Abstract
A series of approximate LCAO-SCF methods intermediate between the INDO and the NDDO schemes is proposed. The suggestion is based upon the decomposition of integrals in multipole-multipole type interactions.
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Pople, J. A., Santry, D. P., Segal, G. A.: J. Chem. Phys. 43, S 129 (1965)
Pople, J. A., Beveridge, D. L., Dobosh, P. A.: J. Chem. Phys. 47, 2026 (1967)
Pople, J. A., Beveridge, D. L.: Approximate molecular orbital theory. New York: McGraw-Hill 1970
Murrell, J. N., Harget, A. J.: Semi-empirical self-consistent-field molecular-orbital theory of molecules. London: Wiley 1972
Dewar, M. S. J., Klopman, G.: J. Am. Chem. Soc. 89, 3089 (1967)
Jackson, J. D.: Classical electrodynamics, (a) Sec. 3.5. (b) Sec. 4.1. New York: Wiley 1962
Dahl, J. P.: Acta Chem. Scand. 21, 1244 (1967)
Rose, M. E.: Elementary theory of angular momentum, Sec. 14. New York: Wiley 1957
Dixon, R. N.: Mol. Phys. 12, 83 (1967)
Roothaan, C. C. J.: J. Chem. Phys. 19, 1445 (1951)
Ohno, K.: Theoret. Chim. Acta (Berl.) 2, 219 (1964)
Klopman, G.: J. Am. Chem. Soc. 86, 4550 (1964)
Nicholson, B. J.: Advan. Chem. Phys. 18, 249 (1970)
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Voigt, B. On bridging the gap between the INDO and the NDDO schemes. Theoret. Chim. Acta 31, 289–295 (1973). https://doi.org/10.1007/BF00527556
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DOI: https://doi.org/10.1007/BF00527556