Prediction of self-diffusion coefficient and shear viscosity of water and its binary mixtures with methanol and ethanol by molecular simulation

Journal of Chemical Physics

Volumn 134, Issue 7, 2011, Pages

  Guevara Carrion, Gabriela ^a   Vrabec, Jadran ^b   Hasse, Hans ^a  

^a Rheinland Pfälzische Technische Universität Kaiserslautern Landau   (Germany)

^b UNIVERSITY OF PADERBORN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ALCOHOL MIXTURES; ANOMALOUS BEHAVIOR; CENTER OF MASS; EXCESS ENTHALPIES; EXCESS VOLUME; EXPERIMENTAL DATA; GREEN-KUBO; HYDROGEN BONDINGS; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SIMULATIONS; PRESSURE DEPENDENCE; PURE LIQUIDS; SELF-DIFFUSION COEFFICIENTS; WATER MODELS;

DIFFUSION IN LIQUIDS; ETHANOL; LIQUIDS; METHANOL; MOLECULAR DYNAMICS; ORGANIC POLYMERS; SHEAR VISCOSITY; TRANSPORT PROPERTIES; VISCOMETERS;

BINARY MIXTURES;

EID: 79951875084     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3515262     Document Type: Article

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