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Synergistic Effect of Hetero Interstitial Atoms (C/N/O) on the Thermodynamic Stability in BCC Fe: A DFT Study

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成果类型:
期刊论文
作者:
Wang, Fang*;Mi, Tengge;Chen, Pinghu;Zhu, Hongmei;Chen, Yong;...
通讯作者:
Wang, Fang;Qiu, CJ
作者机构:
[Chen, Pinghu; Mi, Tengge; Zhu, Hongmei; Wang, Fang; Chen, Yong; Qiu, Changjun] Univ South China, Coll Mech Engn, Sch Resource Environm & Safety Engn, Key Lab Hunan Prov Equipment Safety Serv Technol E, Hengyang 421001, Peoples R China.
[Zhang, Pengbo] Dalian Maritime Univ, Sch Phys, Dalian 116026, Peoples R China.
[Li, Ruiqing] Cent South Univ, Light Alloys Res Inst, Changsha 410083, Peoples R China.
通讯机构:
[Qiu, CJ ; Wang, F] U
Univ South China, Coll Mech Engn, Sch Resource Environm & Safety Engn, Key Lab Hunan Prov Equipment Safety Serv Technol E, Hengyang 421001, Peoples R China.
语种:
英文
关键词:
interstitial atoms;BCC Fe;stability;synergistic effect
期刊:
Coatings
ISSN:
2079-6412
年:
2025
卷:
15
期:
8
页码:
-
基金类别:
National Natural Science Foundation of China; [52375341]
机构署名:
本校为第一且通讯机构
院系归属:
机械工程学院
摘要:
Laser cladding rapid solidification technique is an effective strategy for manufacturing ultra-high-strength martensitic stainless steels (UHS-MSS). Due to super-saturation solution strengthening of interstitial atoms (IAs), martensitic stainless steels containing IAs exhibit excellent ultra-high strength and toughness and have high tolerance for oxygen impurities. Hence, studying the specific speciation and structural characteristics of IAs is of great significance for guiding laser cladding of ultra-high-strength steels. Herein, we use density functional theory (DFT) computations to analyze ...

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