* Error (Neighbor List) : "Collision of atoms 33 and 1276. Their distance is 4.10341e-06.
" : 205:kimpy/neighlist/neighbor_list.cpp
Traceback (most recent call last):
  File "/work2/08773/bwaters/stampede2/bwaters/job-e763e219-09c3-4c47-9525-07d9339d09c4-007-4a1da6e9-de4d-4b2d-94e9-a3145cc672ed/TE_614119825279_000-and-MO_612732924171_001-1680541657/staged_job_files/repository/td/EquilibriumCrystalStructure__TD_457028483760_000/util/aflow_util.py", line 267, in aflow_command
    return subprocess.check_output(cmd_str, shell=True, stderr=subprocess.PIPE,encoding="utf-8")
  File "/usr/lib/python3.8/subprocess.py", line 415, in check_output
    return run(*popenargs, stdout=PIPE, timeout=timeout, check=True,
  File "/usr/lib/python3.8/subprocess.py", line 516, in run
    raise CalledProcessError(retcode, process.args,
subprocess.CalledProcessError: Command 'aflow --np=1 --compare_materials -D compare --no_scale_volume --screen_only --quiet --print=json' returned non-zero exit status 50.

During handling of the above exception, another exception occurred:

Traceback (most recent call last):
  File "../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner", line 181, in <module>
    comparison=aflow.compare_materials_dir(COMPARE_DIR)
  File "/work2/08773/bwaters/stampede2/bwaters/job-e763e219-09c3-4c47-9525-07d9339d09c4-007-4a1da6e9-de4d-4b2d-94e9-a3145cc672ed/TE_614119825279_000-and-MO_612732924171_001-1680541657/staged_job_files/repository/td/EquilibriumCrystalStructure__TD_457028483760_000/util/aflow_util.py", line 309, in compare_materials_dir
    output=self.aflow_command([
  File "/work2/08773/bwaters/stampede2/bwaters/job-e763e219-09c3-4c47-9525-07d9339d09c4-007-4a1da6e9-de4d-4b2d-94e9-a3145cc672ed/TE_614119825279_000-and-MO_612732924171_001-1680541657/staged_job_files/repository/td/EquilibriumCrystalStructure__TD_457028483760_000/util/aflow_util.py", line 272, in aflow_command
    raise RuntimeError("ERROR: unexpected error from aflow command %s , error code = %d\nstderr: %s" % (cmd_str, exc.returncode, exc.stderr))
RuntimeError: ERROR: unexpected error from aflow command aflow --np=1 --compare_materials -D compare --no_scale_volume --screen_only --quiet --print=json , error code = 50
stderr: 
Command exited with non-zero status 1

{"realtime":162.10,"usertime":1058.99,"systime":4131.47,"memmax":137476,"memavg":0}