Molecular deformation and vibrational structure of the first U.V. band in linear polyenes
β Scribed by S. Diner; J. P. Malrieu
- Publisher
- Springer
- Year
- 1967
- Tongue
- English
- Weight
- 266 KB
- Volume
- 7
- Category
- Article
- ISSN
- 1432-2234
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π SIMILAR VOLUMES
Experimental data on the nonlinear optical molecular hyperpolarizabilities of push-pull polyenes (measured with the vibrational method recently proposed) are presented and discussed. The analysis of the results and the interpretation of the spectral features allow us to establish structure-property
The potential energy curves and changes in electronic structures along a coordinate consisting of C=C stretching and C-C shrinking are examined for the 1 tAg and 2 tAg states of trans-polyenes ranging from hexatriene to dodecahexaene by the ab initio molecular orbital method. The shapes of the calcu