• 文献标题:   The Electronic and Magnetic Properties and the Topological Phase Graphene Sheet with Fe, Co, Si, and Ge Impurities
  • 文献类型:   Article
  • 作  者:   KHEYRI A, NOURBAKHSH Z, DARABI E
  • 作者关键词:   density functional theory, graphene sheet, graphene sheet with impurity, topological metal, magnetic propertie
  • 出版物名称:   JOURNAL OF SUPERCONDUCTIVITY NOVEL MAGNETISM
  • ISSN:   1557-1939 EI 1557-1947
  • 通讯作者地址:   Univ Isfahan
  • 被引频次:   1
  • DOI:   10.1007/s10948-016-3401-x
  • 出版年:   2016

▎ 摘  要

The structural, electronic, and magnetic properties of pure graphene sheet and graphene sheet with Fe, Co, Si, and Ge impurities are investigated. The calculated results are done within density functional theory in the presence of spin-orbit coupling using the generalized gradient approximation. Electron density of states, band order, electron charge distribution, magnetic moment of these sheets, and the effect of pressure on the band order of graphene sheet with Fe impurity are investigated.