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On the calculation of matrix elements in diatomic molecules
Authors:T.E.H. Walker
Affiliation:Department of Physics , University of Virginia , Charlottesville, Virginia, 22901
Abstract:Group theoretical techniques similar to those employed for transition-metal complexes are applied to diatomic molecules. Expressions are given for reduced matrix elements between configurations with one, two and three electrons outside closed shells. The results agree with previous calculations but predict deviations from simple applications of the hypothesis of pure precession.
Keywords:
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