[Pw_forum] Parity of electronic wave function
Paolo Giannozzi
paolo.giannozzi at uniud.it
Wed Apr 10 18:12:27 CEST 2013
bands.x should have a symmetry analyzer of electronic states.
The suffix "g" or "u" of the irreducible representation will
tell you the parity
P.
On Wed, 2013-04-10 at 10:29 +0530, koushik pal wrote:
> Dear PW users,
>
> Is it possible to determine the parity of each electronic band (or
> electronic wave function) in a given electronic band structure as
> calculated within the Quantum ESPRESSO?
>
> If possible, can somebody please tell me how to do it?
>
>
> Thanks in advance.
>
>
> With Regards,
>
> Koushik Pal
>
> MS student
> JNCASR
>
> Bangalore-560064
>
> India
>
>
>
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