O H3- and O2 H5- double Rydberg anions: Predictions and comparisons with N H4- and N2 H7-

Journal of Chemical Physics

Volumn 127, Issue 1, 2007, Pages

  Melin, Junia ^a   Ortiz, J V ^a  

^a AUBURN UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEXATION; ELECTRONS; PHOTOELECTRON SPECTROSCOPY; WATER;

RYDBERG ANIONS; VERTICAL ELECTRON DETACHMENT ENERGIES (VEDE);

NEGATIVE IONS;

EID: 34547850709     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2741558     Document Type: Article

References (32)

1. J. T. Snodgrass, J. V. Coe, C. B. Freidhoff, K. M. McHugh, and K. H. Bowen, Faraday Discuss. Chem. Soc. 86, 241 (1988).
2. J. Simons and M. Gutowski, Chem. Rev. (Washington, D.C.) 91, 669 (1991).
3. H. Hopper, M. Lococo, O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz, J. Am. Chem. Soc. 122, 12813 (2000).
4. J. Melin, G. Seabra, and J. V. Ortiz, in Theoretical Aspects of Chemical Reactivity, edited by, A. Toro-Labb́, (Elsevier, Amsterdam, 2007), pp. 87.
5. J. T. Snodgrass, Ph.D. dissertation, Johns Hopkins University, 1986.
6. J. V. Coe, Ph.D. dissertation, Johns Hopkins University, 1986.
7. H. Cardy, C. Larrieu, and A. Dargelos, Chem. Phys. Lett. 131, 507 (1986).
8. D. Cremer and E. Kraka, J. Phys. Chem. 90, 33 (1986).
9. J. V. Coe, J. T. Snodgrass, C. B. Freidhoff, K. M. McHugh, and K. H. Bowen, J. Chem. Phys. 83, 3169 (1985).
10. J. V. Ortiz, J. Chem. Phys. 87, 3557 (1987).
11. M. Gutowski, J. Simons, R. Hernandez, and H. L. Taylor, J. Phys. Chem. 92, 6179 (1988).
12. M. Gutowski and J. Simons, J. Chem. Phys. 93, 3874 (1990).
13. J. V. Ortiz, J. Phys. Chem. 94, 4762 (1990).
14. S. J. Xu, J. M. Niles, J. H. Hendricks, S. A. Lyapustina, and K. H. Bowen, J. Chem. Phys. 0021-9606 10.1063/1.1499491 117, 5742 (2002); D. Radisic, S. T. Stokes, and K. H. Bowen, J. Chem. Phys. 123, 11101 (2005).
15. S. J. Xu, J. M. Niles, J. H. Hendricks, S. A. Lyapustina, and K. H. Bowen, J. Chem. Phys. 0021-9606 10.1063/1.1499491 117, 5742 (2002); D. Radisic, S. T. Stokes, and K. H. Bowen, J. Chem. Phys. 123, 11101 (2005).
16. J. V. Ortiz, J. Chem. Phys. 117, 5748 (2002).
17. J. V. Ortiz, Adv. Quantum Chem. 33, 35 (1999).
18. J. V. Ortiz, J. Chem. Phys. 91, 7024 (1989).
19. N. Matsunaga and M. S. Gordon, J. Phys. Chem. 99, 12773 (1995).
20. G. Trinquier, J. P. Daudey, G. Caruana, and Y. Madaule, J. Am. Chem. Soc. 106, 4794 (1984).
21. J. Moc and K. Morokuma, Inorg. Chem. 33, 551 (1994).
22. J. A. Pople, M. Head-Gordon, and K. Ragavachari, J. Chem. Phys. 87, 5968 (1987).
23. R. Krishnan, J. S. Binkley, R. Seeger, and J. A. Pople, J. Chem. Phys. 0021-9606 10.1063/1.438955 72, 650 (1980); M. J. Frisch, J. A. Pople, and J. S. Binkley, J. Chem. Phys. 80, 3265 (1984).
24. R. Krishnan, J. S. Binkley, R. Seeger, and J. A. Pople, J. Chem. Phys. 0021-9606 10.1063/1.438955 72, 650 (1980); M. J. Frisch, J. A. Pople, and J. S. Binkley, J. Chem. Phys. 80, 3265 (1984).
25. K. Fukui, Acc. Chem. Res. 0001-4842 10.1021/ar00072a001 14, 363 (1981); C. Gonzalez and H. B. Schlegel, J. Chem. Phys. 90, 2154 (1989).
26. K. Fukui, Acc. Chem. Res. 0001-4842 10.1021/ar00072a001 14, 363 (1981); C. Gonzalez and H. B. Schlegel, J. Chem. Phys. 90, 2154 (1989).
27. J. V. Ortiz, in Computational Chemistry: Reviews of Current Trends, edited by, J. Leszczynski, (World Scientific, Singapore, 1997), Vol. 2.
28. M. J. Frisch, G. W. Trucks, H. B. Schlegel, et al., GAUSSIAN 03 (Gaussian, Inc., Pittsburgh PA, 2003).
29. J. V. Ortiz, J. Chem. Phys. 109, 5741 (1998).
30. A. D. Becke and K. E. Edgecombe, J. Chem. Phys. 92, 5397 (1990).
31. S. Noury, X. Krokisdis, F. Fuster, and B. Silvi, Comput. Chem. (Oxford) 23, 597 (1999).
32. B. Hibbard, J. Kellum, and B. Paul, VIS 5D, version 5.2, Visualization Project, University of Wisconsin-Madison Space Science and Engineering Center, 1990.