Adiabatic and diabatic decoupling for selected H-H* scattering states
- 1 January 1971
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 21 (3) , 523-533
- https://doi.org/10.1080/00268977100101681
Abstract
For thermal atomic collisions a new simple expression for the partial inelastic scattering cross section, not involving any derivatives or highly cancelling components, is derived in a two-state distorted wave description. It is shown that an R-dependent diabatic representation is not possible, R being the internuclear distance, and a near-adiabatic representation is suggested as an alternative to the usual adiabatic representation. To test the numerical stability of the new formula and to compare the representations, transition probabilities for thermal H-H* collisions are calculated by the method of distorted waves using the complete radial coupling operators.Keywords
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