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Volumn 4, Issue , 2013, Pages

Quantum simulation of low-temperature metallic liquid hydrogen

Author keywords

[No Author keywords available]

Indexed keywords

HYDROGEN;

EID: 84890074893     PISSN: None     EISSN: 20411723     Source Type: Journal    
DOI: 10.1038/ncomms3064     Document Type: Article
Times cited : (100)

References (39)
  • 1
    • 36849136034 scopus 로고
    • On the possibility of a metallic modification of hydrogen
    • Wigner, E. & Huntington, H. B. On the possibility of a metallic modification of hydrogen. J. Chem. Phys. 3, 764-770 (1935).
    • (1935) J. Chem. Phys. , vol.3 , pp. 764-770
    • Wigner, E.1    Huntington, H.B.2
  • 2
    • 12044250331 scopus 로고
    • Ultrahigh-pressure transitions in solid hydrogen
    • Mao, H. K. & Hemley, R. J. Ultrahigh-pressure transitions in solid hydrogen. Rev. Mod. Phys. 66, 671-692 (1994).
    • (1994) Rev. Mod. Phys. , vol.66 , pp. 671-692
    • Mao, H.K.1    Hemley, R.J.2
  • 3
    • 0034628559 scopus 로고    scopus 로고
    • Structure and bandgap closure in dense hydrogen
    • Johnson, K. A. & Ashcroft, N. W. Structure and bandgap closure in dense hydrogen. Nature 403, 632-635 (2000).
    • (2000) Nature , vol.403 , pp. 632-635
    • Johnson, K.A.1    Ashcroft, N.W.2
  • 4
    • 6044238274 scopus 로고    scopus 로고
    • A superconductor to superfluid phase transition in liquid metallic hydrogen
    • Babaev, E., Sudbo, A. & Ashcroft, N. W. A superconductor to superfluid phase transition in liquid metallic hydrogen. Nature 431, 666-668 (2004).
    • (2004) Nature , vol.431 , pp. 666-668
    • Babaev, E.1    Sudbo, A.2    Ashcroft, N.W.3
  • 5
    • 6044240836 scopus 로고    scopus 로고
    • A quantum fluid of metallic hydrogen suggested by first-principles calculations
    • Bonev, S. A., Schwegler, E., Ogitsu, T. & Galli, G. A quantum fluid of metallic hydrogen suggested by first-principles calculations. Nature 431, 669-672 (2004).
    • (2004) Nature , vol.431 , pp. 669-672
    • Bonev, S.A.1    Schwegler, E.2    Ogitsu, T.3    Galli, G.4
  • 6
    • 42249108387 scopus 로고    scopus 로고
    • Melting line of hydrogen at high pressures
    • Deemyad, S. & Silvera, I. F. Melting line of hydrogen at high pressures. Phys. Rev. Lett. 100, 155701 (2008).
    • (2008) Phys. Rev. Lett. , vol.100 , pp. 155701
    • Deemyad, S.1    Silvera, I.F.2
  • 8
    • 0037061462 scopus 로고    scopus 로고
    • Optical studies of solid hydrogen to 320 GPa and evidence for black hydrogen
    • Loubeyre, P., Occelli, F. & LeToullec, R. Optical studies of solid hydrogen to 320 GPa and evidence for black hydrogen. Nature 416, 613-617 (2002).
    • (2002) Nature , vol.416 , pp. 613-617
    • Loubeyre, P.1    Occelli, F.2    LeToullec, R.3
  • 9
    • 81955167333 scopus 로고    scopus 로고
    • Conductive dense hydrogen
    • Eremets, M. I. & Troyan, I. A. Conductive dense hydrogen. Nat. Mater. 10, 927-931 (2011).
    • (2011) Nat. Mater. , vol.10 , pp. 927-931
    • Eremets, M.I.1    Troyan, I.A.2
  • 10
    • 84859609461 scopus 로고    scopus 로고
    • Synchrotron infrared measurements of dense hydrogen to 360 GPa
    • Zha, C. S., Liu, Z. X. & Hemley, R. J. Synchrotron infrared measurements of dense hydrogen to 360 GPa. Phys. Rev. Lett. 108, 146402 (2012).
