ABINIT aborts linear response calculations

uma · Post by **uma** » Mon Mar 24, 2014 11:11 am

Dear ABINIT experts,

I am trying linear response calculations on an amorphous material with 108 atoms. The package gave MPI_Allreduce errors. In this forum, geomatteo recommended that I recompile the package without MPI_INPLACE. The cluster administrators kindly reconfigured the package(ABINIT-7.6.2) for me. But now I get the following message. The ABINIT package itself seems to abort the job. Could you help me with the solution? I have tried with 8, 60, 150 and 100 processors with a wall time of 24 hours. The job was best with 60 processors.

PSIlogger: Child with rank 62 exited with status 13.

application called MPI_Abort(MPI_COMM_WORLD, 13) - process 62Fatal error in MPI_
Allreduce: Other MPI error, error stack:
MPI_Allreduce(855).......: MPI_Allreduce(sbuf=0x6a96630, rbuf=0x6882010, count=6
84, MPI_DOUBLE_PRECISION, MPI_SUM, MPI_COMM_WORLD) failed
MPIR_Allreduce_impl(712).:
MPIR_Allreduce_intra(507):
mpid_irecv_done(98)......: read from socket failed - request state:recv(pde)done
MPIR_Allreduce_intra(442):

Sincerely,
Uma