[Wien] How to check band structure calculation progress

[zubaer]

Hi Xavier,
Thanks. I really appreciate the help.
Zubaer

On Fri, May 2, 2008 at 6:02 AM, Rocquefelte <Xavier.Rocquefelte at cnrs-imn.fr>
wrote:

>  Dear Zubaer,
>
> One very simple solution is first to check when the last file has been
> modified (ls -altr). Then check the case.output1 file which contains the
> data needed for spaghetti calculation.
> One way is to edit the file and another could be to do "grep K=
> *.output1". It will show you the number of K points for which the
> calculation has been done. Compare to your case.klist_band file in order to
> estimate the time needed to finish the calculation.
>
> Regards
>
> Xavier
>
>
> zubaer a écrit :
>
> Hi,
>
> I have been trying to calculate bandstructure of a 64-atom supercell. I am
> running calculation using w2web interface after I got the lattice parameters
> minimized.
>
> It's (x lapw1 -c -band) been running for 1 day. In my dayfile I dont see
> any info regarding this calculation progress. Is there any way to check the
> progress?
>
> Thanks,
> Zubaer
>
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