HOMO-LUMO gaps of armchair carbon nanotubes with Stone-Wales defect

Bibliographic Information

Other Title
  • Stone-Wales 欠陥をもつアームチェア炭素ナノチューブのHOMO-LUMOギャップのチューブ長依存性

Description

The HOMO-LUMO gaps in armchair carbon nanotubes with Stone-Wales defect were calculated with PM3 method. It was found that the HOMO-LUMO gaps in armchair carbon nanotubes with Stone-Wales defects in two different orientations show an oscillatory behavior with a period of 3 with the increase of the number of carbon layers along the tube axis.

Journal

Details 詳細情報について

  • CRID
    1390001205737904768
  • NII Article ID
    130005054566
  • DOI
    10.11545/ciqs.2011.0.p6.0
  • Data Source
    • JaLC
    • CiNii Articles
  • Abstract License Flag
    Disallowed

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