• Title of article

    Beryllium decorated armchair boron nitride nanoribbon: A new planar tetracoordinate nitride containing system with enhanced conductivity

  • Author/Authors

    Xiao، نويسنده , , Bo and Yu، نويسنده , , Xuefang and Hu، نويسنده , , Hong and Ding، نويسنده , , Yihong، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2014
  • Pages
    7
  • From page
    277
  • To page
    283
  • Abstract
    In this Letter, a new kind of planar tetracoordinate nitride (ptN) structure is obtained via Be-decorated armchair boron nitride nanoribbon (aBNNR). The high stability of such a ptN system is confirmed by both global minimization and molecular dynamical simulation at 1500 K. The results suggest that this Be-decorated aBNNR will be a thermally stable material. The electronic property of aBNNR is significantly increased after the addition of Be atoms to the edges and the band gap decreases as the width of the ribbon decreases. Our Letter posits a new and potentially stable and useful BNNR and augments the literature on ptN.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2014
  • Journal title
    Chemical Physics Letters
  • Record number

    1936945