[QE-developers] sym_rho

[Lorenzo Paulatto]

You understand correctly. Note that you can apply symmetry before or after
computing the sum over k-points, it makes no difference.

Cheers

-- 
Lorenzo Paulatto

On Fri, 29 May 2020, 22:41 Duy Le, <ttduyle at gmail.com> wrote:

> Dear developers,
>
> I want to understand the usage of sym_rho. I believe that sym_rho is
> needed for for calculating rho using IBZ because of the different
> wave-function of equivalent k-points. Is it the only reason or did I
> understood it incorrectly?
>
> Thank you very much.
>
> Duy Le
> University of Central Florida
> _______________________________________________
> developers mailing list
> developers at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/developers
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/developers/attachments/20200530/fc64c267/attachment.html>