr-containing specie results in the removal of 1 Al- and 2 Mg-containing species from the pure Mg-Al-composition. Such mechanism may be confirmed by the observation that measured a{sub 0} = b{sub 0} distances are generally consistent with theoretical estimates obtained from [Mg{sub 3-2x}Al{sub 1-x}Zr{sub x}]-stoichiometry. The presence of predominant Mg{sup 2+}, Al(OH){sub 4}{sup -} and Zr(OH){sub 5}{sup -} complexes in aqueous solutions after syntheses was established in thermodynamic calculations by applying GEMS-Selektor v.3. code and, therefore, the reaction: Mg{sub 3}Al{sub 1}(OH){sub 8}Cl{sub 1} + Zr(OH){sub 5}{sup -} = Mg{sub 1}Zr{sub 1}(OH){sub 5}Cl{sub 1} + Al(OH){sub 4}{sup -} + 2Mg{sup 2+} + 4OH{sup -} can describe a mechanism of Zr-substitution. Estimates of the molar Gibbs free energies of Zr-containing LDHs with 0 ≤ = xZr{sub solid} ≤ 0.5 show that the incorporation of Zr into the LDH increasing significantly their aqueous solubility. Thus, it is not possible to neglect that Zr can be partly localized as Zr(OH){sub 5