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Re: [abinit-forum] How to generate xred


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  • From: "Anglade Pierre-Matthieu" <anglade@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] How to generate xred
  • Date: Tue, 11 Sep 2007 10:25:28 +0200
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It depends:
- If you know (for instance) xcart, Abinit will generate xred for you
(look in the output).
- you can compute it by hand usually or with a small script
- if you have a complicate structure and you know the symmetries,
point group, etc, some softwares exist that generate the complete set
of coordinate.

regards

PMA

On 9/11/07, xd0533@163.com <xd0533@163.com> wrote:
> Dear users,
> How do you generate xred?Is there any software to generate it?
>
> xd
>


--
Pierre-Matthieu Anglade



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