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Vibronic spectral behavior of molecules: XVIII. Theoretical contribution to the S1→S0fluorescence of the isomeric phenyl naphthalenes within the Herzberg-Teller approach

✍ Scribed by Klaus Gustav; Michael Storch

Publisher
Springer
Year
1991
Tongue
English
Weight
498 KB
Volume
2
Category
Article
ISSN
1040-0400

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Theoretical vibronic T,+Sc "line" spectra of the isomeric phenylnaphthalenes, calculated within the Condon approach on the basis of completely optimized So and T, molecular geometries, are presented and compared with experimental phosphorescence spectra. The theory-experiment comparison is satisfact

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✍ Klaus Gustav; Michael Storch 📂 Article 📅 1990 🏛 John Wiley and Sons 🌐 English ⚖ 797 KB

## Abstract Based on the completely optimized __S__~0~, __S__~1~, and __S__~2~ molecular geometries of azulene, the vibronic structure of the __S__~1~ ← __S__~0~ absorption as well as of the __S__~1~ → __S__~0~, __S__~2~ → __S__~1~, and __S__~2~ → __S__~0~ fluorescences is investigated theoreticall