An improved thermodynamic perturbation theory for Mercedes-Benz water

Journal of Chemical Physics

Volumn 127, Issue 17, 2007, Pages

  Urbic, T ^a   Vlachy, V ^a   Kalyuzhnyi, Yu V ^b   Dill, K A ^c  

^a UNIVERSITY OF LJUBLJANA   (Slovenia)

^b INSTITUTE FOR CONDENSED MATTER PHYSICS   (Ukraine)

^c UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; HYDROGEN BONDS; MATHEMATICAL MODELS; MONTE CARLO METHODS; PERTURBATION TECHNIQUES; WATER;

ISOTHERMAL COMPRESSIBILITY; MERCEDES-BENZ MODEL; THERMODYNAMIC PERTURBATION THEORY;

THERMAL EXPANSION;

WATER;

ARTICLE; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; HYDROGEN BOND; METHODOLOGY; MONTE CARLO METHOD; PHYSICAL CHEMISTRY; SOLUTION AND SOLUBILITY; STATISTICAL MODEL; TEMPERATURE; THERMODYNAMICS;

CHEMISTRY, PHYSICAL; COMPUTER SIMULATION; HYDROGEN BONDING; MODELS, STATISTICAL; MOLECULAR CONFORMATION; MONTE CARLO METHOD; SOLUTIONS; TEMPERATURE; THERMODYNAMICS; WATER;

EID: 36048986660     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2784124     Document Type: Article

References (39)

1. D. Eisenberg and W. Kauzmann, The Structure and Properties of Water (Oxford University Press, Oxford, 1969).
2. Water, a Comprehensive Treatise, edited by, F. Franks, (Plenum, New York, 1972), Vols. 1-7.
3. F. H. Stillinger, Science 209, 451 (1980).
4. C. Tanford, The Hydrophobic Effect: Formation of Micelles and Biological Membranes, 2nd ed. (Wiley, New York, 1980).
5. W. Blokzijl and J. B. F. N. Engberts, Angew. Chem., Int. Ed. Engl. 32, 1545 (1993).
6. G. Robinson, S.-B. Zhu, S. Singh, and M. Evans, Water in Biology, Chemistry and Physics: Experimental Overviews and Computational Methodologies (World Scientific, Singapore, 1996).
7. R. Schmidt, Monatsch. Chem. 132, 1295 (1993).
8. B. Guillot, J. Mol. Liq. 101, 219 (2002).
9. A. Ben-Naim, Biophys. Chem. 105, 183 (2003).
10. L. R. Pratt, Annu. Rev. Phys. Chem. 53, 409 (2002).
11. J.-C. Soetens, C. Millot, C. Chipot, G. Jansen, J. G. Angyán, and B. Maigret, J. Phys. Chem. B 101, 10910 (1997).
12. B. Hess and Nico F. A. van der Vegt, J. Phys. Chem. B 110, 17616 (2006).
13. T. M. Truskett, P. G. Debenedetti, S. Sastry, and S. Torquato, J. Chem. Phys. 111, 2647 (1999).
14. T. M. Truskett and K. A. Dill, J. Phys. Chem. B 106, 11829 (2002).
15. K. A. Dill, T. M. Truskett, V. Vlachy, and B. Hribar-Lee, Annu. Rev. Biophys. Biomol. Struct. 34, 173 (2005).
16. I. Nezbeda, J. Kolafa, and Yu. V. Kalyuzhnyi, Mol. Phys. 68, 143 (1989).
17. I. Nezbeda and G. A. Iglezias-Silva, Mol. Phys. 69, 767 (1990).
18. I. Nezbeda, J. Mol. Liq. 73/74, 317 (1997).
19. G. Andaloro and R. M. Sperandeo-Mineo, Eur. J. Phys. 11, 275 (1990).
20. K. A. T. Silverstein, A. D. J. Haymet, and K. A. Dill, J. Am. Chem. Soc. 120, 3166 (1998).
21. K. A. T. Silverstein, K. A. Dill, and A. D. J. Haymet, Fluid Phase Equilib. 120, 3166 (1998).
22. N. T. Southall and K. A. Dill, J. Phys. Chem. B 104, 1326 (2000).
23. K. A. T. Silverstein, A. D. J. Haymet, and K. A. Dill, J. Chem. Phys. 114, 6303 (2001).
24. B. Hribar, N. T. Southall, V. Vlachy, and K. A. Dill, J. Am. Chem. Soc. 124, 12302 (2002).
25. A. Ben-Naim, J. Chem. Phys. 54, 3682 (1971).
26. A. Ben-Naim, Mol. Phys. 24, 705 (1972).
27. J. P. Hansen and I. R. McDonald, Theory of Simple Liquids (Academic, London, 1986).
28. M. S. Wertheim, J. Stat. Phys. 0022-4715 10.1007/BF01127721 42, 459 (1986); M. S. Wertheim, J. Stat. Phys. 42, 477 (1986).
29. M. S. Wertheim, J. Stat. Phys. 0022-4715 10.1007/BF01127721 42, 459 (1986); M. S. Wertheim, J. Stat. Phys. 42, 477 (1986).
30. M. S. Wertheim, J. Chem. Phys. 87, 7323 (1987).
31. M. S. Wertheim, J. Chem. Phys. 88, 1145 (1987).
32. M. S. Wertheim, J. Chem. Phys. 85, 2929 (1986).
33. T. Urbic, V. Vlachy, Yu. V. Kalyuzhnyi, N. T. Southall, and K. A. Dill, J. Chem. Phys. 112, 2843 (2000).
34. T. Urbic, V. Vlachy, Yu. V. Kalyuzhnyi, N. T. Southall, and K. A. Dill, J. Chem. Phys. 116, 723 (2002).
35. T. Urbic, V. Vlachy, Yu. V. Kalyuzhnyi, and K. A. Dill, J. Chem. Phys. 118, 5516 (2003).
36. T. Urbic, V. Vlachy, O. Pizio, and K. A. Dill, J. Mol. Liq. 112, 71 (2004).
37. T. Urbic, V. Vlachy, Yu. V. Kalyuzhnyi, and K. A. Dill, J. Chem. Phys. 127, 174505 (2007).
38. Yu. V. Kalyuzhnyi, G. Stell, M. L. Llano-Restrepo, W. G. Chapman, and M. F. Holovko, J. Chem. Phys. 101, 7939 (1994).
39. G. Jackson, W. G. Chapman, and K. E. Gubbins, Mol. Phys. 65, 1 (1988).