Vibronic structure of the emission spectra from single vibronic levels of the S1 manifold in naphthalene: Theoretical simulation

Journal of Chemical Physics

Volumn 104, Issue 10, 1996, Pages 3486-3500

  Negri, Fabrizia ^a   Zgierski, Marek Z ^b  

^a UNIVERSITY OF BOLOGNA   (Italy)

^b NATIONAL RESEARCH COUNCIL CANADA   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000708046     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.471054     Document Type: Article

References (26)

1. J. R. Platt, J. Chem. Phys. 17, 484 (1949).
2. W. Moffitt, J. Chem. Phys. 22, 320 (1954).
3. M. Gouterman, J. Mol. Spectrosc. 6, 138 (1961).
4. H. Sellers, P. Pulay, and J. E. Boggs, J. Am. Chem. Soc. 107, 6487 (1985).
5. M. Stockburger, H. Gatterman, and W. Klusman, J. Chem. Phys. 63, 4519, 4529 (1975).
6. M. Z. Zgierski, Chem. Phys. Lett. 47, 599 (1977).
7. U. Boesl, H. J. Neusser, and E. W. Schlag, Chem Phys. 15, 167 (1976).
8. N. Mikami and H. K. Hong, Bull. Chem. Soc. Jpn. 52, 3484 (1979).
9. M. Gutmann, P. F. Schönzart, and G. Hohlneicher, Chem. Phys. 140, 107 (1990).
10. S. M. Beck, D. E. Powers, J. B. Hopkins, and R. E. Smalley, J. Chem. Phys. 73, 2019 (1980).
11. S. M. Beck, J. B. Hopkins, D. E. Powers, and R. E. Smalley, J. Chem. Phys. 74, 43 (1981).
12. F. M. Behlen, D. B. McDonald, V. Sethuraman, and S. A. Rice, J. Chem. Phys. 75, 5685 (1981).
13. M. J. Robey, I. G. Ross, R. V. Southwood-Jones, and S. J. Strickler, Chem. Phys. 23, 207 (1977).
14. A. Warshel and M. Karplus, J. Am. Chem. Soc. 94, 5612 (1972).
15. F. Zerbetto, M. Z. Zgierski, F. Negri, and G. Orlandi, J. Chem. Phys. 89, 3681 (1988).
16. J. Del Bene and H. H. Jaffe, J. Chem. Phys. 48, 1807 (1968).
17. GAUSSIAN 92/DFT, Revision G.2, M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. W. Wong, J. B. Foresman, M. A. Robb, M. Head-Gordon, E. S. Replogle, R. Gomperts, J. L. Andres, K. Raghavachari, J. S. Binkley, C. Gonzalez, R. L. Martin, D. J. Fox, D. J. Defrees, J. Baker, J. J. P. Stewart, and J. A. Pople Gaussian, Inc., Pittsburgh, Pennsylvania, 1993.
18. M. Z. Zgierski, J. Chem. Phys. 85, 109 (1986).
19. P. Swiderek, G. Hohlneicher, S. A. Maluendes, and M. Dupuis, J. Chem. Phys. 98, 974 (1993).
20. P. Pulay, G. Fogarasi, and J. E. Boggs, J. Chem. Phys. 74, 3999 (1981).
21. J. B. Foresman, M. Head-Gordon, J. A. Pople, and M. J. Frisch, J. Chem. Phys. 96, 135 (1992).
22. G. Orlandi, P. Palmieri, R. Tarroni, F. Zerbetto, and M. Z. Zgierski, J. Chem. Phys. 100, 2458 (1994).
23. M. Z. Zgierski and F. Zerbetto, J. Chem. Phys. 99, 3721 (1993).
24. M. Z. Zgierski and F. Zerbetto, J. Chem. Phys. 98, 14 (1993).
25. F. Zerbetto and M. Z. Zgierski, J. Chem. Phys. 98,4822 (1993);
26. F. Zerbetto and M. Z. Zgierski, J. Chem. Phys. 101, 1842 (1994).