/scratch/08773/bwaters/jobs/jobs/0fc49aa2-3127-4eca-92fb-e089b3a29a16-007/TE_484165392257_007-and-MO_330233188199_001-1755727809/staged_job_files/repository/te/LatticeConstantCubicEnergy_diamond_V__TE_484165392257_007/../../td/LatticeConstantCubicEnergy__TD_475411767977_007/runner:122: FutureWarning: Please use atoms.calc = calc atoms.set_calculator(calc) {"realtime":4.04,"usertime":1.78,"systime":0.48,"memmax":138300,"memavg":0}