Ground-state potentials for co+/rare- gas interactions

Molecular Physics

Volumn 89, Issue 2, 1996, Pages 473-488

  Heinemann, Christoph ^a,b   Schwarz, Helmut ^a   Kochoe, Wolfram ^a  

^a TECHNISCHE UNIVERSITÄT BERLIN   (Germany)

^b SANOFI   (France)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000123279     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/002689796173840     Document Type: Article

References (58)

1. Moore, C. E., 1971, Atomic Energy Levels, National Standard Reference Data Series, (Washington, DC: National Bureau of Standards), NSRDS-NBS, Vol. 35.
2. Bengali, A. A., Bergman, R. G., and Moore, C. B., 1995, J. Am. chem. Soc., 117, 3879.
3. Asher, R. L., Bellert, D., Buthelezi, T., and Brucat, P. J., 1994, Chem. Phys. Lett., 277
4. Buthelezi, T., Bellert, D., Lewis, V., and Brucat, P. J., 1995, Chem. Phys. Lett., 242, 627.
5. A sher, R. L., Bellert, D., Buthelezi, T., and Brucat, P. J., 1994, Chem. Phys. Lett., 599
6. A sher, R. L., Bellert, D., Buthelezi, T., Lewis, V., and Brucat, P. J., 1995, Chem. Phys. Lett., 234, 113
7. A sher, R. L., Bellert, D., Buthelezi, T., Lessen, D., Brucat, P. J., 1995, Chem. Phys. Lett., 234, 119
8. Buthelezi, T., Bellert, D., Lewis, V., Brucat, P. J., 1995, Chem. Phys. Lett., 246, 145.
9. Pilgrim, J. S., Yeh, C. S., Berry, K. R., and Duncan, M. A., 1994, J. chem. Phys., 100, 7945
10. Scurlock, C. T., Pilgrim, J. S., Duncan, M. A., 1995, Chem. Phys. Lett., 103, 3293.
11. Kemper, P. R., Hsu, M.-T., and Bowers, M. T., 1991, J. phys. Chem., 95, 10600
12. Von Helden, G., Kemper, P. R., and Bowers, M. T., 1992, J. phys. Chem., 96, 6591.
13. Kickel, B. L., and Armentrout, P. B., 1996, Organometallic Ion Chemistry, edited by B. S. Freiser, (Dordrecht : Kluwer), p. 1.
14. Bauschlicher, Jr., C. W., Partridge, H., and Langhoff, S. R., 1990, Chem. Phys. Lett., 165, 272
15. Partridge, H., Bauschlicher, Jr., C. W., and Langhoff, S. R., 1992, J. phys. Chem., 96, 5350
16. Partridge, H., and Bauschlicher, Jr., C. W., 1994, J.phys. Chem., 98, 2301
17. Bauschlicher, Jr., C. W., and Partridge, H., 1995, Chem. Phys. Lett., 239, 241.
18. Hammond, B. L., Lester Jr., W. A., Braga, M., and Taft, C. A., 1990, Phys. Rev. B, 41, 10447.
19. Schwarz, J., and Schwarz, H., 1994, Organometallics, 13, 1518
20. Schro der, D., Fiedler, A., Schwarz, J., and Schwarz, H., 1994, Inorg. Chem., 33, 5094
21. Schwarz, J., Heinemann, C., and Schwarz, H., 1995, J. phys. Chem., 99, 11405
22. Heinemann, C., Ph. D. thesis, Technical University Berlin, D83; 1996 (Aachen: Shaker Verlag) (ISBN 3 2865 1263 4)
23. Heinemann, C., Schwarz, J., and Schwarz, H., 1995, Chem. Phys. Lett., 247, 611
24. Heinemann, C., Schwarz, J., and Schwarz, H., 1996, J. phys. Chem., 100, 6088.
25. Heinemann, C., Schwarz, J., Koch, W., and Schwarz, H., 1995, J. chem. Phys., 103, 4551.
26. A sher, R. L., Bellert, D., Buthelezi, T., and Brucat, P. J., 1994, Chem. Phys. Lett., 227, 623.
27. Chalasinski, G., and Gutkowski, M., 1988, Chem. Rev., 88, 943.
28. Bartlett, R. J., 1989, J.phys. Chem., 89,1697
29. Bartlett, R. J., and Stanton, J. F., 1994, Reviews in Computational Chemistry, edited by K. B. Lipkowitz and D. G. Boyd, Vol. 5 (New York: VCH)
