It is demonstrated that the inclusion of double-excited configurations in semi-cmpiricclf and B priuri calculations of polycnes leads to a significant alteration of the spectrum. In areement with the recent experiment of Hudson and liohlor, a forbidden ('A,) state appears below the strongly allmved
Spectroscopic investigation on the effect of gas adsorption on solid films of polyenes: Evidence of a low-lying forbidden transition
โ Scribed by Krishnagopal Mandal; T.N. Misra
- Publisher
- Elsevier Science
- Year
- 1974
- Tongue
- English
- Weight
- 382 KB
- Volume
- 27
- Category
- Article
- ISSN
- 0009-2614
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โฆ Synopsis
Optical absorption spectra of a few polyenes in the crystalline state have been studied. On adsorption of certain gases on the crystallite surfaces of polyenes. a new band appears on the low energy side of the long wavelength bands of these polyenes. The position of this band is 536,537 and 375 m,u for all~runs &c:nrotene. 15,LS'sis O-carotene and retinyl compounds, respectively.
A good mirror image relationship between the new absorption bonds and the well known emission bands for these molecules indicates that this new band may be due to a weak transition to a low-lying n-electron state. This transition corresponds to a forbidden state below the strongly allowed (' Bu) state. The adsorbed gas molecules introduce the perturbation required for the enhancement of a low-lying forbidden transition.
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