Electronic current models of vibrational circular dichroism
โ Scribed by Laurence A. Nafie; Teresa B. Freedman
- Publisher
- Elsevier Science
- Year
- 1990
- Tongue
- English
- Weight
- 688 KB
- Volume
- 224
- Category
- Article
- ISSN
- 0022-2860
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
Calculations of the vibrational circular dichroism (VCD) and absorption spectra of propylene oxide over the range 700-1600 cm-' are compared with experimental spectra. VCD spectra are calculated using Stephens' equation for vibrational rotational strengths in the distributed origin gauge. Atomic pol
The magnetic vibrational circular dichroism spectra of C6o fullerene in solution are presented for excitation of the 1430 and 1183 cm-l ttu-symmetry fundamental vibrations. These transitions give rise to A-term MVCD of opposite sign (A~/Do= -3.8 and l. 1 ร 10-4, respectively) which are similar in ma
A theory of type B magnetic vibrational circular dichroism (MVCD) is developed and applied. The motion of the nuclei is treated classically and the momentum correlation between their motion and the electronic motion is treated explicitly.