• 文献标题:   Mechanical deformation and fracture mode of polycrystalline graphene: Atomistic simulations
  • 文献类型:   Article
  • 作  者:   HAO F, FANG DN
  • 作者关键词:   polycrystalline graphene, molecular dynamic, buckling, fracture mode
  • 出版物名称:   PHYSICS LETTERS A
  • ISSN:   0375-9601 EI 1873-2429
  • 通讯作者地址:   Tsinghua Univ
  • 被引频次:   23
  • DOI:   10.1016/j.physleta.2012.04.040
  • 出版年:   2012

▎ 摘  要

Mechanics of polycrystalline graphene are studied through molecular dynamics simulations. Local buckling forms the ridge or funnel centering on pentagon, and fluctuating stress occurs under small tensile strain due to out-of-plane distortion. In addition, brittle breaking is initialized from heptagons and ends with fracture of pentagons. (C) 2012 Elsevier B.V. All rights reserved.