cp2k on SGI Altix ICE with mpt

Noam Bernstein no... at bollweevil.gdbg.org
Fri Jun 14 22:11:22 CEST 2013


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
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