纳米金属材料宏观弹性模量的数值模拟研究.pdfVIP

Journal of Mechanical Strength 2007 ,29 ( 1) :016～020 纳米金属材料宏观弹性模量的数值模拟研究 COMPUTATIONAL SIMULATION OF THE ELASTIC MODUL US OF NANOCRYSTALLINE MATERIALS 邸玉贤 　计欣华 李林安 秦玉文 陈金龙 (天津大学 机械工程学院力学系 ,天津 300072) DI YuXian 　J I XinHua 　LI LinAn 　QIN YuWe 　CHEN JinLong ( Department of Mechanical Engineering , Tianjin University , Tianjin 300072 , China) 摘要 　将分子动力学模拟方法与连续体的有限元模拟技术相结合 ,进行“复合有限元”方法的探索与研究。首先 ,将纳 米金属材料看作由晶粒 、晶界、三叉晶界组成的复合材料 ,基体是具有不规则原子结构的界面相 ,夹杂是具有理想晶格的晶 粒相 ,用有限元源程序自动生成系统fepg 软件模拟材料的宏观弹性模量 ,并进一步调整晶粒尺寸 ,研究晶粒尺寸对材料宏 观弹性模量的影响。研究结果表明,随着晶粒尺寸的减小 ,晶界、孔洞等所占的体积比增大 ,材料的弹性模量也随之下降。 关键词 　纳米金属材料 　分子动力学 　有限元 　数值模拟 　弹性模量 中图分类号 　O313 Abstract 　The traditional finite element analysis method in conjunction with the atomic simulation technology was applied to study the mechanical properties of nanostructure materials. A phase mixture model in which nanocrystalline material is regarded as a mixture of crystalline phases and intercrystalline phases (grainboundary , triple line junction and quadratic node) is presented. The elastic modulus ( ) of nanocrystalline NC materials were simulated by means of finite element program automatic generate systemFEPG. The effects of grain size were investigated in the literature. With a decrease of grain size and a increase volume fraction of grain boundary and porosity , it was found that , the macro elastic modulus declined step by step. The calculated results were compared with previously published ex perimental data. Key words 　Nanophase metals ; Molecular dynamics ; Finite element method ; Numerical simula