Quantum dynamics of the photoinitiated unimolecular dissociation of HOCO

Journal of Chemical Physics

Volumn 117, Issue 24, 2002, Pages 11139-11145

  Yu, Hua Gen ^a   Muckerman, James T ^a  

^a BROOKHAVEN NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

PHOTOINITIATED UNIMOLECULAR DISSOCIATION; POTENTIAL ENERGY SURFACE; QUANTUM DYNAMICS; TIME-DEPENDENT WAVE PACKET DYNAMICS;

BINDING ENERGY; CHEMICAL BONDS; CONFORMATIONS; ELECTRON ENERGY LEVELS; ELECTRON RESONANCE; MATHEMATICAL MODELS; MOLECULAR VIBRATIONS; OXIDES; PARTIAL DIFFERENTIAL EQUATIONS; PHOTODISSOCIATION; QUANTUM THEORY; STATISTICAL MECHANICS;

MOLECULAR DYNAMICS;

EID: 0037461489     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1522711     Document Type: Article

References (52)

1. M. E. Jacox, J. Chem. Phys. 88, 4598 (1988).
2. H. E. Radford, W. Wei, and T. J. Sears, J. Chem. Phys. 97, 3989 (1992).
3. T. J. Sears, W. M. Fawzy, and P. M. Johnson, J. Chem. Phys. 97, 3996 (1992).
4. T. J. Sears, H. E. Radford, and M. A. Moore, J. Chem. Phys. 98, 6624 (1993).
5. J. Petty and C. B. Moore, J. Mol. Spectrosc. 161, 149 (1993).
6. A. Miyoshi, H. Matsui, and N. Washida, J. Chem. Phys. 100, 3532 (1994).
7. B. Ruscic, M. Schwarz, and J. Berkowitz, J. Chem. Phys. 91, 6780 (1989).
8. B. Ruscic and M. Litorja, Chem. Phys. Lett. 316, 45 (2000).
9. M. W. Chase, J. Phys. Chem. Ref. Data Monogr. 9, 9 (1998).
10. T. V. Duncan and C. E. Miller, J. Chem. Phys. 113, 5138 (2000).
11. H.-G. Yu, J. T. Muckerman, and T. J. Sears. Chem. Phys. Lett. 349, 547 (2001).
12. R. S. Zhu, E. G. W. Diau, M. C. Lin, and A. M. Mebel, J. Phys. Chem. A 105, 11249 (2001).
13. N. F. Scherer, L. R. Khundkar, R. B. Bernstein, and A. H. Zewail, J. Chem. Phys. 87, 1451 (1987).
14. N. F. Scherer, C. Sipes, R. B. Bernstein, and A. H. Zewail, J. Chem. Phys. 92, 5239 (1990).
15. S. I. Ionov, G. A. Brucker, C. Jaques, L. Valachovic, and C. Wittig, J. Chem. Phys. 97, 9486 (1992).
16. S. I. Ionov, G. A. Brucker, C. Jaques, L. Valachovic, and C. Wittig, J. Chem. Phys. 99, 6553 (1993).
17. D. Fulle, H. F. Hamann, H. Hippler, and J. Troe, J. Chem. Phys. 105, 983 (1996).
18. K. Kudla, G. C. Schatz, and A. F. Wagner, J. Chem. Phys. 95, 1635 (1991).
19. G. C. Schatz, and J. Dyke, J. Chem. Phys. Lett. 188, 11 (1992).
20. M. I. Hernández, and D. C. Clary, J. Chem. Phys. 101, 2779 (1994).
21. D. C. Clary and G. C. Schatz, J. Chem. Phys. 99, 4578 (1993).
22. D. H. Zhang and J. Z. H. Zhang, J. Chem. Phys. 103, 6512 (1995).
23. F. N. Dzegilenko and J. M. Bowman, J. Chem. Phys. 108, 511 (1998).
24. K. L. Feilberg, G. D. Billing, and M. S. Johnson, J. Phys. Chem. A 105, 11171 (2001).
25. E. M. Goldfield, S. K. Gray, and G. C. Schatz, J. Chem. Phys. 102, 8807 (1995).
26. D. A. McCormack and G.-J. Kroes, J. Chem. Phys. 116, 4184 (2002).
27. D. A. McCormack and G.-J. Kroes, Chem. Phys. Lett. 352, 281 (2002).
28. D. H. Zhang and J. Z. H. Zhang, J. Chem. Phys. 101, 5615 (1994).
29. M. I. Lester, B. V. Pond, D. T. Anderson, L. B. Harding, and A. F. Wagner, J. Chem. Phys. 113, 9889 (2000).
30. M. I. Lester, B. V. Pond, M. D. Marshall, D. T. Anderson, L. B. Harding, and A. F. Wagner, Faraday Discuss. 118, 373 (2001).
31. G. D. Billing, J. T. Muckerman, and H.-G. Yu, J. Chem. Phys. 117, 4755 (2002).
32. J. A. Bentley, R. E. Wyatt, M. Menou, and C. Leforestier, J. Chem. Phys. 97, 4255 (1992).
33. J. Echave and D. C. Clary, J. Chem. Phys. 100, 402 (1994).
34. L. Liu and J. T. Muckerman, J. Chem. Phys. 107, 3402 (1997).
35. M. D. Feit and J. A. Fleck, Appl. Opt. 17, 3990 (1978).
36. C. Temperton, J. Comput. Phys. 58, 283 (1985).
37. C. Temperton, J. Comput. Phys. 82, 247 (1989).
38. A. J. C. Varandas and H. G. Yu, J. Chem. Soc., Faraday Trans. 93, 819 (1997).
39. S. K. Gray, J. Chem. Phys. 96, 6543 (1992).
40. P. Pernot and W. A. Lester, Jr., Int. J. Quantum Chem. 40, 577 (1991).
41. R. Heather and H. Metiu, J. Chem. Phys. 86, 5009 (1987).
42. J. Z. H. Zhang, J. Dai, and W. Zhu, J. Phys. Chem. A 101, 2746 (1997).
43. G. Nyman and H. G. Yu, Rep. Prog. Phys. 63, 1001 (2000).
44. G. Breit and E. P. Wigner, Phys. Rev. 49, 519 (1936).
45. R. Sadeghi and R. T. Skodje, J. Chem. Phys. 102, 193 (1995).
46. J. Aguilar and J. M. Combes, Commun. Math. Phys. 22, 269 (1971).
47. M. R. Wall and D. Neuhauser, J. Chem. Phys. 102, 8011 (1995).
48. J. W. Pang, T. Dieckmann, J. Feigon, and D. Neuhauser, J. Chem. Phys. 108, 8360 (1998).
49. V. A. Mandelshtam and H. S. Taylor, J. Chem. Phys. 107, 6756 (1997).
50. R. Chen and H. Guo, J. Chem. Phys. 105, 1311 (1996).
51. H.-G. Yu and S. C. Smith, Ber. Bunsenges. Phys. Chem. 101, 400 (1997);
52. H.-G. Yu and S. C. Smith, Chem. Phys. Lett. 283, 69 (1998).