Abstract
Auger transition energies for hydrogen fluoride have been calculated ab initio in a finite basis LCGO SCF approach. Two basis sets, one of double zeta quality and one extended, are both shown to give reasonable agreement with experimental results. The effect of CI on the (2σ−2)1Σ+ state is discussed. KL—LLL satellite structure in the experimental spectrum is also accounted for by the calculations. Calculations at different internuclear distances show that possible contributions from bond lengthening are of the same magnitude as correlation effects.
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