Theoretical Study of Transition-Metal Hydrides. 5. HfH+ through HgH+, BaH+, and LaH+

Journal of the American Chemical Society

Volumn 112, Issue 20, 1990, Pages 7179-7189

  Goddard, William A ^a   Ohanessian, Gilles ^b   Brusich, Mark J ^c  

^a CALIFORNIA INSTITUTE OF TECHNOLOGY   (United States)

^b UNIVERSITÉ PARIS SACLAY   (France)

^c INSTITUTE FOR DEFENSE ANALYSES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000208946     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja00176a016     Document Type: Article

References (49)

1. Elkind, J. L.; Armentrout, P. B. J. Phys. Chem. 1987, 91, 2037.
2. Tolbert, M. A.; Beauchamp, J. L. J. Am. Chem. Soc. 1984, 106, 8117.
3. Bartmess, J. E.; Kester, J. D. Inorg. Chem. 1984, 23, 1877.
4. Po, P. L.; Radus, T. P.; Porter, R. P. J. Phys. Chem. 1978, 82, 520.
5. Armentrout, P. B.; Georgiadis, R. Polyhedron 1988, 7, 1573.
6. Elkind, J. L.; Armentrout, P. B. J. Phys. Chem. 1987, 91, 2037.
7. Beauchamp, J. L. In High Energy Processes in Organometallic Chemistry; ACS Symposia Series No. 333; American Chemical Society; Washington, DC, 1987.
8. Armentrout, P. B.; Beauchamp, J. L. Acc. Chem. Res. 1989, 22, 315.
9. Schilling, J. B.; Goddard, W. A., III; Beauchamp, J. L. J. Am. Chem. Soc. 1986, 108, 582.
10. Schilling, J. B.; Goddard, W. A., III; Beauchamp, J. L. J. Phys. Chem. 1987, 91, 5616.
11. Schilling, J. B.; Goddard, W. A., III; Beauchamp, J. L. J. Am. Chem. Soc. 1987, 109, 5565.
12. Schilling, J. B.; Goddard, W. A., III; Beauchamp, J. L. J. Phys. Chem. 1987, 91, 4470.
13. Pettersson, L. G. M.; Bauschlicher, C. W., Jr.; Langhoff, S. R.; Partridge, H. J. Chem. Phys. 1987, 87, 481.
14. Alvarado-Swaisgood, A. E.; Harrison, J. F. J. Phys. Chem. 1988, 92, 2757.
15. Carter, E. A.; Goddard, W. A., III, J. Phys. Chem. 1988, 92, 5679.
16. Moore, C. E. Atomic Energy Levels; National Bureau of Standards: Washington, D. C., 1971; Vol. 3.
17. van Kleef, Th. A. M.; Metsch, B. C. Physics 1978, 95C, 251.
18. Wyart, J.-F. Opt. Pura Api. (Spain) 1977, 10, 177.
19. Goddard, W. A., III; Harding, L. B. Amu. Rev. Phys. Chem. 1978, 29, 363.
20. Brusich, M. J.; Goddard, W. A., III, to be published.
21. Brusich, M. J. Ph.D. Thesis, California Institute of Technology, 1988.
22. Steigerwald, M. L. Ph.D. Thesis, California Institute of Technology, 1983.
23. Wilson, C. W., Jr.; Goddard, W. A., III Theor. Chim. Acta 1972, 26, 195.
24. Goddard, W. A., III; Wilson, C. W. Jr. Theor. Chim. Acta. 1972, 26, 211.
25. Pyykkö, P. J. Chem. Soc., Faraday Trans. 2 1979, 75, 1256.
26. Pyykkö, P.; Snijders, J. G.; Baerends, E. J. Chem. Phys. Lett. 1981, 83, 432.
27. Fuentealba, P.; Reyes, O. Mol. Phys. 1987, 62, 1291.
28. Wang, S. W.; Pitzer, K. S. J. Chem. Phys. 1983, 79, 3851.
29. Elkind, J. L.; Sunderlin, L. S.; Armen trout, P. B. J. Phys. Chem. 1989, 93, 3151.
30. Huber, K. P.; Herzberg, G. Molecular Spectra and Molecular Structure. IV. Constants of Diatomic Molecules; Van Nostrand Reinhold: New York, 1979.
31. Mrozowski, A. S. Phys. Rev. 1940, 58, 332.
32. Herzberg, G. Spectra of Diatomic Molecules; Van Nostrand Reinhold: New York, 1950.
33. Gaydoh, A. G. Dissociation Energies; Chapman and Hall: London, 1968.
34. Georgiadis, R.; Armentrout, P. B. J. Phys. Chem. 1988, 92, 7060.
35. Ziegler, T.; Snijders, J. G.; Baerends, E. J. J. Chem. Phys. 1981, 74, 1271.
36. Ramos, A. F.; Pyper, N. C.; Malli, G. L. Phys. Rev. 1988, A38, 2729.
37. Hay, P. J.; Wadt, W. R. J. Chem. Phys. 1985, 82, 299.
38. Hay, P. J.; Wadt, W. R. J. Chem. Phys. 1985, 82, 270.
39. Huzinaga, S. J. Chem. Phys. 1965, 42, 1293.
40. Dunning, T. H., Jr. J. Chem. Phys. 1970, 43, 2823.
41. Bair, R. A.; Goddard, W. A., III, to be published.
42. Bair, R. A. Ph.D. Thesis, California Institute of Technology, 1981.
43. Carter, E. A.; Goddard, W. A., III J. Chem. Phys. 1988, 88, 3132.
44. Bobrowicz, F. B., Goddard, W. A., III In Modern Theoretical Chemistry: Methods of Electronic Structure Theory; Schaefer, H. F., III, Ed.; Plenum Press: New York, 1977; Vol. 3.
45. Ladner, R. C.; Goddard, W. A., III J. Chem. Phys. 1969, 51, 1073.
46. Moss, B. J.; Bobrowicz, F. W.; Goddard, W. A., III J. Chem. Phys. 1975, 63, 4632.
47. Goddard, W. A., III Phys. Rev. 1967, 157, 73-81.
48. Ohanessian, G.; Goddard, W. A., III, to be published.
49. Balasubramanian, K. J. Phys. Chem. 1989, 93, 6585.