• Title of article

    Resonance structures might correspond to excited states in polycyclic conjugated systems

  • Author/Authors

    Azami، نويسنده , , S.M. and Pooladi، نويسنده , , R. and Setoudeh، نويسنده , , N.، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2010
  • Pages
    3
  • From page
    20
  • To page
    22
  • Abstract
    Resonance structures are presented for four small carbon nanotubes (CNTs) in the context of quantum chemical concepts. The results show that there might exist Kekulé structures, which are apparent excited electronic states and may mislead a chemist as being contributed to the CNT ground state.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2010
  • Journal title
    Chemical Physics Letters
  • Record number

    1928993