Quantum dynamics of photoexcited cyclohexadiene introducing reactive coordinates

Journal of Chemical Physics

Volumn 112, Issue 11, 2000, Pages 5054-5059

  Hofmann, Angelika ^a   De Vivie Riedle, Regina ^a  

^a MAX PLANCK INSTITUT FÜR QUANTENOPTIK   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000348106     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.481059     Document Type: Article

References (39)

1. F. Bernardi, M. Olivucci, and M. A. Robb, J. Photochem. Photobiol., A 105, 365 (1997).
2. W. Domcke and G. Stock, Adv. Chem. Phys. 100, 1 (1997).
3. M. Klessinger, Pure Appl. Chem. 69, 773 (1997).
4. W. Fuß et al., Chem. Phys. 232, 161 (1998).
5. S. H. Pullen, N. A. Anderson, L. A. Walker II, and R. J. Sension, J. Chem. Phys. 108, 556 (1998).
6. M. O. Trulson, G. D. Dollinger, and R. A. Mathies, J. Chem. Phys. 90, 4274 (1989).
7. U. Manthe and H. Köppel, J. Chem. Phys. 93, 1658 (1990).
8. L. Seidner, G. Stock, and W. Domcke, J. Chem. Phys. 103, 3998 (1995).
9. P. Cattaneo and M. Persico, J. Phys. Chem. A 101, 3454 (1997).
10. A. Ferretti, A. Lami, and G. Villani, J. Chem. Phys. 106, 934 (1997).
11. S. Hahn and G. Stock, Chem. Phys. Lett. 296, 137 (1998).
12. A. Ferretti, A. Lami, and G. Villani, Chem. Phys. Lett. 290, 131 (1998).
13. A. Ferretti, A. Lami, and G. Villani, J. Chem. Phys. 109, 9002 (1998).
14. A. Ferretti, A. Lami, and G. Villani, J. Chem. Phys. 111, 916 (1999).
15. G. A. Worth, H.-D. Meyer, and L. S. Cederbaum, J. Chem. Phys. 105, 4412 (1996).
16. G. A. Worth, H.-D. Meyer, and L. S. Cederbaum, J. Chem. Phys. 109, 3518 (1998).
17. P. Celani, F. Bernardi, M. A. Robb, and M. Olivucci, J. Phys. Chem. 100, 19364 (1996).
18. P. Celani et al., J. Am. Chem. Soc. 116, 10141 (1994).
19. M. Garavelli et al., J. Photochem. Photobiol., A 114, 109 (1998).
20. M. Olivucci (private communication).
21. W. H. Miller, N. C. Handy, and J. E. Adams, J. Chem. Phys. 72, 99 (1980).
22. B. A. Ruf and W. H. Miller, J. Chem. Soc. 84, 1523 (1988).
23. M. Garavelli et al., J. Phys. Chem. A 101, 2023 (1997).
24. M. Garavelli et al., Faraday Discuss. 110, 51 (1998).
25. M. B. R. Koradi and K. Wüthrich, J. Mol. Graphics 14, 51 (1996).
26. M. Garavelli (private communication).
27. M. J. Frisch et al., GAUSSIAN94, Revision E.2, Gaussian, Inc., Pittsburgh, PA, 1995.
28. L. Laaksonen, GOPENMOL: Program for the display and analysis of molecular structures, Centre for Scientific Computing, Espoo, Finland.
29. R. Franke, J. Inst. Math. Appl. 19, 471 (1977).
30. R. Franke, Math. Comput. 38, 181 (1982).
31. R. Franke, Comput. Math. Appl. 8, 273 (1982).
32. R. Kosloff, J. Phys. Chem. 92, 2087 (1988).
33. R. Kosloff, Annu. Rev. Phys. Chem. 45, 145 (1994).
34. C. Leforestier et al., J. Comput. Phys. 94, 59 (1991).
35. K. Sundermann, Ph.D. thesis, FU Berlin, 1998.
36. J. M. D. Hill, S. R. Donaldson, and A. McEwan, Installation and User Guide for the Oxford BSP toolset (v1.4) implementation of BSPlib (Oxford University Computing Laboratory, 1998).
37. L. Kurtz (private communication).
38. W. Fuß et al., Chem. Phys. Lett. 262, 675 (1996).
39. S. A. Trushin et al., J. Chem. Phys. 106, 9386 (1997).