Study of molecular behavior in a water nanocluster: Size and temperature effect

Journal of Physical Chemistry B

Volumn 110, Issue 18, 2006, Pages 9286-9290

  Ju, Shin Pon ^a   Yang, Sheng Hui ^a   Liao, Ming Liang ^b  

^a NATIONAL SUN YAT SEN UNIVERSITY   (Taiwan)

^b AIR FORCE INSTITUTE OF TECHNOLOGY   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; HYDROGEN BONDS; MATHEMATICAL MODELS; MOLECULES; THERMAL EFFECTS; WATER;

FLEXIBLE THREE-CENTERED (F3C); INTRAMOLECULAR INTERACTIONS; NANOCLUSTER; SIZE EFFECT; WATER DENSITIES;

MOLECULAR DYNAMICS;

EID: 33744828251     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp056567p     Document Type: Article

References (26)

1. Narten, A. H.; Thiessen, W. E.; Blum, L. Science 1982, 217, 1033.
2. Pugliano, N.; Saykally, R. J. J. Chem. Phys. 1992, 96, 1832.
3. Kropman, M. F.; Bakker, H. J. Science 2001, 291, 2118.
4. Palinkas, O.; Kalman, E.; Kovacs, P. Mol Phys. 1977, 34, 525.
5. Stillinger, F. H. Science 1980, 209, 4455.
6. Xantheas, S. S.; Dunning, T. H. J. Chem. Phys. 1993, 99, 8774.
7. Gregory, J. K.; Clary, D. C.; Liu K.; Brown, M. G.; Saykally, R. J. Science 1997, 275, 814.
8. Brodskaya, E. N.; Eriksson J. C.; Laaksonen, A.; Rusanov, A. I. J. Colloid Interface Sci. 1996, 180, 86.
9. Silvestrelli, P. L.; Parrihello, M. Phys. Rev. Lett., 1999, 82, 308.
10. Luzar, A. Chem. Phys. 2000, 258, 267.
11. Sokol, M.; Dawid, A.; Dendzik, Z.; Gburski, Z. J. Mol. Struct. 2004, 704, 341.
12. Egorov, A. V.; Komolkin, A. V.; Chizhik, V. I.; Padro, K. A.; Gvardia E. J. Phys. Chem. 2000, 74, 1650.
13. Yeh, I. C.; Hummer, G. J. Phys. Chem. B 2004, 108, 15873.
14. Guàrdia, E.; Martý, J. Phys. Rev. E 2004, 69, 011502.
15. Levitt, M.; Hirshberg, M.; Sharon, R.; Laidig, K. E.; Daggett, V. J. Phys. Chem. B 1997, 101, 5051.
16. Furbank, R. J.; Morrisa, J. F. Phys. Fluids 2004, 16, 1777.
17. Heine, D. R.; Grest, G. S.; Webb, E. B. Phys. Rev. Lett. 2005, 95, 107801.
18. Haile, J. M. Molecular Dynamics Simulation; Wiley-Interscience: New York, 1992; Chapter 4.
19. Rapaport, D. C. The Art of Molecular Dynamics Simulations.; Cambridge University Press: Cambridge, UK, 1997; Chapter 3.
20. Gordillo, M. C.; Marti, J. Chem. Phys. Lett. 2000, 329, 341.
21. Michael, L.; Miriam, H.; Ruth, S.; Keith, E. L.; Valerie, D. J. Phys. Rev. B 1997, 101, 5051.
22. Brint, C. L.; Burton, J. J. J. Chem. Phys. 1975, 63, 3327.
23. Zakharov, V. V.; Brodskaya, E. N.; Laaksonen, A. J. Chem. Phys. 1997, 107, 10675.
24. Erkoc, S. Phys. E 2000, 8, 210.
25. Lin, S. T.; Maiti, P. K.; Goddard, W. A. J. Phys. Chem. B 2005, 109, 8663.
26. Ju, S. P.; Chang, J. G.; Lin, J. S.; Lin, Y. S. J. Chem. Phys. 2005, 122, 154707.