Mo中刃位错运动的分子动力学模拟OA
Molecular Dynamics Simulation of Edge Dislocation Motion in Mo
为探明Mo的变形机制,利用分子动力学对Mo中的刃位错运动行为展开模拟研究.通过改变模拟温度以及施加应力,系统研究温度以及应力对Mo中刃位错运动的影响.模拟结果表明,纯Mo中位错运动速度随着应力的增加而增加,在低应力下呈线性增长模式,随着应力升高,运动速度随应力的增幅减缓.控制刃位错运动的是声子拖拽机制,阻力系数随着温度的升高而升高,导致位错运动速度随着温度的升高而降低.
To investigate the deformation mechanism of Mo,molecular dynamics simulations were conducted to study the motion behavior of edge dislocations in Mo.By changing the simulated temperature and applying stress,the influence of temperature and stress on the movement of edge dislocations in Mo was systematically studied.The simulation results show that the velocity of dislocation motion in pure Mo increases with the increase of stress,showing a linear growth pattern at low stress.As the stress increases,the velocity of motion slows down with the increase of stress.The phonon drag mechanism controls the motion of edge dislocations,and the resistance coefficient increases with temperature,resulting in a decrease in dislocation velocity with increasing temperature.
龚芮
中国原子能科学研究院,北京 102413
矿业与冶金
分子动力学Mo刃位错声子拖拽机制
molecular dynamicsMoedge dislocationPhonon drag mechanism
《世界有色金属》 2026 (2)
217-219,3
联合基金(U2341260)中核集团(菁英人才)项目(FY212406000102).
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