Theoretical study of the interaction between hydrogen and 4d alloying atom in nickel
Liu, WG; Qian, Y; Zhang, DX; Han, XB; Chu, XX; Zeng, YS; Bao, GL; Wang, GH; Wu, SW; Liu, W
2017
发表期刊NUCLEAR SCIENCE AND TECHNIQUES
ISSN2210-3147
卷号28期号:6页码:82
文章类型期刊论文
摘要In order to investigate the tritium behaviors in Hastelloy N alloy in molten salt reactor, first-principles calculations are used to study the interaction between hydrogen and 4d transition metal alloying atom in nickel-based alloy. The interaction energies between 4d elements and H are calculated. Atomic size effects and electron distribution effects are analyzed. The hydrogen-4d interactions are compared with the hydrogen-3d interactions calculated in our previous work.
关键词1st-principles Calculations
DOI10.1007/s41365-017-0235-6
关键词[WOS]1ST-PRINCIPLES CALCULATIONS
收录类别SCI
语种英语
引用统计
文献类型期刊论文
条目标识符http://ir.sinap.ac.cn/handle/331007/28873
专题中科院上海应用物理研究所2011-2018年
推荐引用方式
GB/T 7714
Liu, WG,Qian, Y,Zhang, DX,et al. Theoretical study of the interaction between hydrogen and 4d alloying atom in nickel[J]. NUCLEAR SCIENCE AND TECHNIQUES,2017,28(6):82.
APA Liu, WG.,Qian, Y.,Zhang, DX.,Han, XB.,Chu, XX.,...&Liu, W.(2017).Theoretical study of the interaction between hydrogen and 4d alloying atom in nickel.NUCLEAR SCIENCE AND TECHNIQUES,28(6),82.
MLA Liu, WG,et al."Theoretical study of the interaction between hydrogen and 4d alloying atom in nickel".NUCLEAR SCIENCE AND TECHNIQUES 28.6(2017):82.
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