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Publication Citation: Scheme to Calculate Core Hole-Electron Interactions in Solids

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Author(s): J A. Soininen; Eric L. Shirley;
Title: Scheme to Calculate Core Hole-Electron Interactions in Solids
Published: October 01, 2001
Abstract: We present a first-principles scheme for calculating a core-hole potential for core electron excitations. The scheme incorporates atomic and solid-state screening in the description of core excitations in several materials.We compare the results calculated using our scheme to experimental x-ray absorption and inelastic scattering spectra.
Citation: Physical Review B (Condensed Matter and Materials Physics)
Volume: 64
Issue: No. 16
Keywords: absorption;atomic screening;core hole;first-principles;scattering;screening;solid-state screening;x-ray
Research Areas:
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