Photodissociation of carbonyl cyanide CO(CN)2. An ab initio calculation study

Chemical Physics Letters

Volumn 311, Issue 6, 1999, Pages 474-478

  Suter, H U ^a   Huber, J R ^a   Ha, T K ^b  

^a UNIVERSITY OF ZURICH   (Switzerland)

^b ETH ZURICH   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0010719424     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(99)00869-6     Document Type: Article

References (21)

1. Moore C.B., Weisshaar J.C. Annu. Rev. Phys. Chem. 34:1983;525.
2. Clark J.H., Moore C.B., Nogar N.S. J. Chem. Phys. 68:1978;1264.
3. Goddard J.D., Yamaguchi Y., Schaefer H.F. III J. Chem. Phys. 75:1981;3459.
4. Polik W.F., Guyer D.R., Moore C.B. J. Chem. Phys. 92:1990;3453.
5. Furlan A., Scheld H.A., Huber J.R. Chem. Phys. Lett. 282:1998;1.
6. Scheld H.A., Furlan A., Huber J.R. J. Chem. Phys. 111:1999;923.
7. R. Pfister, J.R. Huber, unpublished.
8. Okada K., Saito K. J. Phys. Chem. 99:1995;13168.
9. Sumathi R., Nguyen M.T. J. Phys. Chem. A. 102:1998;412.
10. Horwitz R.J., Francisco J.S., Guest J.A. J. Phys. Chem. A. 101:1997;1231.
11. So S.P. Chem. Phys. Lett. 270:1997;363.
12. M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zerkowski, J.V. Ortiz, J.B. Foresman, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Binkley, D.J. Defrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzales and J.A. Pople, GAUSSIAN 94, Revision B.3, Gaussian, Inc., Pittsburgh, PA, 1995.
13. Krishnan R., Binkley J.S., Seeger R., Pople J.A. J. Chem. Phys. 72:1980;650.
14. Roos B.O., Andersson K., Fülscher M.P., Malqmvist P.-A., Serrano-Andres L., Pierloot K., Merchan M. Adv. Chem. Phys. 93:1996;219. and references therein.
15. K. Andersson, M.P. Fülscher, G. Karlstrom, R. Lindh, P.-A. Malmqvist, J. Olsen, B.O. Roos, A.J. Sadlej, M.R.A. Blomberg, P.E.M. Siegbahn, V. Kellö, J. Noga, M. Urban, P.-O. Widmark, MOLCAS Version 3, Dep. Theor. Chem., Chem. Cent., Univ. of Lund, POB 124, S-221 00 Lund, Sweden.
16. Widmark P.-O., Malmqvist P.-A., Roos B.O. Theor. Chim. Acta. 77:1990;291.
17. Ochterski J.W., Petersson G.A., Montgomery J.A. J. Chem. Phys. 104:1996;2598.
18. Lees R.M. Can. J. Phys. 49:1971;367.
19. Chang N., Yu C. Chem. Phys. Lett. 242:1995;232.
20. Fang W.H., Liu R.Z., You X.Z. Chem. Phys. Lett. 226:1994;453.
21. Sengupta D., Peeters J., Nguyen M.T. Chem. Phys. Lett. 283:1998;91.