30. Taylor, P. R., 1995, Lecture Notes in Quantum Chemistry II, Lecture Notes in Chemistry, Vol. 64 (Berlin: Springer).
31. Knowles, P. J., Hampel, C., and Werner, H.-J., 1993, J. chem. Phys., 99, 5219.
32. Watts, J. D., Gauss, J., and Bartlett, R. J., 1993, J. chem. Phys., 98, 8718.
33. Almlof, J., and Taylor, P. R., 1987, J. chem. Phys., 86, 40-70.
34. Widmark, P.-O., Persson, B. J., and Roos, B. O., 1991, Theor. Chim. Acta, 79, 419
35. Widmark, P.-O 1996, PouAmerigo, R., Merchan, M., Nebot-Gil, I., Widmark, P.-O., and Rice, J. E., Taylor, P. R., Lee, T. J., and Almlof, J., 1991, J. chem. Phys., 94, 4972.
36. Nicklass, A., Dolg, M., Stoll, H., and Preuss, H., 1995, J. chem. Phys., 102, 8942.
37. Kuchle, W., Dolg, M., Stoll, H., and Preuss, H., 1991, Molec. Phys., 74, 1245.
38. Boys, S. F., and Bernardi, F., 1970, Molec. Phys., 19, 553
39. van Duijneveldt, F. B., van Duijneveldt-van de Rijdt, J. G. C. M., and van Lenthe, J., 1994, Chem. Rw., 94, 1873.
40. Martin, R. L., and Hay, P. J., 1981, J. chem. Phys., 75, 4539.
41. Lefebvre-Brion, H., and Field, R. W., 1986, Perturbations in the Spectra of Diatomic Molecules (London: Academic Press).
42. Koseki, S., Schmidt, M. W., and Gordon, M. S., 1992, J.phys. Chem., 96, 10768
43. Koseki, S., Gordon, M. S., Schmidt, M. W., and Matsunaga, N., 1995, J.phys. Chem., 99, 12764.
44. McLean, A. D., and Chandler, G. S., 1980, J. chem. Phys., 72, 5639, augmented by a single d-function with an exponent of 0.696.
45. Werner, H.-J., and Knowles, P. J., with contributions from Almlof, J., Amos, R. D., Deegan, M. J. O., Elbert, S. T., Hampel, C., Meyer, W., Peterson, K., Pitzer, R., Stone, A. J., and Taylor, P. R., MOLPRO : a package of ab initio programs.
46. Chong, D. P., and Langhoff, S. R., 1986, J. chem. Phys., 84, 5606.
47. M. R. A., Fulscher, M. P., Kello, V., Lindh, R., Malmqvist, P.-A, Noga, J., Olsen, J., Roos, B. O., Sadlej, A. J., Siegbahn, P. E. M., Urban, M., and Widmark, P.-O., 1994, University of Lund, Sweden.
48. Schmidt, M. W., Baldridge, K. K., Boatz, J. A., Elbert, S. T., Gordon, M. S., Jensen, J. H., Koseki, S., Matsunaga, N., Nguyen, K. A., Su, S., Windus, T. L., Dupuis, M., and Montgomery, J. A., 1993, J. Comput. Chem., 14, 1347.
49. Lias, S. G., Bartmess, J. E., Liebman, J. F., Holmes, J. L., Levin, R. D., and Mallard, W. G., 1988, J. Phys. Chem. Ref. Data Suppl. 1, 17.
50. Haynes, C. L., Armentrout, P. B., Perry, J. K., and Goddard, W. A. III, 1995, J. phys. Chem., 99, 6340.
51. Schultz, R. H., Crellin, K. C., and Armentrout, P. B., 1991, J. phys. Chem., 113, 8590;
52. Schultz, R. H., and Armentrout, P. B., 1992, J. phys. Chem., 96, 1662
53. Schultz, R. H., and Armentrout, P. B., 1993, J. phys. Chem., 97, 596.
54. Koyanagi, G. K., and McMahon, T. B., personal communication to C.H., 3 January, 1996.
55. Schaefer, H. F III., 7 September, 1995, Concluding remarks at the Conference Molecular Quantum Mechanics: Methods and Applications, Cambridge, UK.
56. Woon, D. E., Peterson, K., and Dunning Jr., T. H., to be published.
57. Partridge, H., Bauschlicher, Jr., C. W., and Visscher, L., 1995, Chem. Phys. Lett., 246, 33.
58. Heinemann, C., Schwarz, H., Koch, W., and Dyall, K. G., 1996, J. chem. Phys., 104, 4642.