    • (2012) Phys. Rev. Lett. , vol.108 , pp. 146402
    • Zha, C.S.1    Liu, Z.X.2    Hemley, R.J.3
  • 11
    • 84869411694 scopus 로고    scopus 로고
    • Implementation of micro-ball nanodiamond anvils for high-pressure studies above 6 Mbar
    • Dubrovinsky, L., Dubrovinskaia, N., Prakapenka, V. B. & Abakumov, A. M. Implementation of micro-ball nanodiamond anvils for high-pressure studies above 6 Mbar. Nat. Commun. 3, 1163 (2012).
    • (2012) Nat. Commun. , vol.3 , pp. 1163
    • Dubrovinsky, L.1    Dubrovinskaia, N.2    Prakapenka, V.B.3    Abakumov, A.M.4
  • 13
    • 79957461288 scopus 로고    scopus 로고
    • Vibron frequencies of solid H-2 and D-2 to 200 GPa and implications for the P-T phase diagram
    • Goncharov, A. F., Hemley, R. J. & Mao, H. K. Vibron frequencies of solid H-2 and D-2 to 200 GPa and implications for the P-T phase diagram. J. Phys. Chem. 134, 174501 (2011).
    • (2011) J. Phys. Chem. , vol.134 , pp. 174501
    • Goncharov, A.F.1    Hemley, R.J.2    Mao, H.K.3
  • 14
    • 34547852700 scopus 로고    scopus 로고
    • Phase transition in a strongly nonideal deuterium plasma generated by quasi-isentropical compression at megabar pressures
    • Fortov, V. E. et al. Phase transition in a strongly nonideal deuterium plasma generated by quasi-isentropical compression at megabar pressures. Phys. Rev. Lett. 99, 185001 (2007).
    • (2007) Phys. Rev. Lett. , vol.99 , pp. 185001
    • Fortov, V.E.1
  • 15
    • 0029663179 scopus 로고    scopus 로고
    • Metallization and electrical conductivity of hydrogen in Jupiter
    • Nellis, W. J., Weir, S. T. & Mitchell, A. C. Metallization and electrical conductivity of hydrogen in Jupiter. Science 273, 936-938 (1996).
    • (1996) Science , vol.273 , pp. 936-938
    • Nellis, W.J.1    Weir, S.T.2    Mitchell, A.C.3
  • 17
    • 45749135818 scopus 로고    scopus 로고
    • Ab initio description of high-temperature superconductivity in dense molecular hydrogen
    • Cudazzo, P. et al. Ab initio description of high-temperature superconductivity in dense molecular hydrogen. Phys. Rev. Lett. 100, 257001 (2008).
    • (2008) Phys. Rev. Lett. , vol.100 , pp. 257001
    • Cudazzo, P.1
  • 18
    • 80155179401 scopus 로고    scopus 로고
    • High-temperature superconductivity in atomic metallic hydrogen
    • McMahon, J. M. & Ceperley, D. M. High-temperature superconductivity in atomic metallic hydrogen. Phys. Rev. B 84, 144515 (2011).
    • (2011) Phys. Rev. B , vol.84 , pp. 144515
    • McMahon, J.M.1    Ceperley, D.M.2
  • 19
    • 34249764645 scopus 로고
    • Ab initio path-integral molecular-dynamics
    • Marx, D. & Parrinello, M. Ab initio path-integral molecular-dynamics. Z. Phys. B: Condens. Matter 95, 143-144 (1994).
    • (1994) Z. Phys. B: Condens. Matter , vol.95 , pp. 143-144
    • Marx, D.1    Parrinello, M.2
  • 20
    • 0000671855 scopus 로고    scopus 로고
    • Efficient and general algorithms for path integral Car-Parrinello molecular dynamics
    • Tuckerman, M. E., Marx, D., Klein, M. L. & Parrinello, M. Efficient and general algorithms for path integral Car-Parrinello molecular dynamics. J. Chem. Phys. 104, 5579-5588 (1996).
    • (1996) J. Chem. Phys. , vol.104 , pp. 5579-5588
    • Tuckerman, M.E.1    Marx, D.2    Klein, M.L.3    Parrinello, M.4
