Analytic potential energy surfaces and diabatic coupling matrix elements for electronic states of the rare gas atom-halogen molecule system

Russian Journal of Physical Chemistry A

Volumn 72, Issue 1, 1998, Pages 61-67

  Buchachenko, A A ^a   Stepanov, N F ^a  

^a MOSCOW STATE UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0032351543     PISSN: 00360244     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (10)

1. Tulli, J.C., Semiempirical Methods of Electronic Structure Calculation: Part A. Techniques, Segal, G.A., Ed., New York: Plenum, 1977, ch. 6. Translated under the title Poluempiricheskie metody rascheta elektronnoi struktury, Moscow: Mir, 1980, vol. 1.
2. Buchachenko, A.A. and Stepanov, N.F., J. Chem. Phys., 1996, vol. 104, p. 9913; 1997, vol. 106, p. 4358 (Erratum).
3. Buchachenko, A.A. and Stepanov, N.F., J. Chem. Phys., 1996, vol. 104, p. 9913; 1997, vol. 106, p. 4358 (Erratum).
4. Buchachenko, A.A. and Stepanov, N.F., Chem. Phys. Lett., 1996, vol. 261, p. 591.
5. Grigorenko, A.A., Nemukhin, A.V., Buchachenko, A.A., Stepanov, N.F., and Umanskii, S.Ya., J. Chem. Phys., 1997, vol. 106, p. 4575.
6. Batista, V.S. and Coker, D.F., J. Chem. Phys., 1996, vol. 105, p. 4033.
7. Reznikov, A.I. and Umanskii, S.Ya., Khim. Fiz., 1990, vol. 9, p. 1299.
8. Zhao, Y., Yourshaw, T., Reiser, G., Arnold, C.C., and Neumark, D.M., J. Chem. Phys., 1994, vol. 101, p. 6538.
9. Clyne, M.A.A. and McDermid, I.S., Dynamics of the Excited State, Lawley, K.P., Ed., New York: Wiley, 1982.
10. Roncero, O., Halberstadt, N., and Beswick, J.A., J. Chem. Phys., 1996, vol. 104, p. 7554.