메뉴 건너뛰기




Volumn 26, Issue 2, 2014, Pages

Equation of state of zircon- and scheelite-type dysprosium orthovanadates: A combined experimental and theoretical study

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; EXCHANGE-CORRELATION ENERGY FUNCTIONALS; HIGH-PRESSURE EXPERIMENT; HIGH-PRESSURE X-RAY DIFFRACTIONS; RARE-EARTH ORTHOVANADATES; SCHEELITE-TYPE STRUCTURE; STRUCTURAL PARAMETER; THEORETICAL EQUATION;

EID: 84890656976     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/26/2/025401     Document Type: Article
Times cited : (20)

References (54)
  • 2
    • 79952462524 scopus 로고    scopus 로고
    • Comparative study of optical and scintillation properties of YVO4, (Lu0.5Y0.5)VO4, and LuVO4 single crystals
    • 10.1016/j.nima.2011.01.044 0168-9002 A
    • Fujimoto Y, Yanagida T, Yokota Y, Chani V, Kochurikhin V and Yoshikawa A 2011 Comparative study of optical and scintillation properties of YVO4, (Lu0.5Y0.5)VO4, and LuVO4 single crystals Nucl. Instrum. Methods Phys. Res. A 635 53-6
    • (2011) Nucl. Instrum. Methods Phys. Res. , vol.635 , pp. 53-56
    • Fujimoto, Y.1    Yanagida, T.2    Yokota, Y.3    Chani, V.4    Kochurikhin, V.5    Yoshikawa, A.6
  • 4
    • 0142057521 scopus 로고    scopus 로고
    • Low-loss optical planar waveguides in YVO4 produced by silicon ion implantation at low doses
    • 10.1063/1.1604965
    • Chen F, Wang X, Li S, Fu G, Wang K, Lu Q, Shen D, Nie R and Ma H 2003 Low-loss optical planar waveguides in YVO4 produced by silicon ion implantation at low doses J. Appl. Phys. 94 4708-10
    • (2003) J. Appl. Phys. , vol.94 , pp. 4708-4710
    • Chen, F.1    Wang, X.2    Li, S.3    Fu, G.4    Wang, K.5    Lu, Q.6    Shen, D.7    Nie, R.8    Ma, H.9
  • 5
    • 0036922490 scopus 로고    scopus 로고
    • Ionic and p-type electronic transport in zircon-type Ce1- 2xAxVO4±δ (A = Ca, Sr)
    • 10.1039/b206004c
    • Tsipis E V, Patrakeev M V, Kharton V V, Vyshatko N P and Frade J R 2002 Ionic and p-type electronic transport in zircon-type Ce1-2xAxVO4±δ (A = Ca, Sr) J. Mater. Chem. 12 3738-45
    • (2002) J. Mater. Chem. , vol.12 , pp. 3738-3745
    • Tsipis, E.V.1    Patrakeev, M.V.2    Kharton, V.V.3    Vyshatko, N.P.4    Frade, J.R.5
  • 6
    • 0442274488 scopus 로고    scopus 로고
    • Compounds with zircon and monazite structures and possibilities of their use for incorporation of radionuclides
    • 1066-3622
    • Volkov Y F 1999 Compounds with zircon and monazite structures and possibilities of their use for incorporation of radionuclides Radiochemistry 41 168-74
    • (1999) Radiochemistry , vol.41 , pp. 168-174
    • Volkov, Y.F.1
  • 7
    • 70349476225 scopus 로고
    • A new type of structural Jahn-Teller phase transition in DyVO4 induced by an electric field
    • Vekhter B G and Kaplan M D 1979 A new type of structural Jahn-Teller phase transition in DyVO4 induced by an electric field JETP Lett. 29 155-7
    • (1979) JETP Lett. , vol.29 , pp. 155-157
    • Vekhter, B.G.1    Kaplan, M.D.2
  • 8
  • 10
    • 0036098799 scopus 로고    scopus 로고
    • Effect of vanadia on physico-chemical and catalytic characteristics of dysprosia
    • Sugunan S and Renuka N K 2002 Effect of vanadia on physico-chemical and catalytic characteristics of dysprosia Ind. J. Chem. 41A 692-700
    • (2002) Ind. J. Chem. , vol.41 , pp. 692-700
    • Sugunan, S.1    Renuka, N.K.2
  • 11
    • 79955030448 scopus 로고    scopus 로고
