MCSCF calculation of the frequency-dependent hyperpolarizability of the lithium atom

International Journal of Quantum Chemistry

Volumn 60, Issue 1, 1996, Pages 487-492

  Jaszuǹski, Michał ^a   Rizzo, Antonio ^b  

^a INSTITUTE OF ORGANIC CHEMISTRY   (Poland)

^b Ist Chim Quantistica ed E   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0346377855     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-461X(1996)60:1<487::AID-QUA47>3.0.CO;2-6     Document Type: Article

References (23)

1. R. McWeeny, Methods of Molecular Quantum Mechanics, 2nd ed. (Academic Press, London, 1989).
2. R. McWeeny, Int. J. Quantum Chem. 23, 405 (1983).
3. M. Jaszunski and R. McWeeny, Mol. Phys. 46, 863 (1982).
4. J. Olsen and P. Jørgensen, J. Chem. Phys. 82, 3235 (1985).
5. P. Jørgensen, H. J. Aa. Jensen, and J. Olsen, J. Chem. Phys. 89, 3654 (1988).
6. J. Olsen, H. J. Aa. Jensen, and P. Jørgensen, J. Comp. Phys. 74, 265 (1988).
7. O. Christiansen and P. Jørgensen, Chem. Phys. Lett. 207, 267 (1993).
8. Y. Luo, O. Vahtras, H. Ågren, and P. Jørgensen, Chem. Phys. Lett. 205, 555 (1993).
9. M. Jaszunski, P. Jørgensen, and A. Rizzo, Theor. Chim. Acta 90, 291 (1995).
10. M. Jaszunski, P. Jørgensen, and H. J. Aa. Jensen, Chem. Phys. Lett. 191, 293 (1992).
11. M. Jaszunski, P. Jørgensen, H. Koch, H. Ågren, and T. Helgaker, J. Chem. Phys. 98, 7229 (1993).
12. G. Maroulis and A. J. Thakkar, J. Phys. B: At. Mol. Opt. Phys. 22, 2439 (1989).
13. J. Pipin and D. M. Bishop, Phys. Rev. A 45, 2736 (1992).
14. C. A. Nicolaides and S. I. Themelis, J. Phys. B: At. Mol. Opt. Phys. 26, 2217 (1993).
15. N. El-Bakali Kassimi and A. J. Thakkar, Phys. Rev. A 50, 2948 (1994).
16. J. Olsen, private communication and to be published.
17. T. Helgaker, P. Taylor, and K. Ruud, HERMIT, a program for calculating atomic integrals.
18. H. J. Aa Jensen, H. Ågren, and J. Olsen, SIRIUS, a program for calculating MCSCF wave functions.
19. J. Olsen, private communication.
20. D. M. Bishop, J. Chem. Phys. 90, 3192 (1989).
21. D. P. Shelton, Phys. Rev. A 42, 2578 (1990).
22. M. Jaszunski and D. L. Yeager, Phys. Rev. A 40, 1651 (1989).
23. D. P. Shelton and J. E. Rice, Chem. Rev. 94, 3 (1994).