A molecular dynamics simulation of water confined in a cylindrical SiO2 pore

Journal of Chemical Physics

Volumn 108, Issue 23, 1998, Pages 9859-9867

  Rovere, M ^a   Ricci, M A ^a   Vellati, D ^a   Bruni, F ^a  

^a ROMA TRE UNIVERSITY   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000860256     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.476424     Document Type: Article

References (29)

1. S. H. Chen, and M. C. Bellissent-Funel, Hydrogen Bond Networks, edited by M. C. Bellissent-Funel and J. C. Dore, NATO ASI Series C: Mathematical and Physical Science, Vol. 435 (Kluwer Academic, Dordrecht, 1994), pp. 337.
2. C. F. Polzanek and R. G. Bryant, J. Chem. Phys. 81, 4038 (1984); B. P. Hills and G. le Floc'k, Mol. Phys. 82, 751 (1994).
3. C. F. Polzanek and R. G. Bryant, J. Chem. Phys. 81, 4038 (1984); B. P. Hills and G. le Floc'k, Mol. Phys. 82, 751 (1994).
4. M. C. Bellissent-Funel, S. H. Chen, and J. M. Zanotti, Phys. Rev. E 51, 4558 (1995).
5. D. C. Steytler and J. C. Dore, Mol. Phys. 56, 1001 (1985).
6. M. C. Bellissent-Funel, J. Lal, and L. Bosio, J. Chem. Phys. 98, 4246 (1993).
7. D. C. Steytler, J. C. Dore, and C. J. Wright, Mol. Phys. 48, 1031 (1983).
8. M. C. Bellissent-Funel, R. Sridi-Dorbez, and L. Bosio, J. Chem. Phys. 104, 10023 (1996).
9. F. Bruni, M. A. Ricci, and A. K. Soper, J. Chem. Phys. (to be published).
10. A. K. Soper, F. Bruni, and M. A. Ricci, J. Chem. Phys. (to be published).
11. S. H. Lee, J. A. Mc Cammon, and P. J. Rossky, J. Chem. Phys. 80, 4448 (1984).
12. S. H. Lee and P. J. Rossky, J. Chem. Phys. 100, 3334 (1994).
13. P. J. Rossky, Hydrogen Bond Networks, edited by M. C. Bellissent-Funel and J .C. Dore, NATO ASI Series C: Mathematical and Physical Science, Vol. 435 (Kluwer Academic, Dordrecht, 1994), p. 337 and references therein.
14. L. Zhang, H. T. Davis, D. M. Kroll, and H. S. White, J. Phys. Chem. 99, 2878 (1995).
15. E. Spohr, J. Chem. Phys. 106, 388 (1997).
16. A. K. Soper, J. Phys.: Condens. Matter 9, 2399 (1997).
17. Information on Vycor glass industrial preparation is available from Corning OEM Sales Service, Box 5000, Corning, New York 14830.
18. A. Brodka and T. W. Zerda, J. Chem. Phys. 104, 6319 (1996).
19. B. P. Feuston and S. H. Garofalini, J. Chem. Phys. 89, 5818 (1988).
20. R. W. G. Wyckoff, Crystal Structures, 2nd ed. (Wiley, New York, 1963).
21. A. Brodka and T. W. Zerda, J. Chem. Phys. 95, 3710 (1991).
22. W. L. Jorgensen, J. Chandrasekhar, J. D. Madura, R. W. Impey, and M. L. Klein, J. Chem. Phys. 79, 926 (1983).
23. M. P. Allen and D. J. Tildesley, Computer Simulation of Liquids (Oxford University Press, Oxford, 1987).
24. M. Neumann, J. Chem. Phys. 85, 1567 (1986).
25. M. J. Benham, J. K. Cook, J. C. Li, D. K. Ross, P. L. Hall, and B. Sarkissian, Phys. Rev. B 39, 633 (1989).
26. S. Iarlori, F. Ercolessi, and E. Tosatti, in Supercomputing Tools for Science and Engineering, edited by D. Laforenza and R. Perego (Milan, 1990), p. 463.
27. B. M. Ladanyi and M. S. Skaf, Annu. Rev. Phys. Chem. 44, 335 (1993).
28. O. Glatter and O. Kratky, Small Angle X-ray Scattering (Academic, New York, 1992).
29. J. P. Brodholt, F. Bruni, P. Jedlovszky, M. A. Ricci, A. K. Soper, and R. Vallauri, J. Chem. Phys. (in press).