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Re: [abinit-forum] unexpected states within the band gap


Chronological Thread 
  • From: Fabien Bruneval <fabien.bruneval@polytechnique.fr>
  • To: forum <forum@abinit.org>
  • Subject: Re: [abinit-forum] unexpected states within the band gap
  • Date: Tue, 23 May 2006 10:32:02 +0200

You are using the conventional cell: therefore, the Brillouin zone of the primitive cell gets folded.
The X point point of the primitive Brillouin zone is folded into the Gamma point of the conventional Brillouin zone.
Hope this helps.


Fabien



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