/scratch.global/bwaters/jobs/bdaa4859-ef59-403d-8066-18cbfbea7130-007/TE_839734634070_007-and-MO_675947402254_000-1750714998/staged_job_files/repository/te/LatticeConstantCubicEnergy_sc_Fe__TE_839734634070_007/../../td/LatticeConstantCubicEnergy__TD_475411767977_007/runner:122: FutureWarning: Please use atoms.calc = calc
  atoms.set_calculator(calc)

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