Describing bond-breaking processes by reactive potentials: Importance of an environment-dependent interaction range
作者： Lars Pastewka , Pablo Pou , Rubén Pérez , Peter Gumbsch , Michael Moseler
DOI: 10.1103/PHYSREVB.78.161402
关键词:
摘要: … While these models provide a faithful description of material properties near equilibrium, the … and low-temperature experiments predict brittle fracture. (c) Diamond transforms to graphite …
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