• 文献标题:   Energetics and electronic structures of corrugated graphene nanoribbons
  • 文献类型:   Article
  • 作  者:   YONEYAMA K, YAMANAKA A, OKADA S
  • 作者关键词:  
  • 出版物名称:   JAPANESE JOURNAL OF APPLIED PHYSICS
  • ISSN:   0021-4922 EI 1347-4065
  • 通讯作者地址:   Univ Tsukuba
  • 被引频次:   1
  • DOI:   10.7567/JJAP.57.085101
  • 出版年:   2018

▎ 摘  要

On the basis of the density functional theory with the generalized gradient approximation, we investigated the energetics and electronic structure of graphene nanoribbons (GNRs) with structural corrugation in terms of their edge shape. Although the corrugation gradually increases, the corrugation energy remains constant under small corrugation angles for zigzag GNRs. In contrast, for armchair GNRs, the energy rapidly increases with increasing corrugation angle. The structural corrugation does not affect the local atomic structure of GNRs except that with armchair edges. The electronic structure of GNRs is insensitive to the structural corrugation up to the corrugation angle of 20 degrees for all GNRs. (C) 2018 The Japan Society of Applied Physics