Hi!
I am trying to perform relaxation calculations in two different systems one containing 16 atoms another with 56 atoms in a cell. With the same set of parameters previously my calculations worked, but this time I am getting this error messages as follows -
for a 56 atom cell, 4 4 4 k-mesh, PAW pseudopotentials running in 480cores I am getting this message without any further errors but this:
Abort(13) on node 9 (rank 9 in comm 0): application called MPI_Abort(MPI_COMM_WORLD, 13) - process 9
similarly, in a 16 atom unit cell, 4 2 4 k-mesh, PAW pseudopotentials running in 120 cores I am getting this error message without any further errors but this:
Abort(13) on node 2 (rank 2 in comm 0): application called MPI_Abort(MPI_COMM_WORLD, 13) - process 2
I looked online, and the summary I have got is this because of the program I am using not the machine, but my understanding might not be correct. So, looking for suggestions.
Thanks