Determination of Thermal Expansion, Defect Formation Energy, and Defect-Induced Strain of α-U Via ab Initio Molecular Dynamics

Uranium (U) is often alloyed with molybdenum (Mo) or zirconium (Zr) in order to stabilize its high-temperature body-centered cubic phase for use in nuclear reactors. However, in all metallic fuel forms, the α phase of U remains in some fraction. This phase decomposition due to temperature or composi...

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Bibliographic Details
Main Authors: Benjamin Beeler, Khadija Mahbuba, Yuhao Wang, Andrea Jokisaari
Format: Article
Language:English
Published: Frontiers Media S.A. 2021-06-01
Series:Frontiers in Materials
Subjects:
Online Access:https://www.frontiersin.org/articles/10.3389/fmats.2021.661387/full