Relativistic effects on the bonding of heavy and superheavy hydrogen halides

Chemical Physics Letters

Volumn 263, Issue 3-4, 1996, Pages 360-366

  Saue, Trond ^a   Faegri, Knut ^a   Gropen, Odd ^b  

^a UNIVERSITY OF OSLO   (Norway)

^b UNIVERSITY OF TROMSØ   (Norway)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0030582806     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(96)01250-X     Document Type: Article

References (33)

1. [1] U. Kaldor and B.A. Hess, Chem. Phys. Lett. 230 (1994) 1.
2. [2] P.A. Christiansen and K.S. Pitzer, J. Chem. Phys. 72 (1981) 1162
3. [3] P. Pyykkö, Chem. Rev. 88 (1988) 563.
4. [4] O. Visser, L. Visscher, P.J.C. Aerts and W.C. Nieuwpoort, Theoret. Chim. Acta. 81 (1992) 405.
5. [5] A.K. Mohanty and E. Clementi, Int. J. Quant. Chem. 39 (1990) 487.
6. [6] K.G. Dyall, K. Faegri, Jr. and P.R. Taylor in The Effects of Relativity in Atoms, Molecules and the Solid State, edited by S. Wilson, I.P. Grant and B. Gyorffy (Plenum Press, New York 1991) p. 167.
7. [7] K.G. Dyall, P.R. Taylor, K. Faegri, Jr. and H. Partridge, J. Chem. Phys. 95 (1991) 2583.
8. [8] O. Matsuoka, J. Chem. Phys. 97 (1972) 2271.
9. [9] L. Pisani and E. Clementi, J. Comp. Chem. 15 (1994) 466.
10. [10] T. Saue, K. Faegri, Jr., and O. Gropen, in preparation.
11. [11] L. Visscher, O. Visser, H. Aerts, H. Merenga and W.C. Nieuwpoort, Comput. Phys. Comm., 81 (1994) 120
12. [12] L. Visscher, T. Saue, W.C. Nieuwpoort, K. Faegri, Jr., and O. Gropen, J. Chem. Phys. 99 (1993) 6704.
13. [13] C.L. Collins, K.G. Dyall and H.F. Schaeffer, III, J. Chem. Phys. 102 (1995) 2024.
14. [14] K.G. Dyall. Chem. Phys. Lett., 224 (1994) 186.
15. [15] J.K. Laerdahl and K. Faegri, Jr. in preparation.
16. [16] L. Visscher, K.G. Dyall and T.J. Lee, Int. J. Quant. Chem., Quant. Chem. Symp 29 (1995) 411.
17. [17] B.A. Hess, Phys. Rev. A. 32 (1986) 3742.
18. [18] O. Gropen in Methods in Computational Chemistry, Vol II, edited by S. Wilson (Plenum Press, New York 1988), p. 1.
19. [19] E. v. Lenthe, E.J. Baerends and J.G. Snijders, J. Chem. Phys. 99 (1993) 4597.
20. [20] K.G. Dyall, J. Chem. Phys. 100 (1994) 2118.
21. [21] K.G. Dyall and K. Faegri, Jr., Theoret. Chim. Acta 94 (1996) 39
22. [22] K. Faegri, Jr. and Jan Almlöf, J. Comp. Chem. 7 (1986) 396.
23. [23] O. Matsuoka and S. Okada, Chem. Phys. Lett. 155 (1989) 547.
24. [24] K.G. Dyall, I.P. Grant, C.T. Johnson, F.A. Parpia and E.P. Plummer, Comp. Phys. Comm. 55 (1989) 425.
25. [25] K.G. Dyall and K. Faegri, Jr., Chem. Phys. Lett. 174 (1990) 25.
26. [26] K. Faegri, Jr., Technical note. Department of Chemistry, University of Oslo (1994).
27. [27] J.G. Snijders and P. Pyykkö, Chem. Phys. Lett. 75 (1980) 5.
28. [28] L. Visscher, personal communication.
29. [29] P. Schwerdtfeger, L. v. Szentpaly, K. Vogel, H. Silberbach. H. Stoll and H. Preuss, J. Chem. Phys. 86 (1987) 510.
30. [30] K.P. Huber and G. Hertzberg, Molecular Spectra and Molecular Structure IV. Constants of Diatomic Molecules, (Van Nostrand Reinhold, New York 1979).
31. [31] M. Dolg, W. Küchle, H. Stoll, H. Preuss and P. Schwerdtfeger, Mol. Phys. 74 (1991) 1265.
32. [32] J. Almlöf, K. Faegri, Jr. and K. Korsell, J. Comp. Chem. 3 (1982) 385.
33. [33] J.F. Ogilvie, W.P. Rodwell and R.H. Tipping, J. Chem. Phys. 73 (1980) 5221.