[Pw_forum] request help for gaas band structure

Davide Ceresoli ceresoli at MIT.EDU
Wed Nov 25 22:07:56 CET 2009


mohsen modaresi wrote:
> Dear Q.E users
> I try to plot GaAs band structure, I follow this procedure
> 1) I run pw.x with gaasspw.in <http://gaasspw.in>
It's always a good idea to look at your structure with XCrysden.
GaAs is diamond, not rock-salt. Also check your lattice spacing.


Davide




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