On independence of the solvation of interaction sites of a water molecule

Journal of Chemical Physics

Volumn 118, Issue 14, 2003, Pages 6446-6454

  Předota, Milan ^a   Ben Naim, Arieh ^a,c   Nezbeda, Ivo ^a,b  

^a INSTITUTE OF CHEMICAL PROCESS FUNDAMENTALS   (Czech Republic)

^b J E PURKINJE UNIVERSITY   (Czech Republic)

^c HEBREW UNIVERSITY OF JERUSALEM   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; COMPUTER SIMULATION; FREE ENERGY; GRAPH THEORY; HYDROGEN BONDS; MATHEMATICAL MODELS; MOLECULAR ORIENTATION; MOLECULAR STRUCTURE; MONTE CARLO METHODS; PERTURBATION TECHNIQUES; PROBABILITY DISTRIBUTIONS; WATER;

HARD SPHERE INTERACTION; REPULSIVE INTERACTION; SOLVATION; THERMODYNAMIC PERTURBATION THEORY;

MOLECULAR DYNAMICS;

EID: 0037623279     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1559687     Document Type: Article

References (15)

1. J. S. Rowlinson, and F. L. Swinton, Liquids and Liquid Mixtures (Butterworths, London, 1982).
2. M. S. Wertheim, J. Stat. Phys. 42, 459 (1986).
3. A. Ben-Naim, Solvation Thermodynamics (Plenum, New York, 1987).
4. A. Ben-Naim, Statistical Thermodynamics for Chemists and Biochemists (Kluwer-Plenum, New York, 1992).
5. I. Nezbeda, J. Mol. Liq. 73-74, 317 (1997).
6. W. L. Jorgensen, J. Chandrasekhar, J. D. Madura, R. W. Impey, and M. L. Klein. J. Chem. Phys. 79, 92 (1983).
7. F. H. Stillinger and A. Rahman, J. Chem. Phys. 60, 1545 (1974).
8. B. Guillot, J. Mol. Liq. 101, 219 (2002).
9. A. Ben-Naim, J. Chem. Phys. 90, 7412 (1989).
10. I. Nezbeda and J. Slovák, Mol. Phys. 90, 353 (1997).
11. J. Slovák and I. Nezbeda, Mol. Phys. 91, 1125 (1997).
12. M. Strnad and I. Nezbeda, Mol. Phys. 93, 25 (1998).
13. M. P. Allen and D. J. Tildesley, The Computer Simulation of Liquids (Clarendon, Oxford, 1987).
14. M. Předota and I. Nezbeda, Mol. Phys. 96, 1237 (1999).
15. M. Předota, I. Nezbeda, and P. T. Cummings, Mol. Phys. 100, 2189 (2002).