Quantum scattering calculation for Br + H2 reaction on a new ab initio potential energy surface

Chemical Physics Letters

Volumn 437, Issue 4-6, 2007, Pages 165-169

  Quan, Wei Long ^a,b   Song, Qing ^a   Tang, Bi Yu ^b  

^a LANZHOU JIAOTONG UNIVERSITY   (China)

^b XIANGTAN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANISOTROPY; CHEMICAL REACTIONS; HYDROGEN; POTENTIAL ENERGY SURFACES; WAVE PACKETS;

QUANTUM SCATTERING; VIBRATIONAL EXCITATIONS;

BROMINE;

EID: 33947274129     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2007.02.023     Document Type: Article

References (25)

1. Eyring H., and Polanyi M. Z. Phys. Chem. B12 (1931) 279
2. Sims L.B., Dosser L.R., and Wilson P.S. Chem. Phys. Lett. 32 (1975) 150
3. Hepburn J.W., Klimek D., Liu K., Macdonald R.G., Northrup F.J., and Polanyi J.C. J. Chem. Phys. 74 (1981) 6226
4. Jourdain J.L., Bras G.L., and Combourieu J. Chem. Phys. Lett. 78 (1981) 483
5. Orel A.E., Ali D.P., and Miller W.H. Chem. Phys. Lett. 79 (1981) 137
6. Umemoto H., Wada Y., Tsunashima S., Takayanagi T., and Sato S. Chem. Phys. 143 (1990) 333
7. Lynch G.C., Truhlar D.G., Brown F.B., and Zhao J.-G. J. Phys. Chem. 99 (1995) 207
8. Mielke S.L., Tawa G.J., Truhlar D.G., and Schwenke D.W. Chem. Phys. Lett. 234 (1995) 57
9. Mitchell T.J., Gonzalez A.C., and Benson S.W. J. Phys. Chem. 99 (1995) 16960
10. Takayanagi T., and Kurosaki Y. J. Chem. Phys. 113 (2000) 7158
11. Kurosaki Y., and Takayanagi T. J. Chem. Phys. 119 (2003) 7838
12. Kurosaki Y., and Takayanagi T. Chem. Phys. Lett. 406 (2005) 121
13. Quan W.L., Tang P.Y., and Tang B.Y. Intel. J. Quant. Chem. 107 (2007) 657
14. Y. Kurosaki, private communication.
15. Neuhauser D., and Baer M. J. Chem. Phys. 90 (1989) 4351
16. Neuhauser D., and Baer M. J. Chem. Phys. 91 (1989) 4651
17. Baer M., Neuhauser D., and Oreg Y. J. Chem. Soc., Faraday Trans. 86 (1990) 1721
18. Zhang D.H., and Zhang J.Z.H. J. Chem. Phys. 101 (1994) 1146
19. Zhang D.H., and Zhang J.Z.H. J. Chem. Phys. 101 (1994) 3671
20. Dai J., and Zhang J.Z.H. J. Phys. Chem. 100 (1996) 6898
21. Chu T.S., Zhang Y., and Han K.L. Int. Rev. Phys. Chem. 25 (2006) 201
22. Yao L., Ju L.P., Chu T.S., and Han K.L. Phys. Rev. A. 74 (2006) 062715
23. Fleck Jr. J.A., Morris J.R., and Feit M.D. Appl. Phys. 10 (1976) 129
24. Aoiz F.J., Bañares L., and Castillo J.F. J. Chem. Phys. 111 (1999) 4013
25. Polanyi J.C., and Wong W.H. J. Chem. Phys. 51 (1969) 1439