Characterization of the mechanical properties of polyphenylene polymer using molecular dynamics simulations
作者： R. Ansari , S. Ajori , S. Rouhi
DOI: 10.1016/J.PHYSB.2015.10.029
关键词:
摘要: Abstract Synthesizing polyphenylene polymer, a two-dimensional hydrocarbon known as porous graphene, has led to the initiation of new age in nanoscience. In this investigation, molecular dynamics (MD) simulations are carried out study mechanical properties graphene such Young's modulus, Poisson's ratio, bulk modulus and ultimate strength strain. The fracture propagation pattern also considered study. results show that moduli lower than those graphyne. Unlikely, it is observed its ratio considerably more Furthermore, found well strain stress extremely size-dependent can be an isotropic material.
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