/scratch.global/bwaters/jobs/46beda85-91e3-4c6e-b0be-db6e7ce1acfb-007/TE_431593503111_004-and-MO_803527979660_001-1750960633/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)
/scratch.global/bwaters/jobs/46beda85-91e3-4c6e-b0be-db6e7ce1acfb-007/TE_431593503111_004-and-MO_803527979660_001-1750960633/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":20.52,"usertime":18.39,"systime":7.86,"memmax":244932,"memavg":0}