/scratch/08773/bwaters/jobs/jobs/444e3f2b-cef9-46da-9e52-fa9303237522-007/TE_530002460811_006-and-MO_723456820410_006-1752097649/staged_job_files/repository/te/ElasticConstantsCubic_bcc_Ti__TE_530002460811_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/444e3f2b-cef9-46da-9e52-fa9303237522-007/TE_530002460811_006-and-MO_723456820410_006-1752097649/staged_job_files/repository/te/ElasticConstantsCubic_bcc_Ti__TE_530002460811_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":1.59,"usertime":3.52,"systime":2.73,"memmax":93432,"memavg":0}