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$_4$

Fuente: arXiv

Saved in:

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
Tags:	Add Tag No Tags, Be the first to tag this record!

Internet

https://arxiv.org/abs/2310.09240