[Pw_forum] Phonon dispersion

Sanjeev Gupta physics.skgupta at gmail.com
Thu Oct 3 18:20:13 CEST 2013


Hi

Use Xcrysden to generate the q-points.

thanks
sanjeev


On Thu, Oct 3, 2013 at 8:46 AM, Chukwuemeka Okoye <okoyecmi at yahoo.com>wrote:

> Dear Users,
>
> I need your assistance to enable me  generate the q-points along the path
> for say, a bcc structure,
> for use in calculating the phonon frequencies i.e  in matdyn.in: for
> example along the path
> Gamma - H - P - Gamma - N for bcc or  Gamma - X -  M - Gamma - R  for
> simple cubic
>
> Thanks.
>
> C M I Okoye
>
>
>
> =========
>
>
> Chukwuemeka M I Okoye
> Department of Physics and Astronomy,
> University of Nigeria,
> Nsukka.
> Enugu State,
> NIGERIA.
> Phone: +234-7038766990
> +234-8053310658
> E-mail: okoyecmi at yahoo.com, cmi.okoye at unn.edu.ng
>
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> Pw_forum mailing list
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>



-- 
With Best Regards,

------------------------------------
Dr. Sanjeev Kumar Gupta
Fulbright Post-Doctoral Scholar
Dept. of Physics
Michigan Technological University
1400 Townsend Drive, Houghton
MI 49931, USA
------------------------------------
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