## Abstract This paper presents some calculations on the monomer and dimer of benzoic acid using optimized molecular geometries. The calculated levels and transition moments are in good agreement with experimental results and they give a good account of some particular features of the absorption an
✦ LIBER ✦
Vibrational spectra and normal mode calculations of benzoic acid single crystals
✍ Scribed by G. Klausberger; K. Furić; L. Colombo
- Publisher
- John Wiley and Sons
- Year
- 1977
- Tongue
- English
- Weight
- 477 KB
- Volume
- 6
- Category
- Article
- ISSN
- 0377-0486
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✦ Synopsis
Abstract
Raman and infrared spectroscopic studies of benzoic acid dimers and crystals have been made. Molecular and crystal normal modes have been calculated. An assignment of the observed spectra has been proposed and some specific modes discussed.
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