ResearchBenchmarksSCF convergence on aspirinSCF convergence on aspirinFollow55.6Avg Iteration ReductionPhiSNet28.45635.50342.5549.597Jun 4, 2021Evaluation resultsMethodMethodLinksAvg Iteration ReductionAvg Time ReductionPhiSNetSCF algorithm=NRSCFSCF algorithm=NRSCF2021.0655.624.5PhiSNetSCF algorithm=DIISSCF algorithm=DIIS2021.0633.429.1PhiSNetSCF algorithm=SOSCFSCF algorithm=SOSCF2021.0629.524.8