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Anomalous ductile-brittle fracture behaviour in fcc crystals

机译:FCC晶体中的异常韧性-脆性断裂行为

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The fracture behaviour of fcc crystals has been investigated by numerically simulating the dynamical failure of a three-dimensional notched crystal using molecular dynamics, simple interatomic potentials for a rare-gas solid and system sizes of about ten million atoms. We find that the solid fails by brittle cleavage for cracking on a {110} face growing in a [110] direction and by ductile plasticity for cracking on a {111} face growing in a [110] direction. Comparison of equilibrium surface energies on the crack face and Schmid factors on the primary slip systems indicates that the classical theories of fracture give predictions in contradiction with the simulation results. A hyperelasticity model is proposed to explain this discrepancy. This anomalous fracture behaviour of fcc crystals has a profound implication on general modelling of dynamic failure of solids.
机译:fcc晶体的断裂行为已经通过使用分子动力学,稀有气体固体的简单原子间势和系统大小约为一千万个原子的数值模拟三维缺口晶体的动力学失效进行了研究。我们发现,固体通过在[110]方向上生长的{110}面上开裂的脆性断裂和在[110]方向上生长的{111}面上裂纹的延性可塑性而失效。比较裂纹表面上的平衡表面能和初级滑动系统上的Schmid因子,表明经典的断裂理论给出了与模拟结果相矛盾的预测。提出了一种超弹性模型来解释这种差异。 fcc晶体的这种异常断裂行为对固体动态破坏的一般建模具有深刻的意义。

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