  • 21
    • 76649093610 scopus 로고    scopus 로고
    • Quantum nature of the proton in water-hydroxyl overlayers on metal surfaces
    • Li, X. Z., Probert, M. I. J., Alavi, A. & Michaelides, A. Quantum nature of the proton in water-hydroxyl overlayers on metal surfaces. Phys. Rev. Lett. 104, 066102 (2010).
    • (2010) Phys. Rev. Lett. , vol.104 , pp. 066102
    • Li, X.Z.1    Probert, M.I.J.2    Alavi, A.3    Michaelides, A.4
  • 24
    • 84875837774 scopus 로고    scopus 로고
    • Nature of proton transport in a water-filled carbon nanotube and in liquid water
    • Chen, J., Li, X. Z., Zhang, Q. F., Michaelides, A. & Wang, E. G. Nature of proton transport in a water-filled carbon nanotube and in liquid water. Phys. Chem. Chem. Phys. 15, 6344-6349 (2013).
    • (2013) Phys. Chem. Chem. Phys. , vol.15 , pp. 6344-6349
    • Chen, J.1    Li, X.Z.2    Zhang, Q.F.3    Michaelides, A.4    Wang, E.G.5
  • 26
    • 0141505012 scopus 로고    scopus 로고
    • First-principles simulations of direct coexistence of solid and liquid aluminum
    • Alfe, D. First-principles simulations of direct coexistence of solid and liquid aluminum. Phys. Rev. B 68, 064423 (2003).
    • (2003) Phys. Rev. B , vol.68 , pp. 064423
    • Alfe, D.1
  • 27
    • 34547264361 scopus 로고    scopus 로고
    • Structure of phase III of solid hydrogen
    • Pickard, C. J. & Needs, R. J. Structure of phase III of solid hydrogen. Nat. Phys. 3, 473-476 (2007).
    • (2007) Nat. Phys. , vol.3 , pp. 473-476
    • Pickard, C.J.1    Needs, R.J.2
  • 28
    • 84862661087 scopus 로고    scopus 로고
    • Density functional theory study of phase IV of solid hydrogen
    • Pickard, C. J., Martinez-Canales, M. & Needs, R. J. Density functional theory study of phase IV of solid hydrogen. Phys. Rev. B 85, 214114 (2012).
    • (2012) Phys. Rev. B , vol.85 , pp. 214114
    • Pickard, C.J.1    Martinez-Canales, M.2    Needs, R.J.3
  • 29
    • 84862661087 scopus 로고    scopus 로고
    • Erratum: Density functional theory study of phase IV of solid hydrogen
    • Pickard, C. J., Martinez-Canales, M. & Needs, R. J. Erratum: Density functional theory study of phase IV of solid hydrogen. Phys. Rev. B 86, 059902 (2012).
    • (2012) Phys. Rev. B , vol.86 , pp. 059902
    • Pickard, C.J.1    Martinez-Canales, M.2    Needs, R.J.3
  • 30
    • 79960635840 scopus 로고    scopus 로고
    • Ground-state structures of atomic metallic hydrogen
    • McMahon, J. M. & Ceperley, D. M. Ground-state structures of atomic metallic hydrogen. Phys. Rev. Lett. 106, 165302 (2011).
    • (2011) Phys. Rev. Lett. , vol.106 , pp. 165302
    • McMahon, J.M.1    Ceperley, D.M.2
  • 31
    • 84860364696 scopus 로고    scopus 로고
    • Quasi-molecular and atomic phases of dense solid hydrogen
    • Liu, H. Y., Wang, H. & Ma, Y. M. Quasi-molecular and atomic phases of dense solid hydrogen. J. Phys. Chem. C 116, 9221-9226 (2012).
    • (2012) J. Phys. Chem. C , vol.116 , pp. 9221-9226
    • Liu, H.Y.1    Wang, H.2    Ma, Y.M.3
  • 32
    • 84857580176 scopus 로고    scopus 로고
    • A fresh look at dense hydrogen under pressure. I. An introduction to the problem, and an index probing equalization of H-H distances
