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Effect of Solute Elements (B, C, N, O) on Γ-Fe Σ5 (210)[001] Grain Boundary: a First-Principles Study

Ying Xu, Ya-nan Xu,Wei-gang Cao, Xin Meng,Fu-cheng Zhang, Xiao-mei Lv

Journal of Iron and Steel Research International(2025)

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关键词
First-principles calculation,Grain boundary,Solute effect,γ-Fe,Electronic evolution
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