Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5414978 | Journal of Molecular Spectroscopy | 2012 | 9 Pages |
Abstract
⺠The spin-rovibronic energy levels of the low-lying electronic states of CaO are investigated. ⺠The spin-orbit and angular momenta couplings are computed ab initio. ⺠All these couplings are considered during wave packet time propagation calculations. ⺠Our results compared well with the experimental data.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
H. Khalil, F. Le Quéré, V. Brites, C. Léonard,