Quantum dynamics simulations of nonadiabatic processes in many-atom systems: Photoexcited Ba(Ar)10 and Ba(Ar)20 clusters

Journal of Chemical Physics

Volumn 104, Issue 15, 1996, Pages 5803-5814

  Jungwirth, Pavel ^a   Gerber, R Benny ^b  

^a J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY   (Czech Republic)

^b NONE

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0010866089     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.471312     Document Type: Article

References (29)

1. M. P. Allen and D. J. Tildesley, Computer Simulation of Liquids (Clarendon, Oxford, 1987).
2. R. M. Whitnell and K. R. Wilson, Reviews in Computational Chemistry, Vol. 4 (VCH, New York, 1993).
3. J. C. Tully and R. K. Preston, J. Chem. Phys. 55, 562 (1971).
4. J. C. Tully, J. Chem. Phys. 93, 1061 (1990).
5. P. J. Kuntz, J. Chem. Phys. 95, 141 (1991).
6. F. Webster, E. T. Wang, P. J. Rossky, and R. A. Friesner, J. Chem. Phys. 100, 4835 (1994).
7. H.-D. Meyer and W. H. Miller, J. Chem. Phys. 70, 3214 (1979).
8. P. Jungwirth and R. B. Gerber, J. Chem. Phys. 102, 6046 (1995).
9. J.-P. Visticot, P. de Pujo, J. M. Mestdagh, A. Lallement, J. Berlande, O. Sublemontier, P. Meynadier, and J. Cuvellier, J. Chem. Phys. 100, 158 (1994).
10. B. Schilling, M. A. Gaveau, O. Sublemontier, J. M. Mestdagh, J.-P. Visti-cot, X. Biquard, and J. Berlande, J. Chem. Phys. 101, 5722 (1994).
11. A. Krylov, R. B. Gerber, M. A. Gaveau, B. Schiling, J. M. Mesdagh, and J.-P. Visticot (unpublished).
12. P. Jungwirth and R. B. Gerber, J. Chem. Phys. 102, 8855 (1995).
13. R. B. Gerber, V. Buch, and M. A. Ratner, J. Chem. Phys. 77, 3022 (1982).
14. V. Aquilanti, G. Liuti, F. Pirani, and F. Vecchiocattivi, J. Chem. Soc. Faraday Trans. 85, 955 (1989).
15. C. H. Becker, P. Cassavecchia, and Y. T. Lee, J. Chem. Phys. 70, 5477 (1979).
16. F. O. Ellison, J. Am. Chem. Soc. 85, 3540 (1963).
17. A. Krylov (private communication).
18. J. Campos-Martinez, J. R. Waldeck, and R. D. Coalson, J. Chem. Phys. 96, 3613 (1992).
19. A. I. Krylov, R. B. Gerber, and V. A. Apkarian, Chem. Phys. 189, 261 (1994).
20. D. Kosloff and R. Kosloff, J. Comp. Phys. 52, 35 (1983).
21. R. Kosloff and D. Kosloff, J. Chem. Phys. 79, 1823 (1983).
22. A. Temperton, J. Comp. Phys. 52, 1 (1983).
23. E. Fredj and R. B. Gerber (unpublished).
24. R. A. Aziz and M. J. Slaman, Mol. Phys. 58, 679 (1986).
25. E. Czuchaj (unpublished).
26. J. C. Williamson, M. Dantus, S. B. Kim, and A. H. Zewail, Chem. Phys. Lett. 196, 529 (1992).
27. M. Dantus, S. B. Kim, J. C. Williamson, and A. H. Zewail, J. Phys. Chem. 98, 2782 (1994).
28. B. Van Wonterghem and P. M. Rentzepis, Appl. Phys. Lett. 56, 1005 (1990).
29. J. R. Schoonover and S. H. Lin, J. Solid State Chem. 76, 143 (1988).