Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons
First excited singlet and triplet electric dipole polarizabilities are reported. The π polarizability is calculated by means of a modified Rayleigh–Schrödinger perturbation theory and an SCF‐LCAO basis. The σ contribution is included by an additive scheme. The polarization of the σ electrons is part...
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| Veröffentlicht in: | International journal of quantum chemistry 1976-05, Vol.10 (3), p.429-437 |
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| Hauptverfasser: | , , |
| Format: | Artikel |
| Sprache: | eng |
| Online-Zugang: | Volltext |
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