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Volumn 84, Issue 22, 2011, Pages

Ground-state structures of ice at high pressures from ab initio random structure searching

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EID: 84855301453     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.84.220104     Document Type: Article
Times cited : (40)

References (32)
  • 1
    • 0003812713 scopus 로고
    • Oxford University Press, New York
    • P. V. Hobbs, Ice Physics (Oxford University Press, New York, 1974).
    • (1974) Ice Physics
    • Hobbs, P.V.1
  • 3
    • 0033214415 scopus 로고    scopus 로고
    • Interiors of giant planets inside and outside the solar system
    • DOI 10.1126/science.286.5437.72
    • T. Guillot, Science SCIEAS 0036-8075 10.1126/science.286.5437.72 286, 72 (1999). (Pubitemid 29484477)
    • (1999) Science , vol.286 , Issue.5437 , pp. 72-77
    • Guillot, T.1
  • 6
    • 61349200925 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.102.075503
    • D. K. Bradley, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.102. 075503 102, 075503 (2009).
    • (2009) Phys. Rev. Lett. , vol.102 , pp. 075503
    • Bradley, D.K.1
  • 7
    • 67651204146 scopus 로고    scopus 로고
    • JCOMEL 0953-8984 10.1088/0953-8984/21/28/283101
    • G. Malenkov, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/21/28/283101 21, 283101 (2009).
    • (2009) J. Phys. Condens. Matter , vol.21 , pp. 283101
    • Malenkov, G.1
  • 9
    • 0001761651 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.52.1312
    • A. Polian and M. Grimsditch, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.52.1312 52, 1312 (1984).
    • (1984) Phys. Rev. Lett. , vol.52 , pp. 1312
    • Polian, A.1    Grimsditch, M.2
  • 10
    • 45849154593 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.89.145501
    • M. Benoit, A. H. Romero, and D. Marx, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.89.145501 89, 145501 (2002).
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 145501
    • Benoit, M.1    Romero, A.H.2    Marx, D.3
  • 11
    • 50049086138 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.101.085502
    • R. Caracas, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.101. 085502 101, 085502 (2008).
    • (2008) Phys. Rev. Lett. , vol.101 , pp. 085502
    • Caracas, R.1
  • 14
    • 78149312160 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.105.195701
    • B. Militzer and H. F. Wilson, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.105.195701 105, 195701 (2010).
    • (2010) Phys. Rev. Lett. , vol.105 , pp. 195701
    • Militzer, B.1    Wilson, H.F.2
  • 15
    • 33746597118 scopus 로고    scopus 로고
    • High-pressure phases of silane
    • DOI 10.1103/PhysRevLett.97.045504
    • C. J. Pickard and R. J. Needs, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.97.045504 97, 045504 (2006). (Pubitemid 44147322)
    • (2006) Physical Review Letters , vol.97 , Issue.4 , pp. 045504
    • Pickard, C.J.1    Needs, R.J.2
  • 16
    • 79551662789 scopus 로고    scopus 로고
    • JCOMEL 0953-8984 10.1088/0953-8984/23/5/053201
    • C. J. Pickard and R. J. Needs, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/23/5/053201 23, 053201 (2011).
    • (2011) J. Phys. Condens. Matter , vol.23 , pp. 053201
    • Pickard, C.J.1    Needs, R.J.2
  • 17
    • 79960635840 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.106.165302
    • J. M. McMahon and D. M. Ceperley, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.106.165302 106, 165302 (2011).
    • (2011) Phys. Rev. Lett. , vol.106 , pp. 165302
    • McMahon, J.M.1    Ceperley, D.M.2
  • 18
    • 70349568754 scopus 로고    scopus 로고
    • JCOMEL 0953-8984 10.1088/0953-8984/21/39/395502
    • P. Giannozzi, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/21/39/395502 21, 395502 (2009)
    • (2009) J. Phys. Condens. Matter , vol.21 , pp. 395502
    • Giannozzi, P.1
  • 19
    • 84855318687 scopus 로고    scopus 로고
    • [
    • [http://www.quantum-espresso.org].
  • 20
    • 33645426115 scopus 로고
    • PRBMDO 1098-0121 10.1103/PhysRevB.43.1993
    • N. Troullier and J. L. Martins, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.43.1993 43, 1993 (1991).
    • (1991) Phys. Rev. B , vol.43 , pp. 1993
    • Troullier, N.1    Martins, J.L.2
  • 21
    • 20844450609 scopus 로고    scopus 로고
    • Static and dynamical properties of heavy water at ambient conditions from first-principles molecular dynamics
    • DOI 10.1063/1.1908913, 204510
    • P. H.-L. Sit and N. Marzari, J. Chem. Phys. 0021-9606 10.1063/1.1908913 122, 204510 (2005). (Pubitemid 40858511)
    • (2005) Journal of Chemical Physics , vol.122 , Issue.20 , pp. 1-9
    • Sit, P.H.-L.1    Marzari, N.2
  • 22
    • 4243943295 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
    • J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865 77, 3865 (1996).
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 23
    • 84855317741 scopus 로고    scopus 로고
    • See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevB.84.220104 for additional computational details and results.
  • 25
    • 25044437775 scopus 로고
    • PRBMDO 1098-0121 10.1103/PhysRevB.49.16223
    • P. E. Blöchl, O. Jepsen, and O. K. Andersen, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.49.16223 49, 16223 (1994).
    • (1994) Phys. Rev. B , vol.49 , pp. 16223
    • Blöchl, P.E.1    Jepsen, O.2    Andersen, O.K.3
  • 27
    • 37549008699 scopus 로고    scopus 로고
    • 0021-9606 10.1063/1.2812268
    • C. J. Pickard and R. J. Needs, J. Chem. Phys. 0021-9606 10.1063/1.2812268 127, 244503 (2007).
    • (2007) J. Chem. Phys. , vol.127 , pp. 244503
    • Pickard, C.J.1    Needs, R.J.2
  • 28
    • 0032900918 scopus 로고    scopus 로고
    • Superionic and metallic states of water and ammonia at giant planet conditions
    • DOI 10.1126/science.283.5398.44
    • C. Cavazzoni, G. L. Chiarotti, S. Scandolo, E. Tosatti, M. Bernasconi, and M. Parrinello, Science SCIEAS 0036-8075 10.1126/science.283.5398.44 283, 44 (1999). (Pubitemid 29044839)
    • (1999) Science , vol.283 , Issue.5398 , pp. 44-46
    • Cavazzoni, C.1    Chiarotti, G.L.2    Scandolo, S.3    Tosatti, E.4    Bernasconi, M.5    Parrinello, M.6
  • 30
    • 78649669571 scopus 로고    scopus 로고
    • PRBMDO 1098-0121 10.1103/PhysRevB.82.174108
    • M. French, T. R. Mattsson, and R. Redmer, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.82.174108 82, 174108 (2010).
    • (2010) Phys. Rev. B , vol.82 , pp. 174108
    • French, M.1    Mattsson, T.R.2    Redmer, R.3


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