[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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