• 文献标题:   Interface engineering of electronic properties of graphene/boron nitride lateral heterostructures
  • 文献类型:   Article
  • 作  者:   ZHANG D, ZHANG DB, YANG FH, LIN HQ, XU HQ, CHANG K
  • 作者关键词:   heterostructure, interface electronic structure, graphene, hexagonal boron nitride
  • 出版物名称:   2D MATERIALS
  • ISSN:   2053-1583
  • 通讯作者地址:   Chinese Acad Sci
  • 被引频次:   18
  • DOI:   10.1088/2053-1583/2/4/041001
  • 出版年:   2015

▎ 摘  要

Heterostructures are often expected to be of enhanced electronic properties compared with homogeneous ones. Valuable experimental efforts have been devoted to the fabrication of graphene/hexagonal boron nitride (hBN) lateral heterostructures. It has been shown that abrupt interface between graphene and hBN could form in a controllable manner at the atomic scale. We thus investigate the electronic properties of such new hybrid structures by systematically considering possible interface configurations. Our results obtained with density-functional theorem reveal that interface has significant impact on electronic properties. Specifically, for heterostructures with a zigzag type of interface, electronic states are found to be spin-polarized, and a half-metallic phase is identified when the graphene domain is terminated with zigzag edges. For heterostructures with an armchair type of interface, electronic states display a robust semiconducting behavior. The novelty and diversity in electronic properties have implications for the design of new atomic devices in two dimensions based on lateral heterostructures.