[CP2K:4459] cp2k on SGI Altix ICE with mpt
no... at bollweevil.gdbg.org
Mon Jun 17 21:59:09 CEST 2013
Thanks Alin. Unfortunately it looks a lot like my arch file, so there's no
change for me to try. I wonder if they introduced a bug (I have access to
mpt 2.06 and 2.07),
or maybe it's a different code path. I've definitely had long CP2K runs on
this machine that
didn't crash this way.
On Sat, Jun 15, 2013 at 11:21 AM, Alin M Elena <alinm... at gmail.com>wrote:
> Hi Noam,
> I have been using it in the past...
> As far as I remember --- I did not manage to track
> down yet one of the arch files I used --- I have never
> had problems with mpt...
> All I had to do special was the way in which I run it...
> MPI_GROUP_MAX=256 mpiexec_mpt $cp2k
> water.inp > water.out
> I will keep digging for an arch file and let you know if
> I find anything.
> On Friday 14 Jun 2013 16:11:22 Noam Bernstein
> > Hi - is anyone running CP2K on and SGI Altix ICE
> with mpt, SGI's MPI? I
> > thought it was OK, but some of my QM/MM jobs are
> dying after a few hours
> > with an error related to an assertion in
> MPI_SGI_release_context_bit. The
> > stack trace isn't saying anything about where in
> cp2k it's failing. I know
> > it's a long shot, but if anyone happens to have it
> running on such a
> > machine, I'd be interested to know what Makefile
> you're using, and what
> > mpi/compiler version.
> > thanks,
> > Noam
> Without Questions there are no Answers!
> Alin Marin ELENA
> Advanced Molecular Simulation Research Laboratory
> School of Physics, University College Dublin
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