Computational studies of the geometric and electronic structures of BF3+, AlF3+, CF32+ and SiF32+

Chemical Physics Letters

Volumn 313, Issue 3-4, 1999, Pages 679-684

  Kaltsoyannis, Nikolas ^a   Price, Stephen D ^a  

^a UNIVERSITY COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001390191     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(99)01138-0     Document Type: Article

References (22)

1. L.H. Jones, Inorganic Vibrational Spectroscopy, Marcel Dekker, New York, 1971.
2. Haller E., Köppel H., Cederbaum L.S., von Niessen W., Bieri G. J. Chem. Phys. 78:1983;1359.
3. Jacox M.E., Thompson W.E. J. Chem. Phys. 102:1995;4747.
4. Lee Y.-Y., Leone S.R., Champkin P.H., Kaltsoyannis N., Price S.D. J. Chem. Phys. 106:1997;7981.
5. Champkin P.H., Kaltsoyannis N., Price S.D. Int. J. Mass Spectrom. Ion Processes. 172:1998;57.
6. Tafadar N., Kaltsoyannis N., Price S.D. Int. J. Mass Spectrom. Ion Processes. 192:1999;205.
7. Hrusak J., Sändig N., Koch W. Int. J. Mass Spectrom. Ion Processes. 187:1999;701.
8. M.J. Frisch et al., Gaussian 98, Revision A3, Gaussian, Inc., Pittsburgh, 1998.
9. Krishnan R., Binkley J.S., Seeger R., Pople J.A. J. Chem. Phys. 72:1980;650.
10. Kendall R.A., Dunning T.H. Jr., Harrison R.J.R.J. J. Chem. Phys. 96:1992;6796.
11. Becke A.D. J. Chem. Phys. 98:1993;1372.
12. Lee C., Yang W., Parr R.G. Phys. Rev. B. 37:1988;785.
13. P.W. Atkins, R.S. Friedman, Molecular Quantum Mechanics, 3rd edn., Oxford University Press, Oxford, 1997.
14. A. Szabo, N.S. Ostlund, Modern Quantum Chemistry, McGraw-Hill, New York, 1989.
15. Mulliken R.S. J. Chem. Phys. 23:1955;1833.
16. R.F.W. Bader, Atoms in Molecules: A Quantum Theory, OUP, Oxford, 1990.
17. Koopmans T. Physica. 1:1934;104.
18. A. Frisch, M.J. Frisch, Gaussian 98 User's Reference, Gaussian, Inc., Pittsburgh, PA, 1998.
19. T.L. Cottrell, The Strengths of Chemical Bonds, 2nd edn., Butterworths, London, 1958.
20. Knowles P.J., Werner H.-J. Chem. Phys. Lett. 115:1985;259.
21. Werner H.-J., Knowles P.J. J. Chem. Phys. 82:1985;5053.
22. P.H. Champkin, N. Kaltsoyannis, S.D. Price, Int. J. Mass Spectrom. Ion Processes, 1999, in press.