Predissociation of the ions HBr+and DBr+
- 1 January 1992
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 75 (1) , 173-188
- https://doi.org/10.1080/00268979200100131
Abstract
Potential energy curves for all HBr+ states which correlate with the first three dissociation limits are calculated employing the multi-reference configuration-interaction MRD-CI treatments in a Gaussian AO basis. Predissociation rates for the A2Σ+ vibrational levels in HBr+ and DBr+ due to spin-orbit interaction are calculated. The spin-orbit coupling elements are evaluated explicitly by using the Breit-Pauli operator and the MRD-CI wavefunctions.Keywords
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