Ab initio calculation of the vibronically averaged hyperfine coupling constants in the 1\(^2\)Π\(_u\) electronic state of CH\(_2 ^+\)
Please always quote using this URN: urn:nbn:de:bvb:20-opus-58951
- The results of pure ab initio calculations of the hyperfine coupling constants for the 1 \(^2 \pi _u\) electronic state for various isotopomers of CHi in the energy range between 0 and 20 000 cm\(^{-1}\) are presented. Effects of vibronic and spin-orbit coupling are discussed.
| Author: | M. Peric, Bernd Engels |
|---|---|
| URN: | urn:nbn:de:bvb:20-opus-58951 |
| Document Type: | Journal article |
| Faculties: | Fakultät für Chemie und Pharmazie / Institut für Organische Chemie |
| Language: | English |
| Year of Completion: | 1992 |
| Source: | In: The journal of chemical physics (1992) 97, 7629-7636. |
| Dewey Decimal Classification: | 5 Naturwissenschaften und Mathematik / 54 Chemie / 540 Chemie und zugeordnete Wissenschaften |
| GND Keyword: | Organische Chemie |
| Release Date: | 2011/10/20 |
| Licence (German): |  Deutsches Urheberrecht |