The a 3Δ versus 2 3Π state of the cesium hydride molecule
✍ Scribed by M. Carnell; S.D. Peyerimhoff
- Book ID
- 103027857
- Publisher
- Elsevier Science
- Year
- 1989
- Tongue
- English
- Weight
- 179 KB
- Volume
- 154
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
Ab initio multi-reference confguration interaction (MRD CI) calculations were carried out for the potential energy curves of the first 17 states of the CsH molecule. Our calculations show that the experimentally reported state referred to as a ' A is most likely the second 311 state of CsH, which correlates with the same dissoc&ion channel as the ' 8.
📜 SIMILAR VOLUMES
We present a theoretical calculation of predissociation lifetimes for the vibrational levels of the H2 molecule in the 2 311a state. Our results predict that vibrational lifetimes decrease with t, up to u= 8 and then remain practically constant. Agreement with available experimental data is good. Fi
Explicitly correlated wavefunctions are used to compute adiabatic potential energy curves and electronic dipole transition moments for a number of triplet Sigma and Pi states of the hydrogen molecule in a wide range of internuclear distances. The potential energy curves are more accurate and complet