    • Synthesis, characterization and photocatalytic performance of VDyOx composite under visible light irradiation
    • 10.1016/j.cej.2011.02.051 1385-8947
    • He Y, Zhao L, Wang Y, Lin H, Li T, Wu X and Wu Y 2011 Synthesis, characterization and photocatalytic performance of VDyOx composite under visible light irradiation Chem. Eng. J. 169 50-7
    • (2011) Chem. Eng. J. , vol.169 , pp. 50-57
    • He, Y.1    Zhao, L.2    Wang, Y.3    Lin, H.4    Li, T.5    Wu, X.6    Wu, Y.7
  • 12
    • 77956468393 scopus 로고    scopus 로고
    • Visible-light-responding Bi0.5Dy0.5VO4 solid solution for photocatalytic water splitting
    • 10.1007/s10562-009-9949-3 1011-372X
    • Wang Q, Liu H, Jiang L, Yuan J and Shangguan W 2009 Visible-light- responding Bi0.5Dy0.5VO4 solid solution for photocatalytic water splitting Catal. Lett. 131 160-3
    • (2009) Catal. Lett. , vol.131 , pp. 160-163
    • Wang, Q.1    Liu, H.2    Jiang, L.3    Yuan, J.4    Shangguan, W.5
  • 13
    • 84859327982 scopus 로고    scopus 로고
    • Inorganic photocatalysts for overall water splitting
    • 10.1002/asia.201100772
    • Xing J, Fang W Q, Zhao H J and Yang H G 2012 Inorganic photocatalysts for overall water splitting Chem. Asian J. 7 642-57
    • (2012) Chem. Asian J. , vol.7 , pp. 642-657
    • Xing, J.1    Fang, W.Q.2    Zhao, H.J.3    Yang, H.G.4
  • 14
    • 0001028577 scopus 로고
    • Dimorphic lanthanum orthovanadate
    • 10.1016/0022-1902(73)80187-3 0022-1902
    • Ropp R C and Carroll B 1973 Dimorphic lanthanum orthovanadate J. Inorg. Nucl. Chem. 35 1153-7
    • (1973) J. Inorg. Nucl. Chem. , vol.35 , pp. 1153-1157
    • Ropp, R.C.1    Carroll, B.2
  • 15
    • 0015368027 scopus 로고
    • Refinement of the crystal structure of some rare earth vanadates RVO4 (R=Dy, Tb, Ho, Yb)
    • 10.1016/0022-4596(72)90002-3
    • Fuess H and Kallel A 1972 Refinement of the crystal structure of some rare earth vanadates RVO4 (R=Dy, Tb, Ho, Yb) J. Solid State Chem. 5 11-4
    • (1972) J. Solid State Chem. , vol.5 , pp. 11-14
    • Fuess, H.1    Kallel, A.2
  • 16
    • 37849189364 scopus 로고    scopus 로고
    • 5 powders
    • DOI 10.1016/j.jallcom.2006.02.052, PII S0925838806002635
    • Tojo T, Zhang Q and Saito F 2007 Mechanochemical synthesis of rare earth orthovanadates from R2O3 (R = rare earth elements) and V2O5 powders J. Alloys Compounds 427 219-22 (Pubitemid 44827632)
    • (2007) Journal of Alloys and Compounds , vol.427 , Issue.1-2 , pp. 219-222
    • Tojo, T.1    Zhang, Q.2    Saito, F.3
  • 17
    • 42749103808 scopus 로고    scopus 로고
    • Structural properties of the zircon- and scheelite-type phases of YVO4 at high pressure
    • 10.1103/PhysRevB.70.064109 B 064109
    • Wang X, Loa I, Syassen K, Hanfland M and Ferrand B 2004 Structural properties of the zircon- and scheelite-type phases of YVO4 at high pressure Phys. Rev. B 70 064109
    • (2004) Phys. Rev. , vol.70
    • Wang, X.1    Loa, I.2    Syassen, K.3    Hanfland, M.4    Ferrand, B.5
  • 20
    • 84855332784 scopus 로고    scopus 로고
    • In situ high-pressure synchrotron x-ray diffraction study of CeVO4 and TbVO4 up to 50 GPa
    • 10.1103/PhysRevB.84.224121 B 224121
    • Errandonea D, Kumar R S, Achary S N and Tyagi A K 2011 In situ high-pressure synchrotron x-ray diffraction study of CeVO4 and TbVO4 up to 50 GPa Phys. Rev. B 84 224121
    • (2011) Phys. Rev. , vol.84
    • Errandonea, D.1    Kumar, R.S.2    Achary, S.N.3    Tyagi, A.K.4
  • 21
    • 33847343009 scopus 로고
    • Relation of equilibrium phase-transition pressure to ionic radii
