Ab initio study on the dissociation pathways of XSO2 ( X = Cl, F) radicals

Chemical Physics Letters

Volumn 269, Issue 1-2, 1997, Pages 128-137

  Li, Zhuangjie ^a  

^a UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0031585961     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(97)00262-5     Document Type: Article

References (36)

1. [1] J.H. Seinfeld, Atmospheric Chemistry and Physics of Air Pollution, Wiley, 1986.
2. [2] G. Brasseur and S. Solomon, Aeronomy of the Middle Atmosphere, 2nd ed., Reidel, Dordrecht, 1986.
3. [3] P.R. Wayne, Chemistry of Atmospheres, 2nd ed., Clarendon Press, Oxford, 1991.
4. [4] World Meteorological Organization, Scientific Assessment of Ozone Depletion: 1994, D.L. Albritton, R.T. Watson, and P.J. Aucamp co-chairs, Global Ozone Research and Monitoring Project-Report No. 37, Geneva, Switzerland, 1995.
5. [5] World Meteorological Organization, Scientific Assessment of Ozone Depletion: Global Ozone Research and Monitoring Project-Report No. 20, Vol. 2, 1989.
6. [6] World Meteorological Organization, Scientific Assessment of Ozone Depletion: Global Ozone Research and Monitoring Project-Report No. 25, 1991.
7. [7] Z. Li, T.S. Dibble, J.S. Francisco, Adv. Phys. Chem. 3 (1995) 686.
8. [8] W.B. DeMore, S.P. Sander, D.H. Golden, R.F. Hampson, M.J. Kurylo, C.J. Howard, A.R. Ravishankara, C.E. Kolb, M.J. Molina, Chemical Kinetics and Photochemical Data for Use in Stratospheric Modeling, Evaluation Number 11, JPL Publication 94-26, Jet Propulsion Laboratory, California Institute of Technology, Pasadena, CA, 1994.
9. [9] R.S. Stolarski, R.D. Rundel, Geophys. Res. Lett. 2 (1975) 443.
10. [10] P. Pagsberg, E. Ratajczak, A. Sillesen, J.T. Jodkowski, Chem. Phys. Lett. 88 (1987) 141.
11. [11] J.L. Lyman, R.J. Holland, J. Phys. Chem. 92 (1988) 7232.
12. [12] T. Ellermann, J. Sehested, O.J. Nielsen, T.J. Willington, P. Pagsberg, Chem. Phys. Lett. 218 (1993) 287.
13. [13] J.S. Francisco, Z. Li, I.H. Williams, Chem. Phys. Lett. 140 (1987) 531.
14. [14] Z. Li, J.S. Francisco, J. Am. Chem. Soc. 111 (1989) 660.
15. [15] J. Sehested, K. Sehested, O.J. Nielsen, J. Phys. Chem. 98 (1994) 6731.
16. [16] Z. Li, R.R. Friedl, S.P. Sander, J. Phys. Chem. 99 (1995) 13445.
17. [17] A.R. Ravishankara, A.A. Turnipseed, N.R. Jensen, S. Barone, M. Mills, C.J. Howard, S. Solomon, Science 263 (1994) 71.
18. [18] J. Sehested, O.J. Nielsen, Chem. Phys. Lett. 206 (1993) 369.
19. [19] A.A. Turnipseed, S.B. Barone, A.R. Ravishankara, J. Phys. Chem. 98 (1994) 4594.
20. [20] N.R. Jensen, D.R. Hanson, C.J. Howard, J. Phys. Chem. 98 (1994) 8574.
21. [21] R.Y. Zhang, M.-T. Leu, L.F. Keyser, J. Phys. Chem. 98 (1994) 13563, and references therein.
22. [22] J.T. Herron, J. Phys. Chem. Ref. Data 16 (1987) 1.
23. [23] S.W. Benson, Chem. Rev. 78 (1978) 23.
24. [24] K. Sudlow, A.A. Woolf, J. Fluorine Chem. 64 (1993) 269.
25. [25] K.L. Wray, E.V. Feldman, J. Chem. Phys. 54 (1971) 3445.
26. [26] Y.R. Sekhar, H. Bill, D. Lovy, Chem. Phys. Lett. 136 (1987) 57.
27. [27] R.J. Boyd, A. Gupta, R.F. Langler, S.P. Lownie, J.A. Pincock, Can. J. Chem. 58 (1980) 331.
28. [28] 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, 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, GAUSSIAN 94, Gaussian, Pittsburgh, PA, 1995.
29. [29] K. Raghavachari, J.A. Pople, E.S. Reploge, M. Head-Gordon, J. Phys. Chem. 94 (1990) 5579.
30. [30] L.A. Curtiss, K. Raghavachari, G.W. Trucks, J.A. Pople, J. Chem. Phys. 94 (1991) 7221.
31. [31] J.W. Ochterski, G.A. Petersson, J.A. Montgomery Jr., J. Chem. Phys. 104 (1995) 2598.
32. [32] Z. Li, Chem. Phys. Lett. to be published.
33. [33] Y. Endo, S. Saito, E. Hirota, J. Chem. Phys. 74 (1981) 1568.
34. [34] S. Sakai, K. Morokuma, Chem. Phys. 52 (1980) 33.
35. [35] G. Herzberg, Molecular Spectra and Molecaular Structure, Vol. III. Electronic Spectra and Electronic Structure of Polyatomic Molecules, Reprint Edition, Krieger, 1991.
36. [36] J.S. Francisco, A.N. Goldstein, Chem. Phys. 127 (1988) 73.