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It is demonstrated that stability criteria derived using elastic stiffness coefficients which govern stress-strain relations at finite deformation give quantitative predictions of crystal instability, as observed in direct molecular dynamics simulations. With the aid of such analysis we show that instabilities can be triggered in succession; as a consequence, the limit of metastability in the superheating of a defect-free crystal can be predicted.
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Jinghan Wang
Sidney Yip
Simon R. Phillpot
Physical Review Letters
Massachusetts Institute of Technology
Argonne National Laboratory
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Wang et al. (Mon,) studied this question.
www.synapsesocial.com/papers/69de11bd7ed287395e5584e8 — DOI: https://doi.org/10.1103/physrevlett.71.4182