Experimental and theoretical characterization of the S1-S0 transition of benzo[a]pyrene

Journal of Chemical Physics

Volumn 105, Issue 17, 1996, Pages 7323-7335

  Gittins, Christopher M ^a   Rohlfing, Eric A ^a   Rohlfing, Celeste M ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001186511     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.472591     Document Type: Article

References (33)

1. Almega Corporation, "AB-2588 Pooled Source Emission Test Program," Report for the Western States Petroleum Association, August 31, 1990.
2. R. Stockdale, M. Lev-on, N. Meeks, C. H. Rebels, Western States Petroleum Association, "Pooled Source Test Program: Industry Specific Air Toxics Emission Factors," presented at the Air and Waste Management Association Meeting, Pittsburgh, Pennsylvania, March, 1991 (unpublished).
3. Clement Associates, Inc., 1989, "Comparative Potency Approach for Estimating the Cancer Risk Associated with Exposure to Mixtures of Polycyclic Aromatic Hydrocarbons," U.S. EPA, 1991, Integrated Risk Information Systems (IRIS).
4. M. Loepfe, H. Burtscher, and H. C. Seigmann, Water, Air, and Soil Pollution 68, 177 (1993).
5. H. Hepp, K. Siegmann, and K. Sattler, Chem. Phys. Lett. 233, 16 (1995).
6. K. Siegmann, H. Hepp, and K. Sattler, Combust. Sci. Technol. 109, 165 (1995).
7. K. Siegmann, H. Burtscher, and H. Hepp, J. Aerosol Sci. 24, S373 (1993).
8. H. Oser, R. Thanner, and H.-H. Grotheer, SPIE Proc. 2504, 15 (1995).
9. K. Siegmann, H. Hepp, K. Sattler, H. Burtscher, and H.-C. Siegmann, in Proceedings of the 1994 Symposium on Atomic, Cluster, and Surface Physics, 1994, p. 260 (unpublished).
10. J. Velazquez and T. A. Cool (private communication).
11. T. Imasaka, H. Fukuoka, T. Hayashi, and N. Ishibashi, Anal. Chim. Acta 156, 111 (1984).
12. G. D. Greenblatt, E. Nissani, E. Zaroura, and Y. Haas, J. Phys. Chem. 91, 570 (1987).
13. P. C. Hansen and C. A. Eckert, J. Chem. Eng. Data 31, 1 (1986).
14. N. J. Dovichi, D. S. Moore, and R. A. Keller, Appl. Opt. 21, 1468 (1982).
15. S. Bashkin and J. O. Stoner, Jr., Atomic Energy Levels and Grotrian Diagrams 1. Hydrogen I-Phosphorus XV (North-Holland/American Elsevier, New York, 1975).
16. M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. A. Robb, J. R. Cheeseman, T. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavachari, M. A. Al-Laham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, J. Cioslowski, B. B. Stefanov, A. Nanayakkara, M. Challacombe, C. Y. Peng, P. Y. Ayala, W. Chen, M. W. Wong, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. Defrees, J. Baker, J. P. Stewart, M. Head-Gordon, C. Gonzalez, and J. A. Pople, OAUSSIAN 94, Gaussian, Inc., Pittsburgh, Pennsylvania, 1995.
17. J. Iball, S. N. Scrimgeour, and D. W. Youns, Acta Crystallogr. B 32, 328 (1976).
18. J. Semmler, P. W. Yang, and G. E. Crawford, Vibr. Spectrosc. 2, 189 (1991).
19. W. J. Hehre, L. Radom, P. v. R. Schleyer, and J. A. Pople, Ab Initio Molecular Orbital Theory (Wiley, New York, 1986).
20. See, e.g., F. Negri and M. Z. Zgierski, J. Chem. Phys. 104, 3486 (1996).
21. J B Foresman, M. Head-Gordon, J. A. Pople, and M. J. Frisch, J. Phys. Chem. 96, 135 (1992).
22. R Boschi, J. N. Murrell, and W. Schmidt, Faraday Discuss. Chem. Soc. 54, 116 (1972).
23. H. A. Bethe and E. A. Salpeter, Quantum Mechanics of One and Two Electron Systems (Academic, New York, 1957);
24. \V. E. Cooke and T. F. Gallagher, Phys. Rev. A 17, 1226 (1978).
25. L. Zhu and P. Johnson, J. Chem. Phys. 94, 5769 (1991);
26. C. Borda, P. Brevet, M. Broyer, J. Chevaleyre, and P. Labastie, Europhys. Lett. 3, 789 (1987).
27. G. Herzberg, Infrared and Roman Spectra of Polyatomic Molecules (Van Nostrand, New York, 1945).
28. G. Z. Whitten and B. S. Rabinovitch, J. Chem. Phys. 38, 2466 (1963).
29. M. Yamaguchi, T. Momose, and T. Shida, J. Chem. Phys. 93, 4211 (1990).
30. D. Gruner and P. Brumer, J. Chem. Phys. 94, 2862 (1991).
31. B. Fourmann, C. Jouvet, A. Tramer, J. M. Le Bars, and Ph. Millie, Chem. Phys. 92, 25 (1985).
32. W. R. Scheldt and Y. J. Lee, Struct. Bond. 64, 1 (1987).
33. F. Duschinsky, Acta Physicochim. URSS 7, 551 (1937).