INDO Calculations with inclusion of an effective solvent field. Application to benzosemiquinones

Author:

Spanget-Larsen Jens

Publisher

Springer Science and Business Media LLC

Subject

Chiropractics,Physical and Theoretical Chemistry

Reference29 articles.

1. Pople, J. A., Beveridge, D. L., Dobosh, P. A.: J. Am. Chem. Soc. 90, 4201 (1968); Pople, J. A., Beveridge, D. L.: Approximate molecular orbital theory. New York: McGraw-Hill 1970

2. Murrell, J. N., Harget, A. J.: Semi-empirical self-consistent-field molecular orbital theory of molecules. London: Wiley-Interscience 1972; Beveridge, D. L., in: Semiempirical methods of electronic structure calculations, Part B, Chapt. 5, Segal, G. A., ed. New York: Plenum Press 1977

3. Borg, D. C., in: Biological applications of electron spin resonance, Chapt. 7. Swartz, H. M., Bolton, J. R., Borg, D. C., eds. New York: Wiley 1972

4. Matsunaga, Y.: Bull. Chem. Soc. Jap. 33, 1436 (1960); Wincow, G., Fraenkel, G. K.: J. Chem. Phys. 34, 1333 (1961); Wincow, G.: J. Chem. Phys. 38, 917 (1963); Kuboyama, A., Wada, K.: Bull. Chem. Soc. Jap. 38, 1709 (1965); Kikuchi, O., Someno, K.: Bull. Chem. Soc. Jap. 40, 2972 (1967); Silver, B. L.: Theoret. Chim. Acta (Berl.) 9, 192 (1967); Edwards, T. G., Grinter, R.: Mol. Phys. 15, 367 (1968)

5. Pila?, J.: J. Phys. Chem. 74, 4029 (1970)

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