• 文献标题:   Energetic and thermal properties of tilt grain boundaries in graphene/hexagonal boron nitride heterostructures
  • 文献类型:   Article, Proceedings Paper
  • 作  者:   WANG MC, ZHANG GP, PENG HS, YAN C
  • 作者关键词:   graphene, hexagonal boron nitride, heterostructure, tilt grain boundary, interfacial thermal conductance
  • 出版物名称:   FUNCTIONAL MATERIALS LETTERS
  • ISSN:   1793-6047 EI 1793-7213
  • 通讯作者地址:   Queensland Univ Technol
  • 被引频次:   3
  • DOI:   10.1142/S1793604715500381
  • 出版年:   2015

▎ 摘  要

Graphene/hexagonal boron nitride (G/h-BN) heterostructure has attracted tremendous research efforts owing to its great potential for applications in nanoscale electronic devices. In such hybrid materials, tilt grain boundaries (GBs) between graphene and h-BN grains may have unique physical properties, which have not been well understood. Here we have conducted non-equilibrium molecular dynamics simulations to study the energetic and thermal properties of tilt GBs in G/h-BN heterostructures. The effect of misorientation angles of tilt GBs on both GB energy and interfacial thermal conductance are investigated.