• 文献标题:   The electronic and magnetic properties of corrugated zigzag graphene nanoribbons with divacancy defects
  • 文献类型:   Article
  • 作  者:   TAN XD, LIAO XP, SUN LT
  • 作者关键词:   zigzag graphene nanoribbon, vacancy defect, corrugation, first principle
  • 出版物名称:   PHYSICA ELOWDIMENSIONAL SYSTEMS NANOSTRUCTURES
  • ISSN:   1386-9477 EI 1873-1759
  • 通讯作者地址:   Southeast Univ
  • 被引频次:   4
  • DOI:   10.1016/j.physe.2016.09.009
  • 出版年:   2017

▎ 摘  要

We investigate the electronic and magnetic properties of the corrugated zigzag graphene nanoribbons (ZGNRs) with divacancy defects by means of the first principle calculations. We show that the magnitude of corrugation in the defective ZGNR determines whether the system is in the antiferromagnetic state, in the ferromagnetic state, or in the nonmagnetic state. Correspondingly, the mutual transition between the semiconductor and the metal can also be realized in this structure. Moreover, for semiconductors the energy gap displays oscillating behaviors as the magnitude of corrugation increases. These results are identified as being useful in manufacturing flexible devices.