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kptbounds

Posted: Tue Feb 01, 2011 11:47 am
by sem
Dear friends,
I want to plot the band structure of graphene in the C2MM space group but I can not find the kptbounds
of graphene in this symmetry
my xred is 1/3 0 0
would U please help me ?
how can i calculate the kptbounds generally ?
thanks in advance .

Re: kptbounds

Posted: Tue Feb 01, 2011 1:03 pm
by jzwanzig
The web site http://www.cryst.ehu.es/ has very nice presentations of the Brillouin zones and special directions for the space groups. This information is also in books, like the big compendium by Bradley and Cracknell.