[Wien] A problem in a parallel execution of WIEN2k_8.1

[oyama]

Dear Peter,

I am running both k-point and mpi-parallel.
.machine file is below
--
1:xps01:2 xps02:2
1:xps03:2 xps04:2
1:xps05:2 xps06:2
1:xps07:2 xps08:2
granularity:1
--
I did not set "shared-memory machine" during siteconfig_lapw.
This is a cause of the incorrect compilation?

Thanks

Takashi





Peter Blaha wrote:
> 
> We need much more info.
> 
> Are you running "k-point parallel", or "mpi-parallel" or both together ?
> List your .machines file .
> Did you set "shared-memory machine" during siteconfig ?
> 
> Change the first line in lapw2para_lapw and add a  -xf (instead of -f) switch.
> This gives you lots of debugging info.
> 
> oyama schrieb:
> > Dear all:
> >
> > I have a problem in a parallel execution of lapw2. It looks like lapw0
> > and lapw1 were completed in parallel environment without any problem,
> > but when it proceeds to lapw2, it aborts with an error message:
> > --
> > LAPW2 - FERMI; weighs written
> > remotemachine: Undefined variable.
> > remotemachine: Undefined variable.
> > remotemachine: Undefined variable.
> > remotemachine: Undefined variable.
> > cp: cannot stat `.in.tmp': No such file or directory
> > rm: cannot remove `.in.tmp': No such file or directory
> > rm: cannot remove `.in.tmp1': No such file or directory
> > --
> >
> > I believe hardware and mpich are properly configured and in fact other
> > program run in parallel mode without any problem. So, I suppose the
> > problem is originated from failure of my compilation of wien2k or
> > setting parallel environment specific to wien2k.
> >
> > Any suggestion or comment is appreciated. Of course, a comment to
> > point what I need to examine further is also really appreciated.
> >
> > Thank you in advance.
> >
> > Yours sincerely,
> >
> > Takashi
> > _______________________________________________
> > Wien mailing list
> > Wien at zeus.theochem.tuwien.ac.at
> > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> 
> --
> 
>                                        P.Blaha
> --------------------------------------------------------------------------
> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
> Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
> Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
> --------------------------------------------------------------------------
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien

-- 
***********************************
尾山　貴司

株式会社村田製作所
研究開発センター解析センタ分析1課

〒520-2393
滋賀県野洲市大篠原2288
TEL077-586-8309
FAX077-587-6782
***********************************