Semiempirical SCF–MO treatment of excited states of aromatic compounds
- 1 January 1971
- journal article
- research article
- Published by Royal Society of Chemistry (RSC) in J. Chem. Soc. A
- p. 1220-1237
- https://doi.org/10.1039/j19710001220
Abstract
Recent papers have described a semiempirical treatment of ground states of conjugated molecules, based on the Hückel σ,π-approximation. Here we report an extension of the method to the lowest singlet and triplet excited states.Keywords
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