Wavepacket dynamics and quantum mechanical energy densities in the quartet N2+ + O2 system

Molecular Physics

Volumn 101, Issue 1-2, 2003, Pages 295-307

  Hasegawa, Koichi ^a   Doi, Kentaro ^a   Nakamura, Koichi ^a   Tachibana, Akitomo ^a  

^a KYOTO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CHARGE TRANSFER; ELECTRON ENERGY LEVELS; MOLECULAR VIBRATIONS; NITROGEN; OXYGEN; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY;

ION-DIPOLE INTERACTION; POTENTIAL ENERGY SURFACE; QUANTUM MECHANICAL ENERGY; TWO-DIMENSIONAL WAVEPACKET DYNAMICS CALCULATION;

MOLECULAR DYNAMICS;

EID: 0042042463     PISSN: 00268976     EISSN: None     Source Type: Journal    
DOI: 10.1080/0026897021000035214     Document Type: Article

References (58)

1. Sheridan, J. R., Merlo, T., and Enzweiler, J. A., 1979, J. Geophys. Res. A, 84, 7302.
2. Ferguson, E. E., Fehsenfeld, F. C., and Albritton, D. L., 1979, Gas-Phase Ion Chemistry, Vol. 1, edited by M. T. Bowers (New York: Academic Press) p. 45.
3. Smith, D., and Adams, N. G., 1980, Topics Current Chem., 89, 1.
4. Abdou, W. A., Torr, D. G., Richards, P. G., and Torr, M. R., 1982, J. Geophys. Res. A, 87, 6324.
5. Abdou, W. A., Torr, D. G., Richards, P. G., Torr, M. R., and Breig, E. L., 1984, J. Geophys. Res. A, 89, 9069.
6. Koyano, I., Tanaka, K., Kato, T., and Suzuki, S., 1987, Faraday Discuss. chem. Soc., 84, 265.
7. Schultz, R. H., and Armentrout, P. B, 1991, J. chem. Phys., 95, 121.
8. Kato, S., Frost, M. J., Bierbaum, V. M., and Leone, S. R., 1994, Can. J. Chem., 72, 625.
9. Kato, S., Bierbaum, V. M., and Leone, S. R., 1998, J. phys. Chem. A, 102, 6659.
10. Ferguson, E. E., Richter, R., and Lindinger, W., 1988, J. chem. Phys., 89, 1445.
11. McFarland, M., Albritton, D. L., Fehsenfeld, F. C., Ferguson, E. E., and Schmeltekopf, A. L., 1973, J. chem. Phys., 59, 6620.
12. Kobayashi, N., and Kaneko, Y., 1974, J. phys. Soc. Jap., 37, 1082.
13. Dobler, W., Villinger, H., Howorka, F., and Lindinger, W., 1983, Intl J. Mass Spectrosc. Ion Phys., 47, 171.
14. Lindinger, W., Fehsenfeld, F. C., Schmeltekopf, A. L., and Ferguson, E. E., 1974, J. Geophys. Res. A, 79, 4753.
15. Smith, D., Adams, N. G., and Miller, T. M., 1978, J. chem. Phys., 69, 308.
16. Alge, E., and Lindinger, W., 1981, J. Geophys. Res. A, 86, 871.
17. Kemper, P. R., and Bowers, M. T., 1984, J. chem. Phys., 81, 2634.
18. Laudenslager, J. B., Huntress Jr., W. T., and Bowers, M. T., 1974, J. chem. Phys., 61, 4600.
19. Tachibana, A., Nakamura, K., Yano, T., Sugiyama, Y., and Tanimura, S., 1999, J. phys. Chem. A, 103, 5749.
20. Lindinger, W., Albritton, D. L., McFarland, M., Fehsenfeld, F. C., Schmeltekopf, A. L., and Ferguson, E. E., 1975, J. chem. Phys., 62, 4101.
21. Schultz, R. H., and Armentrout, P. B., 1991, Chem. Phys. Lett., 179, 429.
22. Fisher, E. R., and Armentrout, P. B., 1991, Chem. Phys. Lett., 179, 435.
23. Schultz, R. H., and Armentrout, P. B., 1982, J. chem. Phys., 96, 1036.
24. Weber, M. E., Dalleska, N. F., Tjelta, B. L., Fisher, E. R., and Armentrout, P. B., 1993, J. chem. Phys., 98, 7855.