    • 10.1063/1.1729706
    • Stubican V S and Roy R 1963 Relation of equilibrium phase-transition pressure to ionic radii J. Appl. Phys. 34 1888-90
    • (1963) J. Appl. Phys. , vol.34 , pp. 1888-1890
    • Stubican, V.S.1    Roy, R.2
  • 23
    • 80052451410 scopus 로고    scopus 로고
    • High pressure Raman scattering study on the phase stability of DyVO4
    • 10.1063/1.3605756 0094-243X
    • Patel N N, Garg A B, Meenakshi S, Wani B N and Sharma S M 2011 High pressure Raman scattering study on the phase stability of DyVO4 AIP Conf. Proc. 1349 99-100
    • (2011) AIP Conf. Proc. , vol.1349 , pp. 99-100
    • Patel, N.N.1    Garg, A.B.2    Meenakshi, S.3    Wani, B.N.4    Sharma, S.M.5
  • 24
    • 2642557203 scopus 로고
    • Compressibilities of TbVO4 and DyVO4 calculated from spectroscopic data
    • 10.1366/000370292789619124 0003-7028
    • Chen G, Haire R G and Peterson J R 1992 Compressibilities of TbVO4 and DyVO4 calculated from spectroscopic data Appl. Spectrosc. 46 1495-7
    • (1992) Appl. Spectrosc. , vol.46 , pp. 1495-1497
    • Chen, G.1    Haire, R.G.2    Peterson, J.R.3
  • 26
    • 51849086741 scopus 로고    scopus 로고
    • Investigation of thermal expansion and compressibility of rare-earth orthovanadates using a dielectric chemical bond method
    • 10.1021/ic800672h
    • Zhang S Y, Zhou S H, Li H Y and Li L 2008 Investigation of thermal expansion and compressibility of rare-earth orthovanadates using a dielectric chemical bond method Inorg. Chem. 47 7863-7
    • (2008) Inorg. Chem. , vol.47 , pp. 7863-7867
    • Zhang, S.Y.1    Zhou, S.H.2    Li, H.Y.3    Li, L.4
  • 27
    • 79955421255 scopus 로고    scopus 로고
    • Electronegativity-related bulk moduli of crystal materials
    • 10.1002/pssb.201046448 0370-1972 b
    • Li K, Ding Z and Xue D 2011 Electronegativity-related bulk moduli of crystal materials Phys. Status Solidi b 248 1227-36
    • (2011) Phys. Status Solidi , vol.248 , pp. 1227-1236
    • Li, K.1    Ding, Z.2    Xue, D.3
  • 28
    • 84890602568 scopus 로고    scopus 로고
    • www.hppi.troitsk.ru/products/Toroid2/Toroid1.htm
  • 29
    • 0027677473 scopus 로고
    • Recent advances in magnetic structure determination by neutron powder diffraction
    • 10.1016/0921-4526(93)90108-I 0921-4526 B
    • Rodriguez-Carvajal J 1993 Recent advances in magnetic structure determination by neutron powder diffraction Physica B 192 55-69
    • (1993) Physica , vol.192 , pp. 55-69
    • Rodriguez-Carvajal, J.1
  • 30
    • 0000354272 scopus 로고
    • X-ray energy-dispersive powder diffractometry using synchrotron radiation
    • 10.1016/0029-554X(76)90845-4 0029-554X
    • Buras B, Staun Olsen J and Gerward L 1976 X-ray energy-dispersive powder diffractometry using synchrotron radiation Nucl. Instrum. Methods 135 193-5
    • (1976) Nucl. Instrum. Methods , vol.135 , pp. 193-195
    • Buras, B.1    Staun Olsen, J.2    Gerward, L.3
  • 31
    • 84890739796 scopus 로고
    • Energy dispersive XRPD at high pressure
    • 10.4028/www.scientific.net/MSF.79-82.409 0255-5476
    • Gerward L 1991 Energy dispersive XRPD at high pressure Mater. Sci. Forum 79-82 409-17
    • (1991) Mater. Sci. Forum , vol.79-82 , pp. 409-417
    • Gerward, L.1
  • 32
    • 0042200552 scopus 로고
    • High pressure and high temperature investigations on intermetallic compounds using energy-dispersive x-ray powder diffraction
    • 10.1016/0168-583X(94)00358-0 0168-583X B
