Evaluating free energy, enthalpy, and entropy of protonated water clusters by a grand canonical Monte Carlo simulation

Journal of Chemical Physics

Volumn 113, Issue 22, 2000, Pages 10100-10104

  Kusaka, Isamu ^a   Oxtoby, David W ^a  

^a UNIVERSITY OF CHICAGO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; ENTHALPY; ENTROPY; FREE ENERGY; MATHEMATICAL MODELS; MONTE CARLO METHODS; PROTONS;

HYDRONIUM IONS;

WATER;

EID: 0034505364     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1312275     Document Type: Article

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