Thermal conductivity and diffusion mechanisms of noble gases in uranium dioxide: A DFT+U study
Author:
Funder
Atomic Energy of Canada Limited
Publisher
Elsevier BV
Subject
Nuclear Energy and Engineering,General Materials Science,Nuclear and High Energy Physics
Reference79 articles.
1. Thermophysical properties of uranium dioxide;Fink;J. Nucl. Mater.,2000
2. Phonon density of states and anharmonicity of UO2;Pang;Phys. Rev. B,2014
3. What is the actual local crystalline structure of uranium dioxide, UO2? A new perspective for the most used nuclear fuel;Desgranges;Inorg. Chem.,2017
4. DFT+ U calculations of the ground state and metastable states of uranium dioxide;Dorado;Phys. Rev. B,2009
5. First principles calculation of the elastic constants and phonon modes of UO2 using GGA+ U with orbital occupancy control;Devey;J. Nucl. Mater.,2011
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1. Phonon Thermal Transport in UO2 via Self-Consistent Perturbation Theory;Physical Review Letters;2024-03-06
2. The initial oxidation behavior of a UCxN1-x layer prepared by the pulsed laser ablation in the 1:1 N2+CH4 atmosphere;Journal of Nuclear Materials;2023-10
3. The electronic and mechanical properties of (U, Th)O2 compounds: a first-principles study;RSC Advances;2023
4. First principles calculations of cohesive energy of fission-product-segregated grain boundary of UO2;Journal of Nuclear Materials;2022-08
5. Helium in uranium dioxide: Computer simulation (Review Article);Low Temperature Physics;2022-08
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