The Anderson-Condon-Shortley Site in X-ray Spectroscopies of Solids
ORAL
Abstract
Electronic structures of compounds involving open d- and f- shell are studied frequently by X-ray and electron spectroscopies. The excitation, especially core excitation, is localized on a single site makes this the problem of impurity site states interacting with the continuum of bands. on the other hande, the electron-electron interaction whithin the d- or f- shell leads to a multiplet problem as addressed long ago for isolated atoms. Building on our easy to use program multiX (*), which treats an atom in a general crystal field environment without symmetry analysis, we now address the interaction of this atomic entity with the band continuum. The crossover from atomic to bandlike spectra is the focus of interest. We discuss experimental examples where available and accessible to our methods.
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Authors
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Bernard Delley
Paul Scherrer Inst
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Anne-Christine Uldry
Paul Scherrer Inst