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MS-informed Misfit Approximation Model for the Interaction Energy Between Substitutional Atoms and Screw Dislocations in BCC Iron-Based Alloys

Zhen Liu,Yaolin Guo,Yifan Li,Nianxiang Qiu,Jingyu Zhang,Zheyu Hu,Zhenbo Peng,Ningru Sun,Muhammad Adnan,Xiaodong Wang,Yingjie Qiao,Shiyu Du

Computational Materials Science（2024）

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Key words
Misfit approximation model,BCC iron-based alloys,Screw kink structure,Molecular statics,Solute hardening
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