On the behavior of single-surface nuclear wavefunctions in the vicinity of the conical intersection for an X3 system

Chemical Physics Letters

Volumn 316, Issue 3-4, 2000, Pages 248-256

  Varandas, A J C ^a   Xu, Z R ^a  

^a UNIVERSITY OF COIMBRA   (Portugal)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000294707     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(99)01275-0     Document Type: Article

References (29)

1. A.J.C. Varandas, Z.R. Xu, in: R. Bader, L. Montero (Eds.), Topics of Current Computational Chemistry, Kluwer, Dordrecht, 1999, in press.
2. Mead C.A. J. Chem. Phys. 78:1983;807.
3. Thompson T.C., Truhlar D.G., Mead C.A. J. Chem. Phys. 82:1985;2392.
4. Thompson T.C., Mead C.A. J. Chem. Phys. 82:1985;2408.
5. Kuppermann A., Wu Y.-S.M. Chem. Phys. Lett. 241:1995;229.
6. Varandas A.J.C., Yu H.G. J. Chem. Soc. Faraday Trans. 93:1997;819.
7. Gerber W.H., Schumacher E. J. Chem. Phys. 69:1978;1692.
8. Varandas A.J.C., Yu H.G., Xu Z.R. Mol. Phys. 96:1999;1193.
9. Varandas A.J.C., Xu Z.R. Int. J. Quantum Chem. 75:1999;89.
10. Kendrick B. Phys. Rev. Lett. 79:1997;2431.
11. Herzberg G., Longuet-Higgins H.C. Faraday Discuss. Chem. Soc. 35:1963;77.
12. Berry M.V. Proc. R. Soc. A. 392:1984;45.
13. Longuet-Higgins H.C. Proc. R. Soc. London A. 344:1975;147.
14. Varandas A.J.C., Tennyson J., Murrell J.N. Chem. Phys. Lett. 61:1979;431.
15. Kendrick B., Pack R. J. Chem. Phys. 104:1996;7475.
16. Baer M., Englman R. Mol. Phys. 75:1992;293.
17. Baer M. Chem. Phys. Lett. 265:1997;105.
18. Billing G.D., Marković N. J. Chem. Phys. 99:1993;2674.
19. J.E.B. Wilson, J.C. Decius, P.C. Cross, Molecular Vibrations: the Theory of Infrared and Raman Spectra, McGraw-Hill, New York, 1955.
20. S. Califano, Vibrational States, Wiley, London, 1976.
21. Baer M. Chem. Phys. Lett. 35:1975;112.
22. Mead C.A., Truhlar D.G. J. Chem. Phys. 77:1982;6090.
23. Yarkony D.R. J. Chem. Phys. 105:1996;10456.
24. Matsunaga N., Yarkony D.R. J. Chem. Phys. 107:1997;7825.
25. Sadygov R.G., Yarkony D.R. J. Chem. Phys. 109:1998;20.
26. Longuet-Higgins H.C. Adv. Spectrosc. 2:1961;429.
27. Mead C.A., Truhlar D.G. J. Chem. Phys. 70:1979;2284.
28. Mead C.A. Chem. Phys. 49:1980;23.
29. Varandas A.J.C. Chem. Phys. Lett. 138:1987;455.