/anvil/scratch/x-bwaters/jobs/jobs/d0b01671-e41e-49c3-b963-8ffd8d0729e4-007/TE_547110175880_007-and-MO_574574915905_001-1752181341/staged_job_files/repository/te/LatticeConstantCubicEnergy_diamond_Mg__TE_547110175880_007/../../td/LatticeConstantCubicEnergy__TD_475411767977_007/runner:122: FutureWarning: Please use atoms.calc = calc
  atoms.set_calculator(calc)

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