    • Peun T, Lauterjung J and Hinze E 1995 High pressure and high temperature investigations on intermetallic compounds using energy-dispersive x-ray powder diffraction Nucl. Instrum. Methods Phys. Res. B 97 483-6
    • (1995) Nucl. Instrum. Methods Phys. Res. , vol.97 , pp. 483-486
    • Peun, T.1    Lauterjung, J.2    Hinze, E.3
  • 34
    • 33846571208 scopus 로고
    • Pressure calibration to 100 kbar based on the compression of NaCl
    • 10.1063/1.1703181
    • Jeffery R N, Barnett J D, Vanflee H B and Hall H T 1966 Pressure calibration to 100 kbar based on the compression of NaCl J. Appl. Phys. 37 3172-80
    • (1966) J. Appl. Phys. , vol.37 , pp. 3172-3180
    • Jeffery, R.N.1    Barnett, J.D.2    Vanflee, H.B.3    Hall, H.T.4
  • 37
    • 0000298009 scopus 로고
    • Finite strain isotherm and velocities for single-crystal and polycrystalline NaCl at high pressures and 300 K
    • 10.1029/JB083iB03p01257 0148-0227
    • Birch F 1978 Finite strain isotherm and velocities for single-crystal and polycrystalline NaCl at high pressures and 300 K J. Geophys. Res. 83 1257-68
    • (1978) J. Geophys. Res. , vol.83 , pp. 1257-1268
    • Birch, F.1
  • 39
    • 2442537377 scopus 로고    scopus 로고
    • Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
    • Kresse G and Furthmüller J 1996 Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Phys. Rev. B 54 11169-86 Further information on the VASP computer code is available at http://cms.mpi.univie.ac.at/vasp
    • (1996) Phys. Rev. , vol.54 , pp. 11169-11186
    • Kresse, G.1    Furthmüller, J.2
  • 40
    • 0011236321 scopus 로고    scopus 로고
    • From ultrasoft pseudopotentials to the projector augmented-wave method
    • 10.1103/PhysRevB.59.1758 B
    • Kresse G and Joubert D 1999 From ultrasoft pseudopotentials to the projector augmented-wave method Phys. Rev. B 9 1758-75
    • (1999) Phys. Rev. , vol.9 , pp. 1758-1775
    • Kresse, G.1    Joubert, D.2
  • 41
    • 25744460922 scopus 로고
    • Projector augmented-wave method
    • 10.1103/PhysRevB.50.17953 0163-1829 B
    • Blöchl P E 1994 Projector augmented-wave method Phys. Rev. B 50 17953
    • (1994) Phys. Rev. , vol.50 , pp. 17953
    • Blöchl, P.E.1
  • 42
    • 50149093649 scopus 로고    scopus 로고
    • Ab initio simulations of materials using VASP: Density-functional theory and beyond
    • 10.1002/jcc.21057
    • Hafner J 2008 Ab initio simulations of materials using VASP: density-functional theory and beyond J. Comput. Chem. 29 2044-78
    • (2008) J. Comput. Chem. , vol.29 , pp. 2044-2078
    • Hafner, J.1
  • 43
    • 4243943295 scopus 로고    scopus 로고
    • Generalized gradient approximation made simple
    • Perdew J P, Burke K and Ernzerhof M 1996 Generalized gradient approximation made simple Phys. Rev. Lett. 77 3865-8 (Pubitemid 126631804)
    • (1996) Physical Review Letters , vol.77 , Issue.18 , pp. 3865-3868
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 45
    • 0141884157 scopus 로고    scopus 로고
    • High-pressure phases of group-IV, III-V, and II-VI compounds
    • DOI 10.1103/RevModPhys.75.863
    • Mujica A, Rubio A, Muñoz A and Needs R 2003 High-pressure phases of group-IV, III-V, and II-VI compounds Rev. Mod. Phys. 75 863-912 (Pubitemid 37244518)
    • (2003) Reviews of Modern Physics , vol.75 , Issue.3 , pp. 863-912
    • Mujica, A.1    Rubio, A.2    Munoz, A.3    Needs, R.J.4
  • 46
    • 1142304418 scopus 로고    scopus 로고
