[Pw_forum] Brillouin Zone for my supercell

Duy Le ttduyle at gmail.com
Thu Oct 28 19:28:59 CEST 2010


I doubt that QE has. Try Xcrysden.
--------------------------------------------------
Duy Le
PhD Student
Department of Physics
University of Central Florida.

"Men don't need hand to do things"


On Thu, Oct 28, 2010 at 1:22 PM, Elie Moujaes <elie.moujaes at hotmail.co.uk>wrote:

>  Dear All,
>
> I am working with a supercell of 60 Carbon atoms. I am trying to do scf and
> band structure calculations. Is there anything in QE that is used to draw
> the Brillouin zone for my supercell as I need to find the coordinates of the
> points that are intercepts with the walls of the Brillouin zone or maybe
> find coordinates of high symmetry points in the BZ? How can I get such
> information?
>
> Regards
>
> Elie Moujaes
> University of Nottingham
> BG7 2RD
>
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