On Wed, 2013-12-18 at 11:47 -0500, Noam Bernstein wrote: > Yes - I never characterized it fully, but we attached with gdb to every > single vasp running process, and all were stuck in the same > call to MPI_allreduce() every time. It's only happening on a rather large > jobs, so it's not the easiest setup to debug.
That sounds like one of the bugs i found i VASP. Could you send me the input data that triggers this (with info on how it was run, i.e. #mpi-tasks etc) and i can check if our heavily fixed version hits it. /Åke S.
