Solvation energies from the linear response function of density functional theory

Chemical Physics Letters

Volumn 260, Issue 1-2, 1996, Pages 236-242

  Pérez, Patricia ^a   Contreras, Renato ^a   Aizman, Arie ^b  

^a UNIVERSITY OF CHILE   (Chile)

^b DEPARTAMENTO DE FÍSICA   (Chile)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0030595233     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(96)00873-1     Document Type: Article

References (21)

1. [1] P. Hohenberg and W. Kohn, Phys. Rev. B 136 (1964) 864.
2. [2] M.J. Stott and E. Zaremba, Phys. Rev. A 21 (1980) 12.
3. [3] R.G. Parr, R.A. Donnelly, M. Levy and W.E. Palke, J. Chem. Phys. 68 (1978) 3801.
4. [4] J.K. Norskov and N.D. Lang, Phys. Rev. B 21 (1980) 2131.
5. [5] W. Kohn and L.J. Sham, Phys. Rev. A 140 (1965) 1133.
6. [6] J. Korchowiec, H. Gerwens and K. Jug, Chem. Phys. Lett. 222 (1994) 58.
7. [7] A. Corma, F. Llopis, P. Viruela and C. Zicovich-Wilson, J. Am. Chem. Soc. 116 (1994) 134.
8. [8] F. De Proft, S. Amira, K. Choho and P. Geerlings, J. Phys. Chem. 98 (1994) 5227.
9. [9] R.G. Parr and R.G. Pearson, J. Am. Chem. Soc. 105 (1983) 7512.
10. [10] R.G. Parr, R.G. Pearson and W. Yang, J. Am. Chem. Soc. 106 (1984) 4049.
11. [11] T.A. Wesolowski and A. Warshel, J. Phys. Chem. 97 (1993) 8050.
12. [12] A. Fortunelli and J. Tomasi, Chem. Phys. Lett. 231 (1994) 34.
13. [13] R. Contreras, F. Mendizabal and A. Aizman, Phys. Rev. A 49 (1994) 3439.
14. [14] P. Perez, R. Contreras and A. Aizman, Int. J. Quantum Chem. 56 (1995) 433.
15. [15] G. Gázquez, in: Structure and bonding, Vol. 80, ed. K.D. Sen (Springer, Berlin, 1993) ch. 20.
16. [16] R. Constanciel and R. Contreras, Theoret. Chim. Acta 65 (1984) 1.
17. [17] C.F.J. Botcher, Theory of electric polarization, Vol. 1 (Elsevier, Amsterdam, 1973) p. 129.
18. [18] M. Berkowitz and R.G. Parr, J. Chem. Phys. 88 (1988) 2554.
19. [19] A. Vela and J.L. Gázquez, J. Am. Chem. Soc. 112 (1990) 1490.
20. [20] R. Contreras and A. Aizman, Int. J. Quantum Chem. 25 (1990) 281.
21. [21] R.G. Pearson, J. Am. Chem. Soc. 108 (1986) 6109.