25. Kickel, B. L., Fisher, E. R., and Armentrout, P. B., 1993, J. chem. Phys., 97, 10198.
26. Freysinger, W., Kahn, F. A., Armentrout, P. B., Tosi, P., Dmitriev, O., and Bassi, D., 1994, J. chem. Phys., 101, 3688.
27. Kato, S., Frost, M. J., Bierbaum, V. M., and Leone, S. R., 1993, Rev. sci. Instrum., 64, 2808.
28. Frost, M. J., Kato, S., Bierbaum, V. M., and Leone, S. R., 1993, J. chem. Phys., 98, 5993.
29. Frost, M. J., Kato, S., Bierbaum, V. M., and Leone, S. R., 1994, J. chem. Phys., 100, 6359.
30. Kato, S., de Gouw, J. A., Lin, C.-D., Bierbaum, V. M., and Leone, S. R., 1996, Chem. Phys. Lett., 256, 305.
31. Kato, S., de Gouw, J. A., Lin, C.-D., Bierbaum, V. M., and Leone, S. R., 1996, J. chem. Phys., 105, 5455.
32. Wyttenbach, T., and Bowers, M. T., 1992, J. Phys. chem., 96, 8920.
33. Böhringer, H., Durup-Ferguson, M., Fahey, D. W., Fehsenfeld, F. C., and Ferguson, E. E., 1983, J. chem. Phys., 79, 4201.
34. Ferguson, E. E., 1986, J. phys. Chem., 90, 731.
35. Gislason, E. A., and Ferguson, E. E., 1987, J. chem. Phys., 87, 6474.
36. Speller, C. V., Fitaire, M., Pointu, A. M., 1983, J. chem. Phys., 79, 2190.
37. Fisher, E. R., and Armentrout, P. B., 1990, J. chem. Phys., 93, 4858.
38. Herschbach, D. R., 1966, Molecular Beams, edited by J. Ross (New York: Wiley) p. 319.
39. Tachibana, A., 2001, J. chem. Phys., 115, 3497.
40. Tachibana, A., 2002, Stress Induced Phenomena in Metallization, edited by S. P. Baker (New York: American Institute of Physics) p. 105.
41. Tachibana, A., 2002, Reviews in Modern Quantum Chemistry: A Celebration of the Contributions of Robert Parr, edited by K. D. Sen (Singapore: World Scientific) p. 1327.
42. Tachibana, A., 2002, Fundamental Perspectives in Quantum Chemistry: A Tribute to the memory of Per-Olov Löwdin, edited by E. Brandas and E. Kryachko (Dordrecht: Kluwer), in press.
43. Tachibana, A., 1987, Int J. Quantum Chem. Symp., 21, 181.
44. Tachibana, A., and Parr, R. G., 1992, Intl J. Quantum Chem., 41, 527.
45. Tachibana, A., 1996, Intl J. Quantum Chem., 57, 423.
46. Tachibana, A., 1999, Theoret. Chem. Accounts., 102, 188.
47. Hehre, W. J., Ditchfield, R., and Pople, J. A., 1972, J. chem. Phys., 56, 2257.
48. Hariharan, P. C., and Pople, J. A., 1973, Theoret. Chim. Acta, 28, 213.
49. Gordon, M. S., 1980, Chem. Phys. Lett., 76, 163.
50. Werner, H.-J., and Knowles, P. J., 1988, J. chem. Phys., 89, 5803.
51. Knowles, P. J., and Werner, H.-J., 1988, Chem. Phys. Lett., 145, 514.
52. Morse, P. M., 1929, Phys. Rev., 34, 57.
53. Tal-Ezer, H., and Kosloff, R., 1984, J. chem. Phys., 81, 3967.
54. Kosloff, R., 1988, J. chem. Phys., 92, 2087.
55. Tachibana, A., Yamato, M., Suzuki, T., and Yamabe, T., 1991, J. molec. Struct. Theochem., 231, 291.
56. Tachibana, A., 1999, The Transition State: A Theoretical Approach, edited by T. Fueno (Tokyo: Kodansha) p. 217.
57. Tachibana, A., and Iwai, T., 1986, Phys. Rev. A, 33, 2262.
58. Haase, G., Asscher, M., and Kosloff, R., 1989, J. chem. Phys., 91, 3346.