A recipe for free-energy functionals of polarizable molecular fluids

Journal of Chemical Physics

Volumn 140, Issue 14, 2014, Pages

  Sundararaman, Ravishankar ^a   Letchworth Weaver, Kendra ^a   Arias, T A ^a  

^a School of Operations Research and Industrial Engineering   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

LIQUIDS; MOLECULAR DYNAMICS; ORGANIC SOLVENTS; POLARIZATION;

AB INITIO CALCULATIONS; ATTRACTIVE INTERACTIONS; DIELECTRIC RESPONSE; FUNDAMENTAL MEASURE THEORIES; INHOMOGENEOUS LIQUIDS; LONG RANGE CORRELATIONS; MOLECULAR DYNAMICS CALCULATION; NON-INTERACTING SYSTEM;

FREE ENERGY;

CARBON TETRACHLORIDE; CHLOROFORM; WATER;

CHEMISTRY; MOLECULAR DYNAMICS; QUANTUM THEORY; THERMODYNAMICS;

CARBON TETRACHLORIDE; CHLOROFORM; MOLECULAR DYNAMICS SIMULATION; QUANTUM THEORY; THERMODYNAMICS; WATER;

EID: 84898929896     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4870653     Document Type: Article

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