[Pw_forum] grid of spacing k-vectors

Eric Germaneau germaneau at gucas.ac.cn
Thu May 5 18:51:30 CEST 2011


Hey Duy Le,

Thank for your reply.
Actually I have the reciprocal vectors but don't know a how to sample 
the 1st Brillouin zone with.
Well, to me it's not that straightforward but if you have a small, 
simple code that can do that I would appreciate to get it.
Yours,

            Éric.

On 05/04/2011 10:37 PM, Duy Le wrote:
> If you can not find the equivalent mesh for a specific spacing, you
> just need to list all special k-points with their weight.
>
> And yes, you can always generate anything you want. A small, simple
> code will help you to do the job.
> --------------------------------------------------
> Duy Le
> PhD Student
> Department of Physics
> University of Central Florida.
>
> "Men don't need hand to do things"
>
>
>
> On Thu, May 5, 2011 at 10:14 AM, Eric Germaneau<germaneau at gucas.ac.cn>  wrote:
>> Dear all,
>>
>> I'm wondering whether it's possible to generate k-vectors for the Brillouin
>> sampling using
>> a grid of spacing instead of a number of vectors.
>> Thank you,
>>
>>                            Éric.
>>
>> --
>> Be the change you wish to see in the world
>> — Mahatma Gandhi —
>>
>> Dr. Éric Germaneau
>>
>> College of Physical Sciences
>> Graduate University of Chinese Academy of Sciences
>> Yuquan Road 19A
>> Beijing 100049
>> China
>>
>> Please, if possible, don't send me MS Word or PowerPoint attachments
>> Why? See: http://www.gnu.org/philosophy/no-word-attachments.html
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>>
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-- 
/Be the change you wish to see in the world
/ — Mahatma Gandhi —

Dr. Éric Germaneau <mailto:germaneau at gucas.ac.cn>

College of Physical Sciences
Graduate University of Chinese Academy of Sciences
Yuquan Road 19A
Beijing 100049
China

/Please, if possible, don't send me MS Word or PowerPoint attachments
Why? See: http://www.gnu.org/philosophy/no-word-attachments.html /

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