Conceptual and mathematical difficulties arise in the study of transitions between vibronic states belonging to crossing Born᎐Oppenheimer hypersurfaces with significantly different positions and shapes of the minimum-energy nuclear configurations Ž . Duschinsky effect . This article presents an anal
Vibronic coupling and the duschinsky effect in benzene
✍ Scribed by F. Metz; M.J. Robey; E.W. Schlag; F. Dörr
- Publisher
- Elsevier Science
- Year
- 1977
- Tongue
- English
- Weight
- 430 KB
- Volume
- 51
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
Explicit consideration of mode mixing (Duschinsky effect) is necessary to interpret the vibronic intensities in the oneand two-photon spectra of the electronically forbidden 'Bzu e 'Al8 transition in benzene. Good agreement with experiment is obtained by using a set of excited state normal coordinates derived from experiment.
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