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Compound-tunable embedding potential method to model local electronic excitations on $f$-element ions in solids: Pilot relativistic coupled cluster study of Ce and Th impurities in yttrium orthophosphate, YPO$_4$

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Bibliographic Details
Main Authors:	Oleynichenko, Alexander V., Lomachuk, Yuriy V., Maltsev, Daniil A., Mosyagin, Nikolai S., Shakhova, Vera M., Zaitsevskii, Andrei, Titov, Anatoly V.
Format:	Preprint
Published:	2023
Subjects:	Materials Science Atomic and Molecular Clusters Chemical Physics Computational Physics
Online Access:	Acceder al recurso
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