Theoretical analysis of uranium-doped thorium dioxide: Introduction of a thoria force field with explicit polarization

Thorium dioxide is used industrially in high temperature applications, but more insight is needed into the behavior of the material as part of a mixed-oxide (MOX) nuclear fuel, incorporating uranium. We have developed a new interatomic potential model including polarizability via a shell model, and...

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Bibliographic Details
Main Authors: A. E. Shields, S. E. Ruiz Hernandez, N. H. de Leeuw
Format: Article
Language:English
Published: AIP Publishing LLC 2015-08-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/1.4928438