/anvil/scratch/x-bwaters/jobs/jobs/ad656bbd-7b68-4147-8441-160a8fac0a64-007/VC_710586816390_003-and-MO_993644691224_001-1751905670/staged_job_files/repository/vc/ForcesNumerDeriv__VC_710586816390_003/runner:395: FutureWarning: Please use atoms.calc = calc
  atoms.set_calculator(calc)
/anvil/scratch/x-bwaters/jobs/jobs/ad656bbd-7b68-4147-8441-160a8fac0a64-007/VC_710586816390_003-and-MO_993644691224_001-1751905670/staged_job_files/repository/vc/ForcesNumerDeriv__VC_710586816390_003/runner:441: FutureWarning: Please use atoms.calc = calc
  atoms.set_calculator(calc)

{"realtime":6.81,"usertime":6.63,"systime":1.13,"memmax":110388,"memavg":0}