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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| Главный автор: | |
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| Формат: | Artículo |
| Язык: | en_US |
| Опубликовано: |
2021
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| Предметы: | |
| Online-ссылка: | https://doi.org/10.15174/au.2021.3214 https://www.actauniversitaria.ugto.mx/index.php/acta/article/view/3214 |
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