[Wien] read error when using irrep
akara at ksu.edu
akara at ksu.edu
Tue Aug 26 15:50:01 CEST 2003
>
> You have to generate a new vector file with lapw1, based on your 30 new
> k-points.
>
> Best regards,
> Torsten Andersen.
Thanks for the reply. Yes I did one iteration (lapw1) with the new set,
which generates the new vector file.
A. Kara
>
> akara wrote:
> > Hi all,
> >
> > I have a case where I did the self-consistant calculation
> > using 8 k-points in parallel.
> >
> > Then I used 30k points along a high symmetry direction (not in parallel).
> > Before doing so, I cleaned the scratch directory (after doing save_lapw).
> >
> > When doing x irrep in my case directory, I got an error message
> > saying unit 10 (case.vector) not found.
> > I copied case.vector from the scratch to the case directory.
> > then I did: x irrep and this is what I got:
> >
> >
> > Input/Output Error 153: Input file ended
> >
> > In Procedure: kptin
> > At Line: 26
> >
> > Statement: Unformatted READ
> > Unit: 10
> > Connected To: 30cu211.vector
> > Form: Unformatted
> > Access: Sequential
> > Records Read : 3414
> > Records Written: 0
> >
> > End of diagnostics
> >
> >
> > Please help
> >
> >
> > Thank you very much
> >
> > A. Kara
> >
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> >
>
> --
> Dr. Torsten Andersen TA-web: http://deep.at/myspace/
> AG Hübner, Department of Physics, Kaiserslautern University, and
> Condensed Matter Theory Group, Department of Physics, Uppsala University
> Web: http://www.fysik4.fysik.uu.se/ http://www.physik.uni-kl.de/
>
>
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