The adiabatic rotation approximation for rovibrational energies of many-mode systems: Description and tests of the method

Journal of Chemical Physics

Volumn 108, Issue 11, 1998, Pages 4397-4404

  Carter, Stuart ^a,b   Bowman, Joel M ^a  

^a EMORY UNIVERSITY   (United States)

^b UNIVERSITY OF READING   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000947511     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.475852     Document Type: Article

References (26)

1. S. Carter, J. M. Bowman, and L. B. Harding, Spectrochim. Acta A 53, 1179 (1997).
2. S. Carter, S. Culik, and J. M. Bowman, J. Chem. Phys. 107, 10458 (1997).
3. For reviews, see (a) J. M. Bowman, Acc. Chem. Res. 19, 202 (1986); (b) M. A. Ratner and R. B. Gerber, J. Phys. Chem. 90, 20 (1986).
4. For reviews, see (a) J. M. Bowman, Acc. Chem. Res. 19, 202 (1986); (b) M. A. Ratner and R. B. Gerber, J. Phys. Chem. 90, 20 (1986).
5. (a) A. Roitberg, R. B. Gerber, R. Elber, and M. A. Ratner, Science 268, 1319 (1995);
6. (b) J. O. Jung and R. B. Gerber, J. Chem. Phys. 105, 10332 (1996);
7. (c) A. Roitberg, R. B. Gerber, R. Elber, and M. A. Ratner, J. Phys. Chem. 101, 1700 (1997).
8. (a) D. Jelski, R. H. Haley, and J. M. Bowman, J. Comput. Chem. 17, 1645 (1996);
9. (b) S. C. Park, J. M. Bowman, and D. A. Jelski, J. Chem. Phys. 104, 2457 (1996).
10. S. Culik, M.S. thesis, Emory University, 1997.
11. F. Dzegilenko and J. M. Bowman (unpublished).
12. (a) D. Wang and J. M. Bowman, J. Phys. Chem. 98, 7994 (1994);
13. (b) J. M. Bowman, Chem. Phys. Lett. 217, 36 (1994);
14. (c) J. Qi and J. M. Bowman, J. Chem. Phys. 105, 9884 (1996).
15. For earlier, related semiclassical work, see, C. W. McCurdy, Jr. and W. H. Miller, State to Slate Chemistry, ACS Symposium Series No. 56, edited by P. R. Brooks and E. F. Hayes (ACS, Society, Washington, DC, 1977), p. 239.
16. H. Wang, W. H. Thompson, and W. H. Miller, J. Chem. Phys. (in press).
17. C.-Y. Yang and S. K. Gray, J. Chem. Phys. (in press).
18. F. Dzegilenko and J. M. Bowman, J. Chem. Phys. 108, 511 (1998).
19. X. T. Wu and E. F. Hayes, J. Chem. Phys. 107, 2705 (1997).
20. H. Patridge and D. W. Schwenke, J. Chem. Phys. 106, 4618 (1997).
21. J. K. G. Watson, Mol. Phys. 15, 479 (1968).
22. R. J. Whitehead and N. C. Handy, J. Mol. Spectrosc. 55, 356 (1975).
23. D. H. Zhang and J. Z. H. Zhang, J. Chem. Phys. 101, 3671 (1994).
24. A. J. C. Varandas, J. M. Bowman, and B. Gazdy, Chem. Phys. Lett. 233, 405 (1995).
25. F. Tobin and J. M. Bowman, Chem. Phys. 47, 151 (1980).
26. K. M. Christoffel and J. M. Bowman, Chem. Phys. Lett. 85, 220 (1982).