Flexible simple point-charge water model with improved liquid-state properties

Journal of Chemical Physics

Volumn 124, Issue 2, 2006, Pages

  Wu, Yujie ^a   Tepper, Harald L ^b   Voth, Gregory A ^a  

^a UNIVERSITY OF UTAH   (United States)

^b FOM INSTITUTE AMOLF   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

DEGREES OF FREEDOM (MECHANICS); DIFFUSION; HYDROGEN BONDS; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; PERMITTIVITY; THERMODYNAMIC PROPERTIES;

EQUILIBRIUM BOND ANGLE; EQUILIBRIUM BOND LENGTH; INTRAMOLECULAR DEGREES OF FREEDOM; LIQUID PROPERTIES;

MATERIALS SCIENCE;

EID: 30744437399     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2136877     Document Type: Article

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