Polarizable interaction potential for water from coupled cluster calculations. II. Applications to dimer spectra, virial coefficients, and simulations of liquid water

Journal of Chemical Physics

Volumn 128, Issue 9, 2008, Pages

  Bukowski, Robert ^a   Szalewicz, Krzysztof ^a   Groenenboom, Gerrit C ^b   Van Der Avoird, Ad ^b  

^a UNIVERSITY OF DELAWARE   (United States)

^b RADBOUD UNIVERSITY NIJMEGEN   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

DIMERS; MATHEMATICAL MODELS; POTENTIAL ENERGY; SPECTRUM ANALYSIS; WATER;

LIQUID WATER; POLARIZABLE INTERACTION POTENTIAL; VIRIAL COEFFICIENTS;

POLARIZATION;

EID: 40549121992     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2832858     Document Type: Article

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