/usr/local/lib/python3.8/dist-packages/ase/atoms.py:504: VisibleDeprecationWarning: Creating an ndarray from ragged nested sequences (which is a list-or-tuple of lists-or-tuples-or ndarrays with different lengths or shapes) is deprecated. If you meant to do this, you must specify 'dtype=object' when creating the ndarray.
  a = np.asarray(a)
/scratch.hyperion/kim-jobs/jobs/bwaters/job-bd174f98-b805-4d30-83c8-fbab27d61d68-007-37b6eaa3-d258-40dc-aff2-8d664b0b2ef0/VC_303890932454_004-and-MO_019208265157_000-1658805615/staged_job_files/repository/vc/DimerContinuityC1__VC_303890932454_004/runner:596: DeprecationWarning: np.asscalar(a) is deprecated since NumPy v1.16, use a.item() instead
  nth[n], np.asscalar(val), yesno[is_continuous]
/scratch.hyperion/kim-jobs/jobs/bwaters/job-bd174f98-b805-4d30-83c8-fbab27d61d68-007-37b6eaa3-d258-40dc-aff2-8d664b0b2ef0/VC_303890932454_004-and-MO_019208265157_000-1658805615/staged_job_files/repository/vc/DimerContinuityC1__VC_303890932454_004/runner:596: DeprecationWarning: np.asscalar(a) is deprecated since NumPy v1.16, use a.item() instead
  nth[n], np.asscalar(val), yesno[is_continuous]
/scratch.hyperion/kim-jobs/jobs/bwaters/job-bd174f98-b805-4d30-83c8-fbab27d61d68-007-37b6eaa3-d258-40dc-aff2-8d664b0b2ef0/VC_303890932454_004-and-MO_019208265157_000-1658805615/staged_job_files/repository/vc/DimerContinuityC1__VC_303890932454_004/runner:596: DeprecationWarning: np.asscalar(a) is deprecated since NumPy v1.16, use a.item() instead
  nth[n], np.asscalar(val), yesno[is_continuous]
/scratch.hyperion/kim-jobs/jobs/bwaters/job-bd174f98-b805-4d30-83c8-fbab27d61d68-007-37b6eaa3-d258-40dc-aff2-8d664b0b2ef0/VC_303890932454_004-and-MO_019208265157_000-1658805615/staged_job_files/repository/vc/DimerContinuityC1__VC_303890932454_004/runner:596: DeprecationWarning: np.asscalar(a) is deprecated since NumPy v1.16, use a.item() instead
  nth[n], np.asscalar(val), yesno[is_continuous]
/scratch.hyperion/kim-jobs/jobs/bwaters/job-bd174f98-b805-4d30-83c8-fbab27d61d68-007-37b6eaa3-d258-40dc-aff2-8d664b0b2ef0/VC_303890932454_004-and-MO_019208265157_000-1658805615/staged_job_files/repository/vc/DimerContinuityC1__VC_303890932454_004/runner:677: DeprecationWarning: np.asscalar(a) is deprecated since NumPy v1.16, use a.item() instead
  e.append(np.asscalar(val))

{"realtime":19.82,"usertime":18.46,"systime":2.75,"memmax":86744,"memavg":0}