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Molecular dynamics simulation study of the effect of grain size on the deformation behavior of nanocrystalline body-centered cubic iron

机译:晶粒尺寸对纳米晶体心立方铁变形行为影响的分子动力学模拟研究

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摘要

A molecular dynamics simulation study has been carried out to clarify the effect of grain size on the deformation behavior of nanocrystalline body-centered cubic Fe. Average flow stresses were found to decrease with grain refinement below 14.7 nm, exhibiting a breakdown in the Hall-Petch relation. A change in the dominant deformation mechanism from dislocation glide to grain boundary sliding appeared to be the direct cause of the breakdown in the Hall-Petch relation observed in the present nanocrystalline pure Fe.
机译:已经进行了分子动力学模拟研究,以阐明晶粒尺寸对以纳米晶体为中心的立方铁的变形行为的影响。发现平均流动应力在14.7 nm以下随晶粒细化而降低,表现出Hall-Petch关系破裂。从位错滑移到晶界滑动的主要变形机制的变化似乎是导致在当前的纳米晶纯铁中霍尔-帕奇关系破裂的直接原因。

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