[Pw_forum] May I get the occupation of the bands
wujianchun
jcwu.suda at hotmail.com
Tue Nov 10 15:16:14 CET 2009
Dear Gabriele Sclauzero and Lorenzo Paulatto,
Thank you for your kind help!
Regards
Jianchun
Department of physics
Soochow University, China
> Date: Tue, 10 Nov 2009 10:06:58 +0100
> From: sclauzer at sissa.it
> To: pw_forum at pwscf.org
> Subject: Re: [Pw_forum] May I get the occupation of the bands
>
> Dear Jianchun,
>
> wujianchun wrote:
> > Dear ,
> >
> > How can I get the information of the occupation of the bands in Pwscf?
>
> use verbosity='high' in the &control namelist
>
>
> Cheers
>
>
> GS
>
> >
> > In VASP, the "outcar" can give the "band No. ", " band energies" and
> > " occupation" simultaneously.
> > filband in Pwscf only gives the K pionts and energies.
> >
> > May I get the corresponding occupation of each bands?
> >
> > Thanks a lot!
> >
> > Regards
> > Jianchun
> > Department of physics
> > Soochow University, China
> >
> >
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> --
>
>
> o ------------------------------------------------ o
> | Gabriele Sclauzero, PhD Student |
> | c/o: SISSA & CNR-INFM Democritos, |
> | via Beirut 2-4, 34014 Trieste (Italy) |
> | email: sclauzer at sissa.it |
> | phone: +39 040 3787 511 |
> | skype: gurlonotturno |
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