A direct DFT dynamics study of the photodissociation of triplet acetaldehyde

Chemical Physics Letters

Volumn 375, Issue 5-6, 2003, Pages 591-597

  Cordeiro, M Natália D S ^a   Martínez Núñez, Emilio ^a   Fernández Ramos, Antonio ^a   Vázquez, Saulo A ^a  

^a UNIVERSITY OF SANTIAGO DE COMPOSTELA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 26544434346     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(03)00919-9     Document Type: Article

References (32)

1. Findlayson-Pitts B.J. Pitts J.N.Jr. Atmosphere Chemistry: Fundamentals and Experimental Techniques 1986 Wiley New York
2. Kato H. Baba M. Chem. Rev. 95 1995 2311
3. Fall R. Reactive Hydrocarbons in the Atmosphere 1999 Academic Press San Diego
4. Horowitz A. Calvert J.G. J. Phys. Chem. 86 1982 3105
5. Noble M. Lee E.K.C. J. Chem. Phys. 80 1984 134
6. Baba M. Nagashima U. Hanazaki I. J. Chem. Phys. 83 1985 3514
7. Otha N. Baba H. J. Phys. Chem. 90 1986 2654
8. Kono T. Takayanagi M. Hanazaki I. J. Phys. Chem. 97 1993 12793
9. Gejo T. Takayanagi M. Kono T. Hanazaki I. Chem. Phys. Lett. 218 1994 343
10. Terentis A.C. Stone M. Kable S.H. J. Phys. Chem. 98 1994 10802
11. Liu H. Lim E.C. Muñoz-Caro C. Niño A. Judge R.H. Moule D.C. J. Chem. Phys. 105 1996 2547
12. Lee S.-H. Chen I.-C. J. Chem. Phys. 105 1996 4597
13. Leu G.-H. Huang C.-L. Lee S.-H. Lee Y.-C. Chen I.-C. J. Chem. Phys. 109 1998 9340
14. Leu C.-L. Chien V. Ni C.-K. Kung A.H. Chen I.-C. J. Phys. Chem. A 104 2000 10362
15. Gherman B.F. Friesner R.A. Wong T.-H. Min Z. Bersohn R. J. Chem. Phys. 114 2001 6128
16. Metha G.F. Terentis A.C. Kable S.H. J. Phys. Chem. A 106 2002 5817
17. Yadav J.S. Goddard J.D. J. Chem. Phys. 84 1986 2682
18. Smith B.J. Nguyen M.T. Bouma W.J. Radom L. J. Am. Chem. Soc. 113 1991 6452
19. Martell J.M. Yu H. Goddard J.D. Mol. Phys. 92 1997 497
20. Setokuchi O. Matsuzawa S. Shimizu Y. Chem. Phys. Lett. 284 1998 19
21. King R.A. Allen W.D. Schaefer III H.F. J. Chem. Phys. 112 2000 5585
22. Kurosaki Y. Yokoyama K. J. Phys. Chem. A 106 2002 11415
23. Martínez-Nuñez E. Vázquez S.A. Varandas A.J.C. Phys. Chem. Chem. Phys. 4 2002 279
24. Kurosaki Y. Yokoyama K. Chem. Phys. Lett. 371 2003 568
25. Gonzalez C. Schlegel H.B. J. Phys. Chem. 94 1990 5523
26. Boys S.F. Bernardi F. Mol. Phys. 19 1970 553
27. Frisch M.J. et-al Gaussian 98, Revision A.11 1998 Gaussian Inc. Pittsburgh, PA
28. Bolton K. Hase W.L. Peslherbe G.H. Modern Methods for Multidimensional Dynamics Computation in Chemistry 1998 World Scientific Singapore
29. Bakken V. Millam J.M. Schlegel H.B. J. Chem. Phys. 111 1999 8773
30. Data from NIST Standard Reference Database 69, March 2003. Release: NIST Chemistry Web Book
31. Okabe H. Photochemistry of Small Molecules 1978 Wiley New York
32. Moon J.E. Park S.T. Kim M.S. J. Chem. Phys. 110 1999 972