/scratch.global/bwaters/jobs/87a73cbd-a464-4523-8830-cf63583f7e25-007/TE_180066487285_007-and-MO_675947402254_000-1750715006/staged_job_files/repository/te/LatticeConstantCubicEnergy_sc_Mn__TE_180066487285_007/../../td/LatticeConstantCubicEnergy__TD_475411767977_007/runner:122: FutureWarning: Please use atoms.calc = calc
  atoms.set_calculator(calc)

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