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Nonadiabatic coupling in the Li2-Li2+ system by Jan Vojtík, Alena Krtková and Rudolf Polák is a scholarly article available to read on EtoBox.

What is Nonadiabatic coupling in the Li2-Li2+ system about?

Nonadiabatic coupling between the lowest two doublet potential energy surfaces of the Li2-Li2+ system is calculated using the semiempirical VB technique of diatomics-in-molecules (DIM). Location of nonadiabatic region in the configuration space and basic characteristics of the system in nonadiabatic and asymptotic regions are used to discuss the influence of the nonadiabatic effects on the behaviour of the Li2-Li2+ system under chemical conditions.

Author

Jan Vojtík, Alena Krtková and Rudolf Polák

Published

1985

Language

EN