The electronic structure of the H2CO+ radical and higher Rydberg states of H2CO

Molecular Physics

Volumn 94, Issue 6, 1998, Pages 917-928

  Pablo, Pablo J ^a   Bruna Michel, Michel R J ^a   Grein, Friedrich ^a  

^a UNIVERSITY OF NEW BRUNSWICK   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000857517     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/002689798167494     Document Type: Article

References (45)

1. Baker, A. D., Baker, C., Brundle, C. R., and Turner, D. W., 1968. Int. J. Mass Spectrum. Ion Phys., 1:285
2. Turner, D. W., Baker, A. D., and Brundle, C. R., 1970. Molecular Photoelectron Spectroscopy, New York:Wiley.
3. Von Niessen, W., Bieri, G., and Åsbrink, L., 1980. J. Electron Spectrosc. related Phenom., 21:175
4. Keller, P. R., Taylor, J. W., Grimm, F. A., and Carlson, T. A., 1984. Chem. Phys., 90:147
5. Carlsson-Göthe, M., and Karlsson, L., 1990. report UUIP-1234, Uppsala University Institute of Physics.
6. Niu, B., Shirley, D. A., and Bai, Y., 1993. J. chem. Phys., 98:4377 Niu, B., Shirley, D. A., Bai, Y., and Daymo, E., 1993, Chem. Phys. Lett., 201, 212
7. Holland, D. M. P., Hayes, M. A., MacDonald, M. A., and McSweeney, S. M., 1994. J. Phys. B, 27:1125
8. Guyon, P. M., Chupka, W. A., and Berkowitz, J., 1976. J. chem. Phys., 64:1419
9. Hood, S. T., Hamnett, A., and Brion, C. E., 1976. Chem. Phys. Lett., 41:428
10. Bawagan, A. O., Brion, C. E., Davidson, E. R., Boyle, C., and Frey, R. F., 1988. Chem. Phys., 128:439
11. Ohno, K., Takano, S., and Mase, K., 1986. J. phys. Chem., 90:2015
12. Wiedmann, R. T., White, M. G., Wang, K., and McKoy, B., 1994. J. chem. Phys., 100:4738
13. Knight, L. B., and Steadman, J., 1984. J. chem. Phys., 80:1018
14. Cederbaum, L. S., Hohlneicher, G., and von Niessen, W., 1973. Molec. Phys., 26:1405 Cederbaum, L. S., Domcke, W., and von Niessen, W., 1975, Chem. Phys. Lett., 34, 60
15. Domcke, W., and Cederbaum, L. S., 1976. J. chem. Phys., 64:612
16. Nakatsuji, H., Ohta, K., and Hirao, K., 1981. J. chem. Phys., 75:2952
17. Cesar, A., Ågren, H., Helgaker, T., Jørgensen, P., and Jensen, H. J. A., 1991. J. chem. Phys., 95:5906
18. Vaz Pires, M., Galloy, C., and Lorquet, J. C., 1978. J. chem. Phys., 69:3242
19. Takeshita, K., 1991. J. chem. Phys., 94:7259
20. Feller, D., and Davidson, E. R., 1984. J. chem. Phys., 80:1006
21. Feller, D., and Davidson, E. R., 1985. Theoret. chim. Acta, 68:57
22. Suter, H. U., and Engels, B., 1994. J. chem. Phys., 100:2936
23. Kuo, S.-C., Zhang, Z., Ross, S. K., Klemm, R. B., Johnson, R. D., Monks, P. S., Thorn, R. P., and Stief, L. J., 1997. J. phys. Chem. A, 101:4035
24. Botschwina, P., and Schmatz, S., 1996. The Structure, Energetics and Dynamics of Organic Ions, Edited by:Baer, T., Ng, C. Y., and Powis, I., 1New York:Wiley.
25. Suter, H. U., Pless, V., Ernzerhof, M., and Engels, B., 1994. Chem. Phys. Lett., 230:398
26. Bruna, P. J., Lushington, G. H., and Grein, F., unpublished
27. Frisch, M. J., Head-Gordon, M., Trucks, G. W., Foresman, J. B., Schlegel, H. B., Raghavachari, H., Robb, M. A., Binkley, J. S., Gonzalez, C., DeFrees, D. F., Fox, D. F., Whiteside, R. A., Seeger, R., Melius, C. F., Baker, J., Martin, R. L., Kahn, L. R., Stewart, J. P., Topiol, S., and Pople, J. A., 1990. Gaussian 90, Pittsburgh, PA:Gaussian Inc.
28. Krishnan, R., Binkley, J. S., Seeger, R., and Pople, J. A., 1980. J. chem. Phys., 72:650 Clark, T., Chandrasekhar, J., Spitznagel, G. W., and Schleyer, P. V. R., 1093, J. comput. chem., 4, 294; Frisch, M. J., Pople, J. A., and Binkley, J. S., 1984, J. chem. Phys., 80, 3265
29. Buenker, R. J., Peyerimhoff, S. D., and Butscher, W., 1978. Molec. Phys., 35:771 Knowles, D. B., Álvarez-Collado, J. R., Hirsch, G., and Buenker, R. J., 1990, J. chem. Phys., 92, 585, and references therein
30. Hachey, M., Bruna, P. J., and Grein, F., 1994. J. chem. Soc. Faraday Trans, 90:683
31. Hachey, M. R. J., Bruna, P. J., and Grein, F., 1995. J. phys. Chem., 99:8050
32. Bruna, P. J., Hachey, M. R. J., and Grein, F., 1995. J. phys. Chem., 99:16 576
33. Hachey, M. R. J., Bruna, P. J., and Grein, F., 1996. J. molec. Spectrosc., 176:375
34. Huzinaga, S., 1965. J. chem. Phys., 42:1293 Dunning, T. H., 1971, J. chem. Phys., 55, 716
35. Goodman, G. L., and Berkowitz, J., 1983. Molecular Ions:Geometric and Electronic Structures, Edited by:Berkowitz, J., and Groeneveld, K.-O., 69New York:Plenum Press.
36. Chau, F. T., and McDowell, C. A., 1990. Spectrochim. Acta A, 46:723
37. Buenker, R. J., and Peyerimhoff, S. D., 1970. J. chem. Phys., 53:1368
38. Bruna, P. J., Hachey, M. R. J., and Grein, F., 1997. J. molec. Struct. Theochem, 400:177
39. Harding, L. B., and Goddard, W. A., 1977. J. Amer. chem. Soc., 99:677
40. Langhoff, P. W., Langhoff, S. R., and Corcoran, C. T., 1977. J. chem. Phys., 67:1722 Langhoff, P. W., Orel, A. E., Rescigno, T. N., and McKoy, B. V., 1978, J. chem. Phys., 69, 4689
41. Robin, M. B., 1974. Higher Excited States of Polyatomic Molecules, New York:Academic Press.
42. Weiss, M. J., Kuyatt, C. E., and Mielczarek, S., 1971. J. chem. Phys., 54:4147
43. Clouthier, D. J., and Ramsay, D. A., 1983. Ann. rev. phys. Chem., 34:31
44. Lessard, C. R., and Moule, D. C., 1977. J. chem. Phys., 66:3908
45. Herman, M. R., Diercksen, G. H. F., Fatyga, B. W., and Langhoff, P. W., 1984. Int. J. Quantum Chem., S18:719