/usr/local/lib/python3.8/dist-packages/ase/atoms.py:966: VisibleDeprecationWarning: Use get_global_number_of_atoms() instead
  warnings.warn('Use get_global_number_of_atoms() instead',

{"realtime":37.02,"usertime":31.37,"systime":4.81,"memmax":345472,"memavg":0}