Spin-orbit effects in the PtH+2 ion

Journal of Molecular Structure: THEOCHEM

Volumn 451, Issue 1-2, 1998, Pages 227-235

  Fagerli, Hilde ^a   Schimmelpfennig, Bernd ^a   Gropen, Odd ^a   Wahlgren, Ulf ^a  

^a UNIVERSITY OF TROMSØ   (Norway)

Author keywords

All electron; Configuration interaction; Douglas Kroll; Platinum hydride; Spin orbit

Indexed keywords

EID: 0000057062     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(98)00174-2     Document Type: Article

References (16)

1. J. Sauer, Chem. Rev. 89 (1989) 199.
2. P. Pyykkö, Relativistic quantum chemistry, Adv. Quantum Chem., 11 (1978) 353-409. P. Pyykkö, in: Relativistic Theory of Atoms and Molecules II: A Bibliography 1986-1992, Lecture Notes in Chemistry, Springer, Berlin, 1993. P. Pyykkö, in: S. Wilson, I.P. Grant, B.L. Gyorffy (Eds.), Eff. Relativ. At., Mol., Solid State (Proc. Meet.), Plenum, New York, 1991, pp. 1-13. P. Pyykkö, Relativistic effects on periodic trends, Chem. Rev., 88 (1988) 563-594.
3. P. Pyykkö, Relativistic quantum chemistry, Adv. Quantum Chem., 11 (1978) 353-409. P. Pyykkö, in: Relativistic Theory of Atoms and Molecules II: A Bibliography 1986-1992, Lecture Notes in Chemistry, Springer, Berlin, 1993. P. Pyykkö, in: S. Wilson, I.P. Grant, B.L. Gyorffy (Eds.), Eff. Relativ. At., Mol., Solid State (Proc. Meet.), Plenum, New York, 1991, pp. 1-13. P. Pyykkö, Relativistic effects on periodic trends, Chem. Rev., 88 (1988) 563-594.
4. P. Pyykkö, Relativistic quantum chemistry, Adv. Quantum Chem., 11 (1978) 353-409. P. Pyykkö, in: Relativistic Theory of Atoms and Molecules II: A Bibliography 1986-1992, Lecture Notes in Chemistry, Springer, Berlin, 1993. P. Pyykkö, in: S. Wilson, I.P. Grant, B.L. Gyorffy (Eds.), Eff. Relativ. At., Mol., Solid State (Proc. Meet.), Plenum, New York, 1991, pp. 1-13. P. Pyykkö, Relativistic effects on periodic trends, Chem. Rev., 88 (1988) 563-594.
5. P. Pyykkö, Relativistic quantum chemistry, Adv. Quantum Chem., 11 (1978) 353-409. P. Pyykkö, in: Relativistic Theory of Atoms and Molecules II: A Bibliography 1986-1992, Lecture Notes in Chemistry, Springer, Berlin, 1993. P. Pyykkö, in: S. Wilson, I.P. Grant, B.L. Gyorffy (Eds.), Eff. Relativ. At., Mol., Solid State (Proc. Meet.), Plenum, New York, 1991, pp. 1-13. P. Pyykkö, Relativistic effects on periodic trends, Chem. Rev., 88 (1988) 563-594.
6. O. Gropen, M. Sjøvoll, H. Strømsnes, E. Karlsen, O. Swang, K. Fægri, Theor. Chim. Acta 85 (1994) 373.
7. H. Zhang, K. Balasubramanian, J. Phys. Chem. 96 (1992) 6981.
8. M. Douglas, N.M. Kroll, Ann. Phys. 89 (1974) 82.
9. J. Almlöf, O. Gropen, in: K.B. Lipkowitz, D.B. Boyd (Eds.), Reviews in Computational Chemistry, vol. 8, VCH, New York, 1996.
10. M. Sjøvoll, H. Fagerli, O. Gropen, J. Almlöf, J. Olsen, T.U. Helgaker, Int. J. Quant. Chem. (accepted for publication).
11. M. Sjøvoll, H. Fagerli, O. Gropen, J. Almlöf, B. Schimmelpfennig, U. Wahlgren, Theor. Chem. Acc. 97 (1997) 324.
12. B.A. Hess, C. Marian, U. Wahlgren, O. Gropen, Chem. Phys. Lett. 251 (1996) 356.
13. O. Launila, B. Schimmelpfennig, H. Fagerli, O. Gropen, A.G. Taklif, U. Wahlgren, J. Molec. Spectrosc. (accepted for publication).
14. B. Schimmelpfennig, AMFI, an atomic mean-field integral code, Stockholm University, 1996.
15. LUCIA: J. Olsen, B.O. Roos, H.J. Aa Jensen, J. Chem. Phys., 89 (1988) 2185.
16. M. Sjøvoll, O. Gropen, J. Olsen, Theor. Chem. Acc. 97 (1997) 301.