Quantum wave packet dynamics of the 1 3A″ N(4S) + NO(X̃2∏) → N2(X̃1∑g+) + O(3P) reaction

Journal of Chemical Physics

Volumn 119, Issue 14, 2003, Pages 7156-7162

  Gamallo, Pablo ^a   González, Miguel ^a   Sayos R ^a   Petrongolo, Carlo ^b  

^a UNIVERSITY OF BARCELONA   (Spain)

^b UNIVERSITY OF SIENA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

ASYMPTOTIC STABILITY; CALCULATIONS; CHEBYSHEV APPROXIMATION; GREEN'S FUNCTION; INTERPOLATION; MATHEMATICAL MODELS; MOLECULAR VIBRATIONS; POLYNOMIALS; RATE CONSTANTS; WAVE EQUATIONS;

CHEBYSHEV TIME RECURSION; QUANTUM DYNAMICS; QUANTUM WAVE PACKET DYNAMICS;

QUANTUM THEORY;

EID: 10744223005     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1606672     Document Type: Article

References (33)

1. P. Gamallo, M. González, and R. Sayós, J. Chem. Phys. 118, 10602 (2003).
2. P. Gamallo, M. González, and R. Sayós, J. Chem. Phys. 118, 2545 (2003).
3. T. H. Dunning, Jr., J. Chem. Phys. 90, 1007 (1989).
4. S. P. Walch and R. L. Jaffe, J. Chem. Phys. 86, 6947 (1987).
5. M. Gilibert, A. Aguilar, M. González, F. Mota, and R. Sayós, J. Chem. Phys. 97, 5542 (1992).
6. J. W. Duff and R. D. Sharma, Geophys. Res. Lett. 23, 2777 (1996).
7. M. Gilibert, A. Aguilar, M. González, and R. Sayós, J. Chem. Phys. 99, 1719 (1993).
8. A. Aguilar, M. Gilibert, X. Giménez, M. González, and R. Sayós, J. Chem. Phys. 103, 4496 (1995).
9. J. W. Duff and R. D. Sharma, Chem. Phys. Lett. 265, 404 (1997).
10. M. A. A. Clyne and I. S. McDermid, J. Chem. Soc. Faraday Trans. 71, 2189 (1975).
11. J. H. Lee, J. V. Michael, W. A. Payne, and L. J. Stief, J. Chem. Phys. 69, 3069 (1978).
12. J. V. Michael and K. P. Lim, J. Chem. Phys. 97, 3228 (1992).
13. P. O. Wennberg, J. G. Anderson, and D. K. Weisenstein, J. Geophys. Res. 99, 18839 (1994), and references therein.
14. D. L. Baulch, C. J. Cobos, R. A. Cox et al., J. Phys. Chem. Ref. Data 23, 847 (1994), and references therein.
15. W. B. DeMore, S. P. Sander, C. J. Howard, A. R. Ravinshankara, D. M. Golden, C. E. Kolb, R. F. Hampson, M. J. Kurylo, and M. J. Molina, in Chemical Kinetics and Photochemical Data for Use in Stratospheric Modeling, Evaluation 12, NASA-JPL, Publication 97-4 (Pasadena, CA, 1997), and references therein.
16. D. E. Siskind and D. W. Rusch, J. Geophys. Res. 97, 3209 (1992).
17. J. L. Fox, J. Geophys. Res. 99, 6273 (1994).
18. S. K. Gray and G. G. Balint-Kurti, J. Chem. Phys. 108, 950 (1998).
19. Y. Huang, D. J. Kouri, and D. K. Hoffman, J. Chem. Phys. 101, 10493 (1994).
20. Y. Huang, S. S. Iyengar, D. J. Kouri, and D. K. Hoffman, J. Chem. Phys. 105, 927 (1996).
21. V. A. Mandelshtam and H. S. Taylor, J. Chem. Phys. 102, 7390 (1995).
22. V. A. Mandelshtam and H. S. Taylor, J. Chem. Phys. 103, 2903 (1995).
23. R. Chen and H. Guo, J. Chem. Phys. 105, 3569 (1996).
24. R. Chen and H. Guo, Chem. Phys. Lett. 261, 605 (1996).
25. A. J. H. Meijer, E. M. Goldfield, S. K. Gray, and G. G. Balint-Kurti, Chem. Phys. Lett. 293, 270 (1998).
26. G. Herzberg, Molecular Spectra and Molecular Structure (Krieger, Malabar, Florida, 1989), Vol. I, p. 134.
27. S. K. Gray, G. G. Balint-Kurti, G. C. Schatz, J. J. Lin, X. Liu, S. Harich, and X. Yang, J. Chem. Phys. 113, 7330 (2000).
28. R. T. Pack, J. Chem. Phys. 60, 633 (1974).
29. R. D. Levine and R. B. Bernstein, Molecular Reaction Dynamics and Chemical Reactivity (Oxford University Press, New York, 1987), pp. 179 and 59.
30. K. P. Huber and G. Herzberg, Molecular Spectra and Molecular Structure (Van Nostrand, New York 1979), Vol. IV, p. 476.
31. P. Defazio, C. Petrongolo, C. Oliva, M. González, and R. Sayós, J. Chem. Phys. 117, 3647 (2002).
32. P. Defazio, C. Petrongolo, S. K. Gray, and C. Oliva, J. Chem. Phys. 115, 3208 (2001).
33. S. K. Gray, C. Petrongolo, K. Drukker, and G. C. Schatz, J. Phys. Chem. A 103, 9448 (1999).