CCL: ORCA and MPI
- From: Ramon Crehuet <rcsqtc%%iiqab.csic.es>
- Subject: CCL: ORCA and MPI
- Date: Thu, 13 Nov 2008 12:32:59 +0100
Sent to CCL by: Ramon Crehuet [rcsqtc^iiqab.csic.es]
Hi again...
I am trying to use Orca in parallel. I have a running version of MPI but
the program dies with:
mpirun: cannot start orca/orca_scf_mpi on n0 (o): No such file or directory
An error has occured in the SCF module
CALLING COMMAND: mpirun -np 4 orca/orca_scf_mpi Fuca-orca-mpi.gbw b
RETURN CODE : 512
ABORTING THE RUN
ABORTING THE RUN
Probably because orca_scf_mpi is not in the orca directory. It is
located in:
/usuaris/progs/programes/orca_amd64_exe/
This directory is in the path.
Should I rename it? Or how can I indicate to Orca where the MPI
executables are?
Thanks again,
Ramon