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Volumn 72, Issue 3, 2005, Pages

Systematic treatment of displacements, strains, and electric fields in density-functional perturbation theory

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EID: 33749159370     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.72.035105     Document Type: Article
Times cited : (824)

References (44)
  • 1
    • 10644250257 scopus 로고
    • PRVBAK 0096-8269 10.1103/PhysRev.136.B864
    • P. Hohenberg and W. Kohn, Phys. Rev. PRVBAK 0096-8269 10.1103/PhysRev.136.B864 136, B864 (1964);
    • (1964) Phys. Rev. , vol.136 , pp. 864
    • Hohenberg, P.1    Kohn, W.2
  • 2
    • 0042113153 scopus 로고
    • PRVBAK 0096-8269 10.1103/PhysRev.140.A1133
    • W. Kohn and L. J. Sham, Phys. Rev. PRVBAK 0096-8269 10.1103/PhysRev.140. A1133 140, A1133 (1965).
    • (1965) Phys. Rev. , vol.140 , pp. 1133
    • Kohn, W.1    Sham, L.J.2
  • 3
    • 0000935680 scopus 로고
    • PLRAAN 1050-2947 10.1103/PhysRevA.52.1086
    • X. Gonze, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.52.1086 52, 1086 (1995);
    • (1995) Phys. Rev. a , vol.52 , pp. 1086
    • Gonze, X.1
  • 4
    • 33748544874 scopus 로고
    • PLRAAN 1050-2947 10.1103/PhysRevA.52.1096
    • X. Gonze, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.52.1096 52, 1096 (1995);
    • (1995) Phys. Rev. a , vol.52 , pp. 1096
    • Gonze, X.1
  • 5
    • 0001084315 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.55.10337
    • X. Gonze, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.55.10337 55, 10337 (1997);
    • (1997) Phys. Rev. B , vol.55 , pp. 10337
    • Gonze, X.1
  • 6
    • 0001096933 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.55.10355
    • X. Gonze and C. Lee, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.55. 10355 55, 10355 (1997).
    • (1997) Phys. Rev. B , vol.55 , pp. 10355
    • Gonze, X.1    Lee, C.2
  • 9
    • 0000111746 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.58.1861
    • S. Baroni, P. Giannozzi, and A. Testa, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.58.1861 58, 1861 (1987).
    • (1987) Phys. Rev. Lett. , vol.58 , pp. 1861
    • Baroni, S.1    Giannozzi, P.2    Testa, A.3
  • 10
  • 11
    • 3543103556 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.47.1651
    • R. D. King-Smith and D. Vanderbilt, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.47.1651 47, R1651 (1993).
    • (1993) Phys. Rev. B , vol.47 , pp. 1651
    • King-Smith, R.D.1    Vanderbilt, D.2
  • 14
    • 12844286241 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.47.558
    • G. Kresse and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.47.558 47, R558 (1993);
    • (1993) Phys. Rev. B , vol.47 , pp. 558
    • Kresse, G.1    Hafner, J.2
  • 15
    • 2442537377 scopus 로고    scopus 로고
    • PRBMDO. 0163-1829. 10.1103/PhysRevB.54.11169
    • G. Kresse and J. Furthmüller, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.11169 54, 11169 (1996). See also http://cms.mpi.univie.ac. at/vasp.
    • (1996) Phys. Rev. B , vol.54 , pp. 11169
    • Kresse, G.1    Furthmüller, J.2
  • 16
    • 15444379500 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.71.035117
    • D. R. Hamann, X. Wu, K. Rabe, and D. Vanderbilt, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.71.035117 71, 035117 (2005).
    • (2005) Phys. Rev. B , vol.71 , pp. 035117
    • Hamann, D.R.1    Wu, X.2    Rabe, K.3    Vanderbilt, D.4
  • 17
    • 0034900723 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.63.155107
    • R. W. Nunes and X. Gonze, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.63.155107 63, 155107 (2001).
    • (2001) Phys. Rev. B , vol.63 , pp. 155107
    • Nunes, R.W.1    Gonze, X.2
  • 18
    • 0037048416 scopus 로고    scopus 로고
