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On bridging the gap between the INDO and the NDDO schemes

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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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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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