[Pw_forum] Full k-points in Brillouin Zone (turning-off all symmetries)

[Ryky Nelson]

Hi Lorenzo,

thanks for the response!

Ryky Nelson
Institut für Anorganische Chemi
RWTH Aachen University

On Tue, Apr 19, 2016 at 10:59 AM, Lorenzo Paulatto <
lorenzo.paulatto at impmc.upmc.fr> wrote:

> On Tuesday, 19 April 2016 10:08:34 CEST Ryky Nelson wrote:
> > Hello QE users,
> >
> > I'm trying to do scf calculations with k-points in the full Brillouin
> Zone
> > (not the irreducible one), in other words I don't want the code to apply
> > any symmetries on my system. Could anyone tell me if the following setup
> on
> > the Namelist SYSTEM would sufficiently do the job?
> >
> > nosysm = .TRUE,
> > noinv = .TRUE.
> >
> > Thank you!
>
>
> Yes, that should do the trick.
> HTH
>
>
> --
> Dr. Lorenzo Paulatto
> IdR @ IMPMC -- CNRS & Université Paris 6
> +33 (0)1 44 275 084 / skype: paulatz
> http://www.impmc.upmc.fr/~paulatto/
> 23-24/4é16 Boîte courrier 115,
> 4 place Jussieu 75252 Paris Cédex 05
>
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