双相不锈钢中沉淀相平衡形貌及界面结构的原子尺度计算 - 金属学报.pdf

第50 卷 第9 期 Vol.50 No.9 2014 年9 月 第1123-1127页 ACTA METALLURGICA SINICA Sep. 2014 pp. 1123-1127 双相不锈钢中沉淀相平衡形貌及界面结构的 原子尺度计算* 戴付志 张文征 (清华大学材料学院先进材料教育部重点实验室, 北京 100084) 摘 要 根据实验测量的位向关系, 利用原子尺度计算研究了双相不锈钢中杆状奥氏体沉淀相的平衡截面形貌. 计算结果 显示: 沉淀相的平衡形貌含有2 个主要择优刻面, 且面积近似相等. 因此, 沉淀相计算截面形貌近似为菱形, 与实验观察形貌 基本吻合. 通过对计算结果的分析, 给出了主要择优刻面上的具体位错结构, 也与实验测量结果基本吻合. 关键词 形貌, 界面能, 界面结构, 原子模拟, 双相不锈钢 中图法分类号 TG 113.12, O77 文献标识码 A 文章编号 0412-1961(2014)09-1123-05 AN INVESTIGATION ON THE EQUILIBRIUM MOR- PHOLOGY AND INTERFACIAL STRUCTURES OF PRICIPITATES IN DUPLEX STAINLESS STEEL BY ATOMISTIC SIMULATION DAI Fuzhi, ZHANG Wenzheng Key Laboratory of Advanced Materials (MOE), School of Materials Science and Engineering, Tsinghua University, Beijing 100084 Correspondent: ZHANG Wenzheng, professor, Tel: (010) Fax: (010) E-mail: zhangwz@tsinghua.edu.cn Supported by National Natural Science Foundation of China (No Manuscript received 2014-04-21, in revised form 2014-05-20 ABSTRACT Assorted morphologies of precipitates in fcc/bcc transformation systems have been reported, which often exhibit irrational characteristic. Various models have been developed to explain the habit plane (or the broad facet), but the overall morphologies of the precipitates are seldom explained quantitatively. In this work, the equilibrium cross- section of rod- shape austenite precipitates in duplex s