中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
Determining the capture efficiency of grain boundaries in bcc tungsten: the critical role of grain boundary characteristics

文献类型:期刊论文

作者Fan, Xinyue2,3; Jin, Shuo2,3; Hao JN(郝剑楠)1; Yuan, Yue2,3; Cheng, Long2,3; Li, YuHao2,3; Liang, Linyun2,3; Lu, GuangHong2,3
刊名JOURNAL OF NUCLEAR MATERIALS
出版日期2025-09-01
卷号615页码:14
关键词Lifetime Capture efficiency Sink strength Tungsten
ISSN号0022-3115
DOI10.1016/j.jnucmat.2025.155968
英文摘要

Capture efficiency is a key metric for evaluating the ability of grain boundaries (GBs) to absorb irradiation defects. However, the accurate description of capture efficiency and clarifying the influence of GB characteristics remains a formidable challenge. In this study, we systematically investigate the interaction of point defects (PDs) with different GBs in tungsten using molecular statistic/dynamic, elastic dipole tensor, and kinetic Monte Carlo methods. It is found that the formation energy and absorption range of PDs in high-angle GBs (HAGBs) is much higher than that in other GBs, implying the strong interaction strength of PDs with HAGBs. More importantly, we emphasize the significance of net strain field (total strain field minus absorption range), which shows a strong positive correlation with capture efficiency of GBs. Therefore, different from the interaction strength, the capture efficiency and sink strength of low-angle GBs (LAGBs) are much higher than that of HAGBs, which is in good agreement with the experiments. Besides, temperature and grain size show significant sensitivity in the capture efficiency for different GBs. The capture efficiency and sink strength of LAGBs are 3-4 times higher than that of HAGBs at 600 K, while this difference decreases to below 50 % at 1200 K. Additionally, the capture efficiency for a 10 nm grain size increases by approximately 0.3-1.2 times compared to 40 nm. These results not only explicitly clarify the influence of GB characteristics on the capture efficiency of GBs for PDs, and provide an important reference to the development of radiation-resistant materials.

分类号一类
WOS关键词KINETIC MONTE-CARLO ; IN-SITU ; NEUTRON-IRRADIATION ; RADIATION TOLERANCE ; DISLOCATION LOOP ; ION IRRADIATION ; POINT-DEFECTS ; PURE TUNGSTEN ; NANOCRYSTALLINE ; DAMAGE
资助项目National Natural Science Foundation of China[12075023] ; National Natural Science Foundation of China[12075021] ; National Natural Science Foundation of China[12275015]
WOS研究方向Materials Science ; Nuclear Science & Technology
语种英语
WOS记录号WOS:001514223500001
资助机构National Natural Science Foundation of China
其他责任者Li, Yu-Hao
源URL[http://dspace.imech.ac.cn/handle/311007/101898]  
专题力学研究所_非线性力学国家重点实验室
作者单位1.Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China
2.Beihang Univ, Beijing Key Lab Adv Nucl Mat & Phys, Beijing 100191, Peoples R China;
3.Beihang Univ, Sch Phys, Beijing 100191, Peoples R China;
推荐引用方式
GB/T 7714
Fan, Xinyue,Jin, Shuo,Hao JN,et al. Determining the capture efficiency of grain boundaries in bcc tungsten: the critical role of grain boundary characteristics[J]. JOURNAL OF NUCLEAR MATERIALS,2025,615:14.
APA Fan, Xinyue.,Jin, Shuo.,郝剑楠.,Yuan, Yue.,Cheng, Long.,...&Lu, GuangHong.(2025).Determining the capture efficiency of grain boundaries in bcc tungsten: the critical role of grain boundary characteristics.JOURNAL OF NUCLEAR MATERIALS,615,14.
MLA Fan, Xinyue,et al."Determining the capture efficiency of grain boundaries in bcc tungsten: the critical role of grain boundary characteristics".JOURNAL OF NUCLEAR MATERIALS 615(2025):14.

入库方式: OAI收割

来源:力学研究所

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