    • Labet, V., Gonzalez-Morelos, P., Hoffmann, R. & Ashcroft, N. W. A fresh look at dense hydrogen under pressure. I. An introduction to the problem, and an index probing equalization of H-H distances. J. Chem. Phys. 136, 074501 (2012).
    • (2012) J. Chem. Phys. , vol.136 , pp. 074501
    • Labet, V.1    Gonzalez-Morelos, P.2    Hoffmann, R.3    Ashcroft, N.W.4
  • 33
    • 84857519680 scopus 로고    scopus 로고
    • A fresh look at dense hydrogen under pressure. III. Two competing effects and the resulting intra-molecular H-H separation in solid hydrogen under pressure
    • Labet, V., Hoffmann, R. & Ashcroft, N. W. A fresh look at dense hydrogen under pressure. III. Two competing effects and the resulting intra-molecular H-H separation in solid hydrogen under pressure. J. Chem. Phys. 136, 074503 (2012).
    • (2012) J. Chem. Phys. , vol.136 , pp. 074503
    • Labet, V.1    Hoffmann, R.2    Ashcroft, N.W.3
  • 34
    • 0033132182 scopus 로고    scopus 로고
    • Quantum dynamics via adiabatic ab initio centroid molecular dynamics
    • Marx, D., Tuckerman, M. E. & Martyna, G. J. Quantum dynamics via adiabatic ab initio centroid molecular dynamics. Comp. Phys. Commun. 118, 166-184 (1999).
    • (1999) Comp. Phys. Commun. , vol.118 , pp. 166-184
    • Marx, D.1    Tuckerman, M.E.2    Martyna, G.J.3
  • 35
    • 77955603954 scopus 로고    scopus 로고
    • Evidence for a first-order liquid-liquid transition in high-pressure hydrogen from ab initio simulations
    • Morales, M. A., Pierleoni, C., Schwegler, E. & Ceperley, D. M. Evidence for a first-order liquid-liquid transition in high-pressure hydrogen from ab initio simulations. Proc. Natl Acad. Sci. USA 107, 12799-12803 (2010).
    • (2010) Proc. Natl Acad. Sci. USA , vol.107 , pp. 12799-12803
    • Morales, M.A.1    Pierleoni, C.2    Schwegler, E.3    Ceperley, D.M.4
  • 36
    • 76649110563 scopus 로고    scopus 로고
    • Structure and phase boundaries of compressed liquid hydrogen
    • Tamblyn, I. & Bonev, S. A. Structure and phase boundaries of compressed liquid hydrogen. Phys. Rev. Lett. 104, 065702 (2010).
    • (2010) Phys. Rev. Lett. , vol.104 , pp. 065702
    • Tamblyn, I.1    Bonev, S.A.2
  • 37
    • 77951918278 scopus 로고    scopus 로고
    • First-principles simulations of lithium melting: Stability of the bcc phase close to melting
    • Hernandez, E. R., Rodriguez-Prieto, A., Bergara, A. & Alfe, D. First-principles simulations of lithium melting: stability of the bcc phase close to melting. Phys. Rev. Lett. 104, 185701 (2010).
    • (2010) Phys. Rev. Lett. , vol.104 , pp. 185701
    • Hernandez, E.R.1    Rodriguez-Prieto, A.2    Bergara, A.3    Alfe, D.4
  • 38
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
    • Kresse, G. & Furthmüller, J. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Mat. Sci. 6, 15-50 (1996).
    • (1996) Comput. Mat. Sci. , vol.6 , pp. 15-50
    • Kresse, G.1    Furthmüller, J.2
  • 39
    • 0035878498 scopus 로고    scopus 로고
    • Thermodynamics of hexagonal-close-packed iron under Earth's core conditions
    • Alfe, D., Price, G. D. & Gillan, M. J. Thermodynamics of hexagonal-close-packed iron under Earth's core conditions. Phys. Rev. B 64, 045103 (2001).
    • (2001) Phys. Rev. B , vol.64 , pp. 045103
    • Alfe, D.1    Price, G.D.2    Gillan, M.J.3


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