First-principles study of the stability and diffusion properties of hydrogen in zirconium carbide

Journal of Nuclear Materials - Tập 479 - Trang 130-136 - 2016
Xiao-Yong Yang1, Yong Lu1,2, Ping Zhang1
1Institute of Applied Physics and Computational Mathematics, Beijing 100088, People's Republic of China
2Beijing Computational Science Research Center, Beijing 100084, People’s Republic of China

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