/anvil/scratch/x-bwaters/jobs/jobs/1a17addf-897c-46ab-b61e-f98e56670550-007/TE_942132986685_007-and-MO_657255834688_001-1752171405/staged_job_files/repository/te/LatticeConstantCubicEnergy_bcc_Ni__TE_942132986685_007/../../td/LatticeConstantCubicEnergy__TD_475411767977_007/runner:122: FutureWarning: Please use atoms.calc = calc atoms.set_calculator(calc) {"realtime":1.82,"usertime":1.94,"systime":0.70,"memmax":194880,"memavg":0}