Correlations in liquid water for the TIP3P-Ewald, TIP4P-2005, TIP5P-Ewald, and SWM4-NDP models

Journal of Chemical Physics

Volumn 136, Issue 6, 2012, Pages

  Huggins, David J ^a,b  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^b UNIVERSITY OF CAMBRIDGE   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

BEST MATCH; ENGINEERED SYSTEMS; EXCESS ENTHALPIES; EXCESS ENTROPY; EXPERIMENTAL DATA; FOURTH-ORDER APPROXIMATION; HYDROGEN BOND ACCEPTORS; HYDROGEN BOND DONORS; LIQUID WATER; MOLECULAR DYNAMICS SIMULATIONS; ORDER PARAMETER; RADIAL DISTRIBUTION FUNCTIONS; SECOND ORDERS; STRUCTURE AND DYNAMICS; THIRD-ORDER; WATER MODELS; WATER MOLECULE;

ANGULAR DISTRIBUTION; ENTHALPY; ENTROPY; FREE ENERGY; HYDROGEN BONDS; MOLECULAR DYNAMICS; MOLECULES;

LIQUIDS;

WATER;

ARTICLE; CHEMISTRY; ENTROPY; HYDROGEN BOND; MOLECULAR DYNAMICS; THERMODYNAMICS;

ENTROPY; HYDROGEN BONDING; MOLECULAR DYNAMICS SIMULATION; THERMODYNAMICS; WATER;

EID: 84857274721     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3683447     Document Type: Conference Paper

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