The construction of a photoabsorption spectrum using the FEFF 9 package: a detailed procedure

A procedure to obtain a photoabsorption spectrum assembled from first-principles calculations made with the FEFF 9 spectroscopy package is presented. The calculation consists of obtaining the absorption cross-section of electromagnetic radiation for each electronic shell of an atom inside a solid; t...

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Bibliographic Details
Main Author: Rivas Valles, Gildardo
Format: Artículo
Published: 2021
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