Traceback (most recent call last): File "/work2/08773/bwaters/stampede2/bwaters/job-b0b431f5-b130-4f47-a981-81cf3e71de10-007-1ac9f9ec-71ce-4b42-bdec-0703cfa61d4b/VC_303890932454_005-and-MO_883726743759_002-1686590429/staged_job_files/repository/vc/DimerContinuityC1__VC_303890932454_005/runner", line 50, in File "/usr/local/lib/python3.8/dist-packages/ase/calculators/kim/__init__.py", line 2, in from .kim import KIM, get_model_supported_species File "/usr/local/lib/python3.8/dist-packages/ase/calculators/kim/kim.py", line 17, in from .calculators import ( File "/usr/local/lib/python3.8/dist-packages/ase/calculators/kim/calculators.py", line 9, in from .kimmodel import KIMModelCalculator File "/usr/local/lib/python3.8/dist-packages/ase/calculators/kim/kimmodel.py", line 16, in from . import neighborlist File "/usr/local/lib/python3.8/dist-packages/ase/calculators/kim/neighborlist.py", line 6, in from ase.neighborlist import neighbor_list File "/usr/local/lib/python3.8/dist-packages/ase/neighborlist.py", line 3, in from scipy import sparse as sp File "", line 1039, in _handle_fromlist File "/usr/local/lib/python3.8/dist-packages/scipy/__init__.py", line 200, in __getattr__ return _importlib.import_module(f'scipy.{name}') File "/usr/lib/python3.8/importlib/__init__.py", line 127, in import_module return _bootstrap._gcd_import(name[level:], package, level) File "/usr/local/lib/python3.8/dist-packages/scipy/sparse/__init__.py", line 283, in from . import csgraph File "/usr/local/lib/python3.8/dist-packages/scipy/sparse/csgraph/__init__.py", line 185, in from ._laplacian import laplacian File "/usr/local/lib/python3.8/dist-packages/scipy/sparse/csgraph/_laplacian.py", line 7, in from scipy.sparse.linalg import LinearOperator File "/usr/local/lib/python3.8/dist-packages/scipy/sparse/linalg/__init__.py", line 120, in from ._isolve import * File "/usr/local/lib/python3.8/dist-packages/scipy/sparse/linalg/_isolve/__init__.py", line 6, in from .lgmres import lgmres File "/usr/local/lib/python3.8/dist-packages/scipy/sparse/linalg/_isolve/lgmres.py", line 7, in from scipy.linalg import get_blas_funcs File "/usr/local/lib/python3.8/dist-packages/scipy/linalg/__init__.py", line 202, in from ._decomp_ldl import * File "", line 991, in _find_and_load File "", line 975, in _find_and_load_unlocked File "", line 671, in _load_unlocked File "", line 844, in exec_module File "", line 939, in get_code File "", line 1038, in get_data MemoryError Command exited with non-zero status 1 {"realtime":3.36,"usertime":6.36,"systime":19.78,"memmax":98216,"memavg":0}