Parsing partial molar volumes of small molecules: A molecular dynamics study

Journal of Physical Chemistry B

Volumn 115, Issue 16, 2011, Pages 4856-4862

  Patel, Nisha ^a   Dubins, David N ^a   Pomès, Régis ^b   Chalikian, Tigran V ^a  

^a UNIVERSITY OF TORONTO   (Canada)

^b HOSPITAL FOR SICK CHILDREN   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; MOLECULAR DYNAMICS; MONTE CARLO METHODS; SPHERES; VOLUMETRIC ANALYSIS;

CAVITY VOLUME; CHEMICAL NATURE; COMPUTATIONAL STUDIES; EMPIRICAL ESTIMATE; EXCLUDED VOLUME; EXPERIMENTAL DATA; HARD SPHERES; LENNARD JONES; LENNARD-JONES POTENTIAL; MD SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR INTERPRETATION; MONTE CARLO SIMULATION; PAIR INTERACTION POTENTIAL; PAIR POTENTIAL; PARTIAL MOLAR VOLUME; PRACTICAL ALGORITHMS; REPULSIVE LENNARD JONES; SCALED-PARTICLE THEORIES; SIMULATION RESULT; SMALL MOLECULES; VOLUMETRIC DATA;

VOLUME MEASUREMENT;

EID: 79955371309     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp2012792     Document Type: Article

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