Abstract
The Green's function method for the calculation of vertical excitation energies is adapted to the CNDO and INDO approximations by introducing an effective interaction into the irreducible vertex part. The computational scheme is explicitly developed for closed-shell molecules and applied to H2O, H2CO, HCOOH, HCONH2.
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Liegener, CM. Calculation of vertical excitation energies of closed-shell molecules in the CNDO and INDO approximations. Theoret. Chim. Acta 57, 219–231 (1980). https://doi.org/10.1007/BF00554103
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DOI: https://doi.org/10.1007/BF00554103