    • GIBBS: Isothermal-isobaric thermodynamics of solids from energy curves using a quasi-harmonic Debye model
    • 10.1016/j.comphy.2003.12.001 0010-4655
    • Blanco M A, Francisco E and Luaña V 2004 GIBBS: isothermal-isobaric thermodynamics of solids from energy curves using a quasi-harmonic Debye model Comput. Phys. Commun. 158 57-72
    • (2004) Comput. Phys. Commun. , vol.158 , pp. 57-72
    • Blanco, M.A.1    Francisco, E.2    Luaña, V.3
  • 48
    • 44449116684 scopus 로고    scopus 로고
    • Assesing the Perdew-Burke-Ernzerhof exchange-correlation density functional revised for metallic bulk and surface systems
    • 10.1103/PhysRevB.77.195445 B 195445
    • Ropo M, Kokko K and Vitos L 2008 Assesing the Perdew-Burke-Ernzerhof exchange-correlation density functional revised for metallic bulk and surface systems Phys. Rev. B 77 195445
    • (2008) Phys. Rev. , vol.77
    • Ropo, M.1    Kokko, K.2    Vitos, L.3
  • 49
    • 61549134825 scopus 로고    scopus 로고
    • Calculation of the lattice constant of solids with semilocal functionals
    • 10.1103/PhysRevB.79.085104 B 085104
    • Haas P, Tran F and Blaha P 2009 Calculation of the lattice constant of solids with semilocal functionals Phys. Rev. B 79 085104
    • (2009) Phys. Rev. , vol.79
    • Haas, P.1    Tran, F.2    Blaha, P.3
  • 50
    • 76149096882 scopus 로고    scopus 로고
    • Ab initio study of high-pressure structural properties of the LuVO4 and ScVO4 zircon-type orthovanadates
    • 10.1080/08957950903417444 0895-7959
    • López-Solano J, Rodríguez-Hernández P and Muñoz A 2009 Ab initio study of high-pressure structural properties of the LuVO4 and ScVO4 zircon-type orthovanadates High Press. Res. 29 582-6
    • (2009) High Press. Res. , vol.29 , pp. 582-586
    • López-Solano, J.1    Rodríguez-Hernández, P.2    Muñoz, A.3
  • 51
    • 0002750254 scopus 로고
    • Neutron diffraction study of ErPO4 and ErVO4
    • Patscheke E, Fuess H and Will G 1968 Neutron diffraction study of ErPO4 and ErVO4 Chem. Phys. Lett. 2 47-50
    • (1968) Chem. Phys. Lett. , vol.2 , pp. 47-50
    • Patscheke, E.1    Fuess, H.2    Will, G.3
  • 52
    • 24844470416 scopus 로고
    • ErVO4-II, a scheelite-type high-pressure modification of erbium orthovanadate
    • 10.1107/S0108270189014162 0108-2701 C
    • Range K-J and Meister H 1990 ErVO4-II, a scheelite-type high-pressure modification of erbium orthovanadate Acta Crystallogr. C 46 1093-4
    • (1990) Acta Crystallogr. , vol.46 , pp. 1093-1094
    • Range, K.-J.1    Meister, H.2
  • 53
    • 4744346529 scopus 로고
    • Phase transitions among the ABX4 compounds
    • 10.1524/zkri.1973.138.138.237 0044-2968
    • Muller O and Roy R 1973 Phase transitions among the ABX4 compounds Z. Kristallogr. 138 237-53
    • (1973) Z. Kristallogr. , vol.138 , pp. 237-253
    • Muller, O.1    Roy, R.2
  • 54
    • 33847034126 scopus 로고    scopus 로고
    • Crystal stability and pressure-induced phase transitions in scheelite AWO4 (A = Ca, Sr, Ba, Pb, Eu) binary oxides. I: A review of recent ab initio calculations, ADXRD, XANES, and Raman studies
    • 10.1002/pssb.200672559 0370-1972 b
    • López-Solano J et al 2007 Crystal stability and pressure-induced phase transitions in scheelite AWO4 (A = Ca, Sr, Ba, Pb, Eu) binary oxides. I: a review of recent ab initio calculations, ADXRD, XANES, and Raman studies Phys. Status Solidi b 244 325-30
    • (2007) Phys. Status Solidi , vol.244 , pp. 325-330
    • López-Solano, J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.