/anvil/scratch/x-bwaters/jobs/jobs/bc1ec31f-5aa0-4bb4-857b-9f38bd848d42-007/TE_431593503111_004-and-MO_820335782779_001-1751997719/staged_job_files/repository/te/SurfaceEnergyCubicCrystalBrokenBondFit_bcc_Cr__TE_431593503111_004/../../td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner:125: FutureWarning: Please use atoms.calc = calc
  surf.set_calculator(calc)
/anvil/scratch/x-bwaters/jobs/jobs/bc1ec31f-5aa0-4bb4-857b-9f38bd848d42-007/TE_431593503111_004-and-MO_820335782779_001-1751997719/staged_job_files/repository/te/SurfaceEnergyCubicCrystalBrokenBondFit_bcc_Cr__TE_431593503111_004/../../td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner:128: FutureWarning: Please use len(self) or, if your atoms are distributed, self.get_global_number_of_atoms.
  num_atoms = surf.get_number_of_atoms()

{"realtime":29.09,"usertime":18.82,"systime":7.59,"memmax":309620,"memavg":0}