[Pw_forum] Quantum ESPRESSO Output

[Ian Dunn]

Please revise the last question in my previous email to read:  "Also, are
the wave functions outputted here the Bloch eigenstates of the
noninteracting Schrodinger equation, or are they Kohn-Sham eigenstates?"
 Thanks!

Regards,
Ian Dunn
Columbia University

On Sun, Jun 19, 2016 at 6:23 PM Ian Dunn <iansdunn at gmail.com> wrote:

> To Whom It May Concern:
>
> For a generic band structure calculation, I'd like to know the
> eigenfunctions at several k points.  When I set wf_collect=.true. I believe
> this information is printed in the K* directories in the files evc.dat and
> gkvectors.dat.  Is there a manual anywhere on how to interpret these output
> files?  Also, are the wave functions outputted here the Bloch eigenstates
> of the many-body Schrodinger equation, or are they Kohn-Sham eigenstates?
> Thanks so much!
>
> Regards,
> Ian
>
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