Effects of fission product doping on the structure, electronic structure, mechanical and thermodynamic properties of uranium monocarbide: A first-principles study

A first-principle approach within the framework of density functional theory was employed to study the effect of vacancy defects and fission products (FPs) doping on the mechanical, electronic, and thermodynamic properties of uranium monocarbide (UC). Firstly, the calculated vacancy formation energi...

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Bibliografische Detailangaben

Hauptverfasser:	Ru-Ting Liang, Tao Bo, Wan-Qiu Yin, Chang-Ming Nie, Lei Zhang, Zhi-Fang Chai, Wei-Qun Shi
Format:	Artigo
Sprache:	Inglês
Veröffentlicht:	Elsevier 2023-07-01
Schriftenreihe:	Nuclear Engineering and Technology
Schlagworte:	Uranium monocarbide Nuclear fuel Mechanical properties Thermodynamic properties First-principles
Online-Zugang:	http://www.sciencedirect.com/science/article/pii/S1738573323001638
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