[Pw_forum] band decomposed pdos,

[Kapildeb Dolui]

Hi,

I would be greatful if you explain how to plot the band decomposed charge
density for each site and orbitals. I do not want to plot in continious
energy scale, rather I want plot the pdos (site and orbital) points on top
of the bandstructure, so that I can visualize (in the bandstructure) that
which atoms and orbital contribute to the bands, for example
http://link.aps.org/doi/10.1103/PhysRevB.88.085318

Thanks in advance,

Kapildeb Dolui
Dept. of Physics,
National University of Singapore

>
> ------------------------------
>
> Message: 13
> Date: Fri, 7 Nov 2014 02:48:30 -0200
> From: Julian Gamboa <laboratorio.superconductividad at gmail.com>
> Subject: Re: [Pw_forum] band decomposed pDOS
> To: PWSCF Forum <pw_forum at pwscf.org>
> Message-ID:
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> CAPn-4wkT9yAWn3yspHMGvx3cvmHt32r2aOLBRZWiZip2xQu7NQ at mail.gmail.com>
> Content-Type: text/plain; charset="utf-8"
>
> yes
>
> 2014-11-07 1:47 GMT-02:00 Kapildeb Dolui <doluik at tcd.ie>:
>
> > Dear PWscf user,
> >
> > Is it possible to plot  projected density of states (or wave function
> > character)  of each band (individually) on each orbital and sites ?
> >
> > Thanks in advance,
> >
> > Kapildeb Dolui,
> > Research Fellow,
> > National University Singapore.
> >
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://pwscf.org/mailman/listinfo/pw_forum
> >
>
>
>
> --
> ....Juli?n Ni?o....
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