Open AccessCommunication: The effect of dispersion corrections on the melting temperature of liquid water
Author(s) -
Soohaeng Yoo,
Sotiris S. Xantheas
Publication year - 2011
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.3573375
Subject(s) - molecular dynamics , thermodynamics , enthalpy , dispersion (optics) , liquid water , polarizability , ab initio , melting temperature , materials science , physics , density functional theory , chemistry , computational chemistry , molecule , optics , quantum mechanics , composite material
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