Extended Born-Oppenheimer equation for a three-state system

Journal of Chemical Physics

Volumn 124, Issue 7, 2006, Pages

  Sarkar, Biplab ^a   Adhikari, Satrajit ^a  

^a INDIAN INSTITUTE OF TECHNOLOGY GUWAHATI   (India)

Author keywords

[No Author keywords available]

Indexed keywords

MATRIX ALGEBRA; PROBABILITY;

ADIABATIC-DIABATIC TRANSFORMATION (ADT) ANGLES; EXTENDED BORN-OPPENHEIMER (EBO) EQUATION; NONADIABATIC COUPLING (NAC) ELEMENTS;

QUANTUM THEORY;

EID: 33244481968     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2170089     Document Type: Article

References (30)

1. G. Herzberg and H. C. Longuet-Higgins, Discuss. Faraday Soc. 35, 77 (1963).
2. M. Born and J. R. Oppenheimer, Ann. Phys. (Leipzig) 84, 457 (1927).
3. C. A. Mead and D. G. Truhlar, J. Chem. Phys. 70, 2284 (1979).
4. A. Kuppermann and Y.-S. M. Wu, Chem. Phys. Lett. 205, 577 (1993).
5. M. Baer, in Theory of Chemical Reaction Dynamics, edited by, M. Baer, (CRC, Boca Raton, FL, 1985), Vol. II, Chap..
6. M. Baer and R. Englman, Chem. Phys. Lett. 265, 105 (1997).
7. M. Baer, J. Chem. Phys. 107, 10662 (1997).
8. R. Baer, D. M. Charutz, R. Kosloff, and M. Baer, J. Chem. Phys. 105, 9141 (1996).
9. S. Adhikari and G. D. Billing, J. Chem. Phys. 111, 40 (1999).
10. A. J. C. Varandas and Z. R. Xu, J. Chem. Phys. 112, 2121 (2000).
11. M. Baer, Chem. Phys. Lett. 35, 112 (1975).
12. M. Baer, S. H. Lin, A. Alijah, S. Adhikari, and G. D. Billing, Phys. Rev. A 62, 32506 (2000).
13. S. Adhikari, G. D. Billing, A. Alijah, S. H. Lin, and M. Baer, Phys. Rev. A 62, 32507 (2000).
14. Z. H. Top and M. Baer, J. Chem. Phys. 66, 1363 (1977).
15. A. Alijah and M. Baer, J. Phys. Chem. A 104, 389 (2000).
16. D. J. Griffiths, Introduction to Electrodynamics (Prentice-Hall, Englewood Cliffs, NJ, 1989), Chap..
17. G. B. Arfken and H. J. Weber, Mathematical Methods for Physicists (Academic, San Diego, 1995), Chap..
18. T. V́rtesi, Á. Vibók, G. J. Halász, and M. Baer, J. Chem. Phys. 121, 4000 (2004).
19. D. R. Yarkony, J. Chem. Phys. 84, 3206 (1986).
20. A. M. Mebel, M. Baer, and S. H. Lin, J. Chem. Phys. 112, 10703 (2000).
21. A. M. Mebel, A. Yahalom, R. Englman, and M. Baer, J. Chem. Phys. 115, 3673 (2001).
22. A. M. Mebel, G. J. Halász, A. Vibók, A. Alijah, and M. Baer, J. Chem. Phys. 117, 991 (2002).
23. M. Baer, A. Alijah, and G. D. Billing, Int. J. Quantum Chem. 90, 1577 (2002).
24. G. D. Billing, M. Baer, and A. M. Mebel, Chem. Phys. Lett. 372, 1 (2003).
25. M. Baer, T. V́rtesi, G. J. Halász, Á. Vibók, and S. Suhai, Faraday Discuss. 127, 337 (2004).
26. P. Puzari, B. Sarkar, and S. Adhikari, J. Chem. Phys. 121, 707 (2004).
27. M. Baer, J. Phys. Chem. A 104, 3181 (2000).
28. See, for example, Figs. 1-5, Á. Vibók, G. J. Halász, and M. Baer, Chem. Phys. Lett. 399, 7 (2004).
29. R. Abrol and A. Kuppermann, J. Chem. Phys. 116, 1035 (2002).
30. M. Baer, T. V́rtesi, G. J. Halász, and Á. Vibók, J. Phys. Chem. A 108, 9134 (2004).