First Principle Surface Analysis of YF<sub>3</sub> and Isostructural HoF<sub>3</sub>

The trifluorides of the two high field strength elements yttrium and holmium are studied by periodic density functional theory. As a lanthanide, holmium also belongs to the group of rare earth elements (REE). Due to their equivalent geochemical behavior, both elements form a geochemical twin pair an...

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Bibliographic Details
Main Authors: Jennifer Anders, Niklas Limberg, Beate Paulus
Format: Article
Language:English
Published: MDPI AG 2022-09-01
Series:Materials
Subjects:
Online Access:https://www.mdpi.com/1996-1944/15/17/6048