An ab initio molecular orbital study of even-membered hydrogen cluster cations: H6+,H8+,H10 +,H12+, and H14+

Journal of Chemical Physics

Volumn 109, Issue 11, 1998, Pages 4327-4334

  Kurosaki, Yuzuru ^a   Takayanagi, Toshiyuki ^a  

^a JAPAN ATOMIC ENERGY AGENCY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 8344242496     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.477035     Document Type: Article

References (30)

1. J. J. Thomson, Philos. Mag. 24, 209 (1912).
2. T. Oka, in Molecular Ions: Spectroscopy, Structure, and Chemistry, edited by T. A. Miller and V. E. Bondeybey (North-Holland, Amsterdam, 1983).
3. P. H. Dawson and A. W. Tickner, J. Chem. Phys. 37, 672 (1962).
4. K. Buchheit and W. Henkes, Z. Angew. Phys. 24, 191 (1968).
5. R. Clampit and L. Gowland, Nature (London) 223, 816 (1969).
6. C. E. Dykstra, A. S. Gaylord, W. D. Gwinn, W. C. Swope, and H. F. Schaefer III, J. Chem. Phys. 68, 3951 (1978).
7. Y. Yamaguchi, J. F. Gaw, R. B. Remington, and H. F. Schaefer III, J. Chem. Phys. 86, 5072 (1987).
8. Y. Yamaguchi, J. F. Gaw, and H. F. Schaefer III, J. Chem. Phys. 78, 4074 (1983).
9. L. R. Wright and R. F. Borkman, J. Chem. Phys. 77, 1938 (1982).
10. M. Farizon, B. Farizon-Mazuy, N. V. de Castro Faria, and H. Chermette, Chem. Phys. Lett. 177, 451 (1991).
11. S. Raynor and D. H. Herschbach, J. Phys. Chem. 87, 289 (1983).
12. S. Yamabe, K. Hirao, and K. Kitaura, Chem. Phys. Lett. 56, 546 (1978).
13. K. Hirao and S. Yamabe, Chem. Phys. 80, 237 (1983).
14. H. Huber, J. Mol. Struct.: THEOCHEM 121, 281 (1985).
15. M. Farizon, H. Chermette, and B. Farizon-Mazuy, J. Chem. Phys. 96, 1325 (1992).
16. M. Okumura, L. I. Yeh, and Y. T. Lee, J. Chem. Phys. 88, 79 (1988).
17. N. J. Kirchner, J. R. Gilbert, and M. T. Bowers, Chem. Phys. Lett. 106, 7 (1984).
18. N. J. Kirchner and M. T. Bowers, J. Phys. Chem. 86, 1301 (1987).
19. J. A. Montgomery, Jr. and H. H. Michels, J. Chem. Phys. 87, 771 (1987).
20. Y. Kurosaki and T. Takayanagi, Chem. Phys. Lett. (in press).
21. GAUSSIAN 94, Revision D. 3, 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. Zakrzewski, J. V. Ortiz, J. B. Foresman, J. Cioslowski, B. B. Stefanov, A. Nanayakkara, M. Challacombe, C. Y. Peng, P. Y. Ayala, W. Chen, M. W. Wong, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. Defrees, J. Baker, J. P. Stewart, M. Head-Gordon, C. Gonzalez, and J. A. Pople, Gaussian, Inc., Pittsburgh, PA, 1995.
22. H. B. Schlegel, J. Comput. Chem. 3, 214 (1982).
23. M. Head-Gordon, J. A. Pople, and M. J. Frisch, Chem. Phys. Lett. 153, 503 (1988).
24. M. J. Frisch, M. Head-Gordon, and J. A. Pople, Chem. Phys. Lett. 166, 275 (1990).
25. M. J. Frisch, M. Head-Gordon, and J. A. Pople, Chem. Phys. Lett. 166, 281 (1990).
26. T. H. Dunning, J. Chem. Phys. 90, 1007 (1989).
27. M. Head-Gordon and T. Head-Gordon, Chem. Phys. Lett. 220, 122 (1994).
28. R. Krishnan and J. A. Pople, Int. J. Quantum Chem. 14, 91 (1978).
29. R. Krishnan, M. J. Frisch, and J. A. Pople, J. Chem. Phys. 72, 4244 (1980).
30. H. B. Schlegel, J. Chem. Phys. 84, 4530 (1986).