Analytical derivatives for molecular solutes. III. Hartree-Fock static polarizability and hyperpolarizabilities in the polarizable continuum model

Journal of Chemical Physics

Volumn 104, Issue 12, 1996, Pages 4611-4620

  Cammi, Roberta ^a   Cossi, Maurizio ^b   Tomasi, Jacopo ^b  

^a UNIVERSITY OF PARMA   (Italy)

^b UNIVERSITY OF PISA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84962374913     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.471208     Document Type: Article

References (23)

1. R. Cammi and J. Tomasi, J. Chem. Phys. 100, 7495 (1994).
2. R. Cammi and J. Tomasi, J. Chem. Phys. 101, 3888 (1994).
3. S. Miertuš, E. Scrocco, and J. Tomasi, Chem. Phys. 55, 117 (181).
4. D. P. Shelton and J. E. Rice, Chem. Rev. 94, 3 (1994).
5. D. M. Bishop, Int. Rev. Phys. Chem. 13, 21 (1994).
6. A. Willetts, J. E. Rice, D. M. Burland, and D. P. Shelton, J. Chem. Phys. 97, 7590 (1993).
7. M. Stahlein, C. R. Moylan, D. M. Burland, and A. Willetts, J. Chem. Phys. 98, 5595 (1993).
8. K. D. Singer and A. F. Garito, J. Chem. Phys. 75, 3581 (1981).
9. P. Debye, Polar Molecules (Dover, New York, 1929).
10. L. Onsager, J. Am. Chem. Soc. 58, 1546 (1936).
11. P. C. Bolton, J. Chem. Phys. 16, 486 (1948).
12. C. H. Collie, J. B. Hasted, and D. M. Ritsan, Proc. Phys. Soc. (London) 60, 145 (1948).
13. A. D. Buckingham, Aust. J. Chem. 6, 93 (1953).
14. S. R. Polo and M. K. Wilson, J. Chem. Phys. 23, 2376 (1955).
15. D. O. Klug, D. E. Kranbuhel, and W. E. Waugham, J. Chem. Phys. 50, 3904 (1969).
16. B. F. Levin and C. G. Bethea, J. Chem. Phys. 63, 2666 (1975).
17. T. Ohba and S. Ikawa, Mol. Phys. 73, 985 (1991).
18. D. Rinaldi, H. F. Ruiz-Lopez, M. T. Martins Costa, and J. L. Rivail, Chem. Phys. Lett. 128, 177 (1986).
19. (a) C. C. Tang and A. F. Garito, Phys. Rev. Lett. 50, 350 (1983);
20. (b) Phys. Rev. B 28, 6766 (1983).
21. M. W. Wong, K. B. Wiberg, and M. Frish, J. Chem. Phys. 95, 8991 (1991).
22. R. Sen, D. Majudmar, and S. P. Bhattacharya, Chem. Phys. Lett. 190, 443 (1992).
23. A. Willetts, and J. E. Rice, J. Chem. Phys. 99, 426 (1993).