/scratch.global/bwaters/jobs/8eab5a09-94d5-4d8f-8836-68e76ec6fea7-007/VC_651200051721_002-and-SM_422015835006_000-1752171001/staged_job_files/repository/vc/SpeciesSupportedAsStated__VC_651200051721_002/runner:229: FutureWarning: Please use atoms.calc = calc
  atoms.set_calculator(calc)

{"realtime":23.42,"usertime":6.68,"systime":46.73,"memmax":188072,"memavg":0}