[QE-users] a question on k-points

[Paolo Giannozzi]

No. For grids given as lists of k-points, symmetry-inequivalent points are
added, but symmetry-equivalent points are not removed.

Paolo

On Mon, Mar 26, 2018 at 4:43 PM, Yi Wang <wangwy13 at gmail.com> wrote:

> Hi,
>
> When doing SCF calculations, if I manually input a set of full grid
> k-points using the card "K_POINTS crystal" without any symmetry
> reduction, will pw.x automatically do the reduction with respect to the
> symmetry? (assuming nosym=.false.)
>
> Many thanks.
>
> Yi Wang
> Nanjing University of Science and Technology
>
> _______________________________________________
> users mailing list
> users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
>



-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20180326/2bfe5340/attachment.html>