• 文献标题:   Tunable electronic properties of graphene - fully hydrogenated boron nitride heterostructure: A van der Waals density functional study
  • 文献类型:   Article
  • 作  者:   ZHANG WX, DONG MM, LI TT, GONG JL, HE C
  • 作者关键词:   heterostructure, electronic propertie, density functional theory
  • 出版物名称:   SUPERLATTICES MICROSTRUCTURES
  • ISSN:   0749-6036
  • 通讯作者地址:   Xi An Jiao Tong Univ
  • 被引频次:   1
  • DOI:   10.1016/j.spmi.2017.03.051
  • 出版年:   2017

▎ 摘  要

The structural and electronic properties of Gr/BN and Gr/H-BN-H heterostructures have been systematically investigated on density functional theory with van der Waals corrections. The results indicate that the band gap of Gr/H-BN-H is about 0.024 eV (without an electric field) and 0.412 eV (with a strong electric field). Moreover, the increase of band gap of Gr/BN and Gr/H-BN-H heterostructures does not lead an obvious drop in their carrier mobility. Meanwhile, Gr/H-BN-H heterostructure has a larger tunable range of band gap and carrier mobility than Gr/BN heterostructure. These electronic properties highlight graphene/BN potential applications in nanodevices with low energy consumption. (C) 2017 Published by Elsevier Ltd.