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赵纪军
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教授   博士生导师   硕士生导师

任职 : 三束材料改性教育部重点实验室主任

性别: 男

毕业院校: 南京大学

学位: 博士

所在单位: 物理学院

学科: 凝聚态物理

电子邮箱: zhaojj@dlut.edu.cn

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Mechanical Properties and Defective Effects of 316LN Stainless Steel by First-Principles Simulations

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论文类型: 期刊论文

发表时间: 2011-11-01

发表刊物: JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY

收录刊物: Scopus、SCIE、EI、ISTIC、CSCD

卷号: 27

期号: 11

页面范围: 1029-1033

ISSN号: 1005-0302

关键字: Stainless steel; Mechanical properties; Vacancy; Interstitial

摘要: In current International Thermonuclear Experimental Reactor (ITER) design, the 316LN austenitic stainless steel (316LN SS) is used for first-wall/blanket structures. Thus, it is necessary to study the fundamental mechanical properties and irradiation effect of 316LN SS. A random solid solution model of Fe-Cr-Ni-Mn-Mo-Si alloy is used for describing 316LN SS. Using first-principles approaches, the elastic constants and ideal strength of the alloy were calculated. Such alloy exhibits good ductile behavior according to the theoretical values of Cauchy pressure and ratio of bulk modulus and shear modulus. Within the 256-atom supercell, inclusion of single vacancy defect further enhances the ductility of the alloy, and the existence of interstitial (Fe, H, He) atoms enhances the Young's modulus.

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