Calculations of the F + HD reaction on three potential energy surfaces

Physical Chemistry Chemical Physics

Volumn 5, Issue 10, 2003, Pages 2034-2038

  Xie, Ting Xian ^a   Zhang, Yan ^a   Zhao, Mei Yu ^a   Han, Ke Li ^a  

^a DALIAN INSTITUTE OF CHEMICAL PHYSICS   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; CALCULATION; CHEMICAL REACTION; ELECTRONICS; ENERGY; GEOMETRY; MOLECULAR DYNAMICS; QUANTUM MECHANICS; REACTION ANALYSIS;

EID: 0038290543     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/b300763d     Document Type: Article

References (27)

1. F. J. Aoiz, L. Banares, V. J. Herrero, V. Saez,Rabanos, K. Stark and H.-J. Werner, J. Chem. Phys., 1995, 102, 9248-9262.
2. V. Aquilanti, S. Cavalli, D. D. Fazio, A. Volpi, A. Aguilar, X. Gimenez and J. M. Lucas, J. Chem. Phys., 1998, 109, 3805-3818.
3. M. H. Alexander, D. E. Manolopoulos and H.-J. Werner, J. Chem. Phys., 2000, 113, 11 084-11 100.
4. V. Aquilanti, S. Cavalli, D. D. Fazio, A. Volpi, A. Aguilar, X. Gimenez and J. M. Lucas, Phys. Chem. Chem. Phys., 1999, 1, 1091-1098.
5. K. Stark and H.-J. Werner, J. Chem. Phys., 1996, 104, 6515-6530.
6. V. Aquilanti, S. Cavalli, F. Pirani, A. Volpi and D. Cappeletti, J. Phys. Chem. A, 2001, 105, 2401-2409.
7. V. Aquilanti, S. Cavalli, D. D. Fazio, A. Volpi, A. Aguilar, X. Gimenez and J. M. Lucas, Phys. Chem. Chem Phys., 2002, 4, 401-415.
8. D. M. Neumark, A. M. Wodtke, G. N. Robinson, C. C. Hayden and Y. T. Lee, J. Chem. Phys., 1985, 82, 3045-3066.
9. F. J. Aoiz, L. Banares, V. J. Herrero, V. S. Rabanos, K. Stark, I. Tanarro and H.-J. Werner, Chem. Phys. Lett., 1996, 262, 175-182.
10. K. L. Kompa, J. H. Parker and G. C. Pimentel, J. Chem. Phys., 1968, 49, 4257-4268.
11. A. Persky, J. Chem. Phys., 1973, 59, 5578-5584.
12. M. J. Berry, J. Chem. Phys., 1973, 59, 6229-6253.
13. G. W. Johnston, H. Kornweitz, I. Schechter, A. Persky, B. Katz, R. Bersohn and R. D. Levine, J. Chem. Phys., 1991, 94, 2749-2757.
14. G. Dharmasena, K. Copeland, J. H. Young, R. A. Lasell, T. R. Philips, K. Shokhirev, G. A. Parker and M. Keil, J. Phys. Chem. A, 1997, 101, 6429-6440.
15. R. Krems and A. Dalgamo, J. Chem. Phys., 2002, 117, 118-123.
16. W. W. Harper, S. A. Nizkorodov and D. J. Nesbitt, J. Chem. Phys., 2002, 116, 5622-5632.
17. D. H. Zhang, S.-Y. Lee and M. Baer, J. Chem. Phys., 2000, 112, 9802-9809.
18. R. T. Skodje, D. Skouteris, D. E. Manolopoulos, S.-H. Lee, F. Dong and K. Liu, J. Chem. Phys, 2000, 112, 4536-4552.
19. R. T. Skodie, D. Skouteris, D. E. Manolopoulos, S.-H. Lee, F. Dong and K. Liu, Phys. Rev. Lett., 2000, 85, 1206-1209.
20. F. Dong, S.-H. Lee and K. Liu, J. Chem. Phys., 2000, 113, 3633-3640.
21. S.-H. Lee, F. Dong and K. Liu, J. Chem. Phys., 2002, 116, 7839-7848.
22. J. F. Castillo and D. E. Manolopoulos, Faraday Discuss., 1998, 110, 119-138.
23. M. Baer, Chem. Phys. Lett., 1999, 312, 203-210.
24. D. H. Zhang and J. Z. H. Zhang, J. Chem. Phys., 1994, 101, 3671-3678.
25. R. T. Pack, J. Chem. Phys., 1974, 60, 633-639.
26. J. A. Fleck, Jr., J. R. Morris and M. D. Feit, Appl. Phys., 1976, 10, 129-160.
27. J. F. Castillo, D. E. Manolopoulos, K. Stark and H.-J. Werner, J. Chem. Phys., 1996, 104, 6531-6546.