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Ab initio many electron relativistic molecular DFS-calculations of inner shell MO-transitions
Authors:B. Fricke  W. -D. Sepp  T. Morović
Affiliation:1. Fachbereich 18-Physik, Universit?t Kassel, Postfach 101380, D-3500, Kassel, Germany
Abstract:Using a relativistic molecular DFS code we have calculated a self-consistent many electron relativistic correlation diagram of the system Cl-Ar. The resulting energy for the 2pπ-1sσ transition is in complete agreement with the experimental results of Schuch et al./1/. This definitely confirms their claim that they are able to measure this quantity from interference structures observed in quasi-molecular K-X-ray spectra.
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