Defect formation mechanisms and point defect concentrations in the anion sublattice of uranium dioxide: molecular dynamics study

DOI10.4208/CICP.OA-2017-0190MaRDI QIDQ5161369zbMATH OpenOpenAlexFDO

Authors M. A. Kovalenko, A. Ya. Kupryazhkin, Sanjeev K. Gupta

Publication date 29 October 2021

Published in Communications in Computational Physics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.4208/cicp.oa-2017-0190

zbMATH Keywords

defect concentrationexchange diffusionlong-living anion Frenkel pairnon-stoichiometric crystalpoint defect modelsuperionic state

Mathematics Subject Classification ID

Molecular, statistical, and kinetic theories in solid mechanics (74A25) Micromechanical theories (74A60) Statistical mechanics of solids (82D20)

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Cited in

(2)

• Thermophysical properties of uranium dioxide: a molecular dynamics study of solid and liquid phases of stoichiometric UO₂
• Uranium mobility in face-centered cubic aluminium driven by interstitial migration

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