[Wien] lapw2 crashed error

[Laurence Marks]

When Fabien says "restart", he may mean "continue", i.e. use "-NI".
Probably only restart from scratch if nothing works.

N.B., I suggest in general look in all *.error files, the crash is probably
in lapw1 or similar.

On Mon, Nov 25, 2019 at 10:42 AM Tran, Fabien <fabien.tran at tuwien.ac.at>
wrote:

> Restart the calculation. Maybe then it works.
>
>
> ------------------------------
> *From:* Wien <wien-bounces at zeus.theochem.tuwien.ac.at> on behalf of
> Peeyush kumar kamlesh <peeyush.physik.rku at gmail.com>
> *Sent:* Monday, November 25, 2019 5:36 PM
> *To:* wien-request at zeus.theochem.tuwien.ac.at;
> wien at zeus.theochem.tuwien.ac.at
> *Subject:* [Wien] lapw2 crashed error
>
> Hello Wien2k user,
> Greetings!
> I am running scf cycle with hf potential. When I run the command "run_lapw
> -hf -p", then after successful completion of 7 cycles, I found error in
> cycle 8. In terminal it is represented as follows:
> ____________________________________________________
> in cycle 8    ETEST: .0004919150000000   CTEST: .0035867
> hup: Command not found.
>  LAPW0 END
>  LAPW0 END
>  LAPW1 END
>  LAPW1 END
>  LAPW1 END
>  LAPW1 END
> sed: Command not found.
> LAPW2 - Error. Check file lapw2.error
> cp: cannot stat '.in.tmp': No such file or directory
>
> >   stop error
>
> ------------------------------------------------------------------------------
>
> When I checked lapw2.error file I found following details:
> _____________________________________________________
> 'LAPW2' - can't open unit: 10
>
>  'LAPW2' -        filename: /case.vector
>
>  'LAPW2' -          status: unknown      form: unformatted
>
> **  testerror: Error in Parallel LAPW2
>
> ---------------------------------------------------------------------------------------
>
> I also tried to search and understand the previous threads, but I was
> unable to do so. Kindly suggest me why this error is appearing and how can
> it be resolved?
>
> Thanks and Regards
> Peeyush Kumar Kamlesh
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
>
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-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
Corrosion in 4D: www.numis.northwestern.edu/MURI
Co-Editor, Acta Cryst A
"Research is to see what everybody else has seen, and to think what nobody
else has thought"
Albert Szent-Gyorgi
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