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


Chronological Thread 
  • From: "陆爱江" <ajlu@ustc.edu>
  • To: "forum" <forum@abinit.org>
  • Subject: Re: Re: [abinit-forum] unexpected states within the band gap
  • Date: Tue, 23 May 2006 17:08:52 +0800

Thank you very much. I've realized I confused something.

 

Reply From: ?????? <ajlu@ustc.edu>

> 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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