[Wien] lapw0,error

Javad hashemifar jhashemifar at gmail.com
Fri Dec 22 08:21:26 CET 2006


After login to w2web, if you click on the "Execution" link at the left side,
you will see a "command line" option that could be used for running Linux
commands.
As far as I know, there is no limit in Wien2k for calculation of supercell
having less than 1000 atom and the only requirement for running big cases,
is enough memory (and likely proper installation of Wien2k)

Regards
Javad Hashemifar

On 12/22/06, sohusohuzu at sohu.com <sohusohuzu at sohu.com> wrote:
>
>  Thanks very much!I'm a beginner.I use w2web to login GUI ,and I don't now
> how to login command line mode from remote host.Could wien2k work well,if
> atom numbers in a cell over 200,
>
> 原文 -----
>
> From: Javad hashemifar
>
> To: A Mailing list for WIEN2k users
>
> Subject: Re: [Wien] lapw0,error
>
> Sent: Thu Dec 21 21:27:23 CST 2006
>
> > Hello
>
> > you could check the lapw0.error, case.output0, case.scf0 file to see
> what
>
> > happened. Moreover direct execution of the command "x lapw0" in command
>
> > terminal could be another opportunity to see what is the problem.
>
> >
>
> > Best regards
>
> > Javad Hashemifar
>
> >
>
> > On 12/19/06, sohusohuzu at sohu.com wrote:
>
> > >
>
> > > > Dear wien user:
>
> > >
>
> > > When I bengan to run SCF ,There would be an error show that "
>
> > >
>
> > > ** Error in Parallel lapw0
>
> > >
>
> > > ** lapw0 STOPPED at Tue Dec 19 19:57:12 CST 2006
>
> > >
>
> > > ** check ERROR FILES!
>
> > >
>
> > > What shoud I do an! d I should check which File?
>
> > >
>
> > > ------------------------------
>
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>
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> > >
>
> > >
>
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>
> > >
>
> > >
>
> > >
>
> >
>
> >
>
> > --
>
> > ======================================
>
> > Seyed Javad Hashemifar, Ph.D.
>
> > [current:]
>
> > Tel:+49-203-3794743 Fax:+49-203-3794742
>
> > Fachbereich Physik (AG Kratzer), Universitat Duisburg-Essen
>
> > 47048 Dusiburg, Germany
>
> > [permanent:]
>
> > Tel: +98-311-3912375 Fax: +98-311-3912376
>
> > Physics Department, Isfahan University of Technology
>
> > 84156 Isfahan, Iran
>
> >
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-- 
======================================
Seyed Javad  Hashemifar,    Ph.D.
[current:]
Tel:+49-203-3794743        Fax:+49-203-3794742
Fachbereich Physik (AG Kratzer), Universitat Duisburg-Essen
47048 Dusiburg, Germany
[permanent:]
Tel:  +98-311-3912375       Fax: +98-311-3912376
Physics Department, Isfahan University of Technology
84156 Isfahan, Iran
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