    • PRLTAO. 0031-9007. 10.1103/PhysRevLett.89.117602
    • I. Souza, J. Íñiguez, D. Vanderbilt, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.89.117602 89, 117602 (2002).
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 117602
    • Souza, I.1    Íñiguez, J.2    Vanderbilt, D.3
  • 19
    • 0037037908 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.89.157602
    • P. Umari and A. Pasquarello, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.89.157602 89, 157602 (2002).
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 157602
    • Umari, P.1    Pasquarello, A.2
  • 20
    • 0001419797 scopus 로고    scopus 로고
    • JPCSAW 0022-3697 10.1016/S0022-3697(99)00273-5
    • D. Vanderbilt, J. Phys. Chem. Solids JPCSAW 0022-3697 10.1016/S0022-3697(99)00273-5 61, 147 (2000).
    • (2000) J. Phys. Chem. Solids , vol.61 , pp. 147
    • Vanderbilt, D.1
  • 24
    • 33645426115 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.43.1993
    • N. Troullier and J. L. Martins, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.43.1993 43, 1993 (1991).
    • (1991) Phys. Rev. B , vol.43 , pp. 1993
    • Troullier, N.1    Martins, J.L.2
  • 25
    • 0034289756 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.62.8802
    • N. A. Hill and U. Waghmare, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.8802 62, 8802 (2000).
    • (2000) Phys. Rev. B , vol.62 , pp. 8802
    • Hill, N.A.1    Waghmare, U.2
  • 26
    • 33744582710 scopus 로고
    • PLRBAQ 0556-2805 10.1103/PhysRevB.18.3126
    • D. Ceperley, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.18.3126 18, 3126 (1978);
    • (1978) Phys. Rev. B , vol.18 , pp. 3126
    • Ceperley, D.1
  • 27
    • 33744691386 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.45.566
    • D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.45.566 45, 566 (1980).
    • (1980) Phys. Rev. Lett. , vol.45 , pp. 566
    • Ceperley, D.M.1    Alder, B.J.2
  • 28
    • 33645898818 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.45.13244
    • J. P. Perdew and Y. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.45.13244 45, 13244 (1992).
    • (1992) Phys. Rev. B , vol.45 , pp. 13244
    • Perdew, J.P.1    Wang, Y.2
  • 29
    • 33746213882 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.52.6301
    • W. Zhong, D. Vanderbilt, and K. M. Rabe, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.52.6301 52, 6301 (1995).
    • (1995) Phys. Rev. B , vol.52 , pp. 6301
    • Zhong, W.1    Vanderbilt, D.2    Rabe, K.M.3
  • 30
    • 36149007835 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.111.143
    • D. Berlincourt and H. Jaffe, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.111.143 111, 143 (1958).
    • (1958) Phys. Rev. , vol.111 , pp. 143
    • Berlincourt, D.1    Jaffe, H.2
  • 34
    • 0015982571 scopus 로고
    • FEROA8 0015-0193
    • A. W. Hewat, Ferroelectrics FEROA8 0015-0193 6, 215 (1974).
    • (1974) Ferroelectrics , vol.6 , pp. 215
    • Hewat, A.W.1
  • 35
    • 33846482863 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.142.570
    • T. C. Damen, S. P. S. Porto, and B. Tell, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.142.570 142, 570 (1966).
    • (1966) Phys. Rev. , vol.142 , pp. 570
    • Damen, T.C.1    Porto, S.P.S.2    Tell, B.3
  • 36
  • 37
    • 27144527160 scopus 로고    scopus 로고
    • Ph.D. thesis, Universite Catholique de Louvain
    • P. Ghosez, Ph.D. thesis, Universite Catholique de Louvain, 1997.
    • (1997)
    • Ghosez, P.1
  • 39
    • 0038503661 scopus 로고    scopus 로고
    • APOPAI 0003-6935
    • B. Wang and C. Sun, Appl. Opt. APOPAI 0003-6935 40, 672 (2001).
    • (2001) Appl. Opt. , vol.40 , pp. 672
    • Wang, B.1    Sun, C.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.