Self-consistent-field calculations molecular magnetic properties using gauge-invariant atomic orbitals

International Journal of Quantum Chemistry

Volumn 75, Issue 4-5, 1999, Pages 637-643

  Kiribayashi, Shinji ^a   Kobayashi, Takao ^a   Nakano, Masayoshi ^a   Yamaguchi, Kizashi ^a  

^a OSAKA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0008075432     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-461X(1999)75:4/5<637::AID-QUA30>3.0.CO;2-4     Document Type: Article

References (17)

1. London, F. J Phys Radium 1937, 8, 397.
2. Hameka, H. F. Mol Phys 1958, 1, 203.
3. Hameka, H. F. Z Naturforsch 1959, 14a, 599.
4. Hameka, H. F. Rev Mod Phys 1962, 34, 87.
5. Wolinski, K.; Hinton, J. F.; Pulay, P. J Am Chem Soc 1990, 112.
6. Helgaker, T.; Jørgensen, P. J Chem Phys 1991, 95, 2529.
7. Bak, K. L.; Jørgensen, P.; Helgaker, T.; Ruud, K.; Jensen, H. J. A. J Chem Phys 1993, 98, 8873.
8. Ruud, K.; Helgaker, T.; Bak, K. L.; Jørgensen, P.; Jensen, H. J. A. J Chem Phys 1993, 99, 3847.
9. Bak, K. L.; Jørgensen, P.; Helgaker, T.; Ruud, K.; Jensen, H. J. A. J Chem Phys 1994, 100, 6620.
10. Rizzo, A.; Helgaker, T.; Ruud, K.; Barszczewicz, A.; Jaszuǹski, M.; Jørgensen, P. J Chem Phys 1995, 102, 8953.
11. Obara, S.; Saika, A. J Chem Phys 1986, 84, 3963.
12. Obara, S.; Saika, A. J Chem Phys 1988, 89, 1540.
13. Honda, M.; Sato, K.; Obara, S. J Chem Phys 1991, 94, 3790.
14. Jørgensen, P.; Simons, J. Second Quantization Based Methods in Quantum Chemistry; Academic: New York, 1981.
15. Kiribatashi, S.; Yamaguchi, K., in preparation.
16. Sadlej, A. J. Collect Czech Chem Commun 1988, 53, 1995.
17. Dunning, T. H. J Chem Phys 1989, 90, 1007.