OpenBLAS blas_thread_init: pthread_create failed for thread 34 of 64: Resource temporarily unavailable
OpenBLAS blas_thread_init: RLIMIT_NPROC 4096 current, 16384 max
Traceback (most recent call last):
  File "/work2/08773/bwaters/stampede2/bwaters/job-9b6013f4-edd3-4ea8-9a87-bd768beb3e00-007-c09ee65c-cace-4ed1-b395-aefddae68c35/TE_937519953396_000-and-SM_473463498269_000-1682975978/staged_job_files/repository/td/EquilibriumCrystalStructure__TD_457028483760_000/util/aflow_util.py", line 510, in build_atoms_from_prototype
    dataset=refine_symmetry(atoms)
  File "/usr/local/lib/python3.8/dist-packages/ase/spacegroup/symmetrize.py", line 41, in refine_symmetry
    dataset = check_symmetry(atoms, symprec, verbose=verbose)
  File "/usr/local/lib/python3.8/dist-packages/ase/spacegroup/symmetrize.py", line 93, in check_symmetry
    dataset = spglib.get_symmetry_dataset(atoms_to_spglib_cell(atoms),
  File "/usr/local/lib/python3.8/dist-packages/ase/utils/__init__.py", line 596, in atoms_to_spglib_cell
    atoms.get_scaled_positions(),
  File "/usr/local/lib/python3.8/dist-packages/ase/atoms.py", line 1858, in get_scaled_positions
    fractional = self.cell.scaled_positions(self.positions)
  File "/usr/local/lib/python3.8/dist-packages/ase/cell.py", line 258, in scaled_positions
    return np.linalg.solve(self.complete().T, np.transpose(positions)).T
  File "<__array_function__ internals>", line 200, in solve
  File "/usr/local/lib/python3.8/dist-packages/numpy/linalg/linalg.py", line 386, in solve
    r = gufunc(a, b, signature=signature, extobj=extobj)
KeyboardInterrupt

During handling of the above exception, another exception occurred:

Traceback (most recent call last):
  File "../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner", line 140, in <module>
    atoms = aflow.build_atoms_from_prototype(species,prototype_label,param_values_superlist[i])
  File "/work2/08773/bwaters/stampede2/bwaters/job-9b6013f4-edd3-4ea8-9a87-bd768beb3e00-007-c09ee65c-cace-4ed1-b395-aefddae68c35/TE_937519953396_000-and-SM_473463498269_000-1682975978/staged_job_files/repository/td/EquilibriumCrystalStructure__TD_457028483760_000/util/aflow_util.py", line 512, in build_atoms_from_prototype
    raise self.failedRefineSymmetryException("WARNING: Error while trying to refine symmetry of ASE atoms object")
util.aflow_util.failedRefineSymmetryException: WARNING: Error while trying to refine symmetry of ASE atoms object
Command exited with non-zero status 1

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