Importance sampling and theory of nonequilibrium solvation dynamics in water

Journal of Chemical Physics

Volumn 113, Issue 21, 2000, Pages 9759-9765

  Geissler, Phillip L ^a   Chandler, David ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC DENSITY OF STATES; ENERGY GAP; MONTE CARLO METHODS; RELAXATION PROCESSES; STATISTICS; WATER;

GAUSSIAN FIELD THEORY; NONEQUILIBRIUM SOLVATION DYNAMICS; TRANSITION PATH SAMPLING;

MOLECULAR DYNAMICS;

EID: 0034507196     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1290136     Document Type: Article

References (24)

1. B. Bagchi, D. W. Oxtoby, and G. R. Fleming, Chem. Phys. 86, 257 (1984).
2. E. W. Castner and M. Maroncelli, J. Mol. Liq. 77, 1 (1998).
3. M. Maroncelli, J. MacInnis, and G. R. Fleming, Science 243, 1674 (1989).
4. R. Jimenez, G. R. Fleming, P. V. Kumar, and M. Maroncelli, Nature (London) 369, 471 (1994).
5. J. S. Bader and D. Chandler, Chem. Phys. Lett. 157, 501 (1989).
6. R. A. Kuharski, J. S. Bader, D. Chandler, M. Sprik, M. L. Klein, and R. W. Impey, J. Chem. Phys. 89, 3248 (1988).
7. E. A. Carter and J. T. Hynes, J. Chem. Phys. 94, 5961 (1991).
8. M. S. Skaf and B. M. Ladanyi, J. Phys. Chem. 100, 18258 (1996).
9. T. Fonseca and B. M. Ladanyi, J. Mol. Liq. 60, 1 (1994).
10. M. Maroncelli and G. R. Fleming, J. Chem. Phys. 89, 5044 (1988).
11. C. Dellago, P. G. Bolhuis, F. S. Csajka, and D. Chandler, J. Chem. Phys. 108, 1964 (1998).
12. C. Dellago, P. G. Bolhuis, and D. Chandler, J. Chem. Phys. 108, 9236 (1998).
13. P. G. Bolhuis, C. Dellago, and D. Chandler, Faraday Discuss. 110, 421 (1998).
14. P. L. Geissler, C. Dellago, and D. Chandler, Phys. Chem. Chem. Phys. 1, 1317 (1999).
15. R. A. Marcus, J. Chem. Phys. 24, 966 (1956).
16. G. van der Zwan and J. T. Hynes, J. Phys. Chem. 89, 4181 (1985).
17. X. Song and D. Chandler, J. Chem. Phys. 108, 2594 (1998).
18. X. Song, D. Chandler, and R. A. Marcus, J. Phys. Chem. 100, 11954 (1996).
19. For example, D. Chandler, Introduction to Modern Statistical Mechanics (Oxford University Press, New York, 1987), Sec. 8.8.
20. D. Chandler, Phys. Rev. E 48, 2898 (1993); Y. Georgievskii, C.-P. Hsu, and R. A. Marcus, J. Chem. Phys 110, 5307 (1999).
21. D. Chandler, Phys. Rev. E 48, 2898 (1993); Y. Georgievskii, C.-P. Hsu, and R. A. Marcus, J. Chem. Phys. 110, 5307 (1999).
22. M. Neumann, J. Chem. Phys. 85, 1567 (1986).
23. H. Stehfest, Commun. ACM 13, 47 (1970).
24. P. L. Geissler, Ph.D. thesis, University of California, Berkeley.