[Pw_forum] CRASH for bands.x calculation

lan haiping lanhaiping at gmail.com
Thu Jul 27 20:50:57 CEST 2006


Dear Andrea

my  version is 3.0.. I should then update it ..

Thank you

Regards,

Hai-Ping


On 7/21/06, Andrea Dal Corso <dalcorso at sissa.it> wrote:
>
> Which version of PW are you using? If it is 3.1 or later, please post
> your input files.
>
> Andrea
>
>
> Quoting lan haiping <lanhaiping at gmail.com>:
>
> > Hi, All.
> >
> >   I came to running crash for bands.x again, with CRASH information:
> >
> > *
> >
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> >      task #         0
> >      from punch_band : error #         5
> >       increase maxdeg
> >
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> > *
> > Would you please help me ? Any hints would be appreciated,
> >  The input file of bands.x is below :
> >
> > *&inputpp
> >    prefix      = "nt80"
> >    outdir      = "/home/haiping/tmp/"
> >    filband    = "bands.dat"
> > /
> > *
> > And no error occured when performing 'nscf' calculation .
> >
> > Regards.
> >
> > Hai-Ping
> >
>
>
>
>
>
>
>
> ----------------------------------------------------------------
> SISSA Webmail https://webmail.sissa.it/
> Powered by Horde http://www.horde.org/
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20060728/c8da70a8/attachment.html>


More information about the users mailing list