BAnd Dispersion of (3,0) carbon nanotube |
- Date: 2007/05/21 00:22
- Name: Jooya
<h_zolfaghari2001@yahoo.com>
- Dear all,
I am trying to calculate the Band Dispersion of a (3,0) nanotube with 2 unite cell (i.e. 24 Carbon atoms). The problem is that I just get some parallel energy lines in the final plot! I am confused how to set the following inputs to get the band dispersion correctly:
<Atoms. UnitVectors> <Band.KPath.UnitCell> Band.Nkpath <Band.kpath>
Thank you very much in advance for your kind help. H.Z.Jooya
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