--------------------------------------------------------------------------
By default, for Open MPI 4.0 and later, infiniband ports on a device
are not used by default.  The intent is to use UCX for these devices.
You can override this policy by setting the btl_openib_allow_ib MCA parameter
to true.

  Local host:              pd-compute-3-34
  Local adapter:           qib0
  Local port:              1

--------------------------------------------------------------------------
--------------------------------------------------------------------------
WARNING: There was an error initializing an OpenFabrics device.

  Local host:   pd-compute-3-34
  Local device: qib0
--------------------------------------------------------------------------
[pd-compute-3-34.local:27923] [[22056,0],0] ORTE_ERROR_LOG: Data unpack would read past end of buffer in file util/show_help.c at line 507
[pd-compute-3-34.local:27923] [[22056,0],0] ORTE_ERROR_LOG: Data unpack would read past end of buffer in file util/show_help.c at line 507
--------------------------------------------------------------------------
By default, for Open MPI 4.0 and later, infiniband ports on a device
are not used by default.  The intent is to use UCX for these devices.
You can override this policy by setting the btl_openib_allow_ib MCA parameter
to true.

  Local host:              pd-compute-3-34
  Local adapter:           qib0
  Local port:              1

--------------------------------------------------------------------------
--------------------------------------------------------------------------
WARNING: There was an error initializing an OpenFabrics device.

  Local host:   pd-compute-3-34
  Local device: qib0
--------------------------------------------------------------------------
Traceback (most recent call last):
  File "../../td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_003/runner", line 101, in <module>
    thetas, relaxed_energies, minimum_distances, sigmas = compute_gb_tilt_energy(
  File "/scratch.hyperion/kim-jobs/jobs/bwaters/job-638594f0-e5af-4ad0-8dd9-9258c7a8c9fc-007-e78e03bb-4649-4928-b2d0-56d8119902ee/TE_317621478872_001-and-MO_677715648236_000-1666135234/staged_job_files/repository/td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_003/compute_gb_tilt_energy.py", line 473, in compute_gb_tilt_energy
    raise RuntimeError(
RuntimeError: Error: LAMMPS did not generate a dump file -- something probably went wrong.
Command exited with non-zero status 1

{"realtime":3.90,"usertime":0.83,"systime":1.33,"memmax":40568,"memavg":0}