/scratch/08773/bwaters/jobs/jobs/23ae0644-0630-4472-889a-4cf3deb1a63f-007/TE_295334088960_006-and-MO_330233188199_001-1755771881/staged_job_files/repository/te/ElasticConstantsCubic_bcc_V__TE_295334088960_006/../../td/ElasticConstantsCubic__TD_011862047401_006/runner:45: FutureWarning: Please use atoms.calc = calc self.slab.set_calculator(self.calculator) /scratch/08773/bwaters/jobs/jobs/23ae0644-0630-4472-889a-4cf3deb1a63f-007/TE_295334088960_006-and-MO_330233188199_001-1755771881/staged_job_files/repository/te/ElasticConstantsCubic_bcc_V__TE_295334088960_006/../../td/ElasticConstantsCubic__TD_011862047401_006/runner:119: DeprecationWarning: Conversion of an array with ndim > 0 to a scalar is deprecated, and will error in future. Ensure you extract a single element from your array before performing this operation. (Deprecated NumPy 1.25.) self.minscale = float( {"realtime":4.78,"usertime":2.60,"systime":1.88,"memmax":99792,"memavg":0}