ResearchBenchmarksElectronic structure evaluation time on ethanolElectronic structure evaluation time on ethanolFollow0.027Avg Wall-Clock Time (s)PhiSNet-0.83825.001910.84216.6821Jun 4, 2021Evaluation resultsMethodMethodLinksAvg Wall-Clock Time (s)SpeedupPhiSNetHardware=NVIDIA A100 G...Hardware=NVIDIA A100 GPU, Batch size=642021.060.027802DFTHardware=Intel Xeon E5...Hardware=Intel Xeon E5-2690 CPUs, Level of theory=PBE/def2-SVP, Software=ORCA 4.0.12021.0621.657—