Input 05-pfft.01-gs.inp

Commits > Commit 567670ad21bfa0dcf9eec7f6790e7f8f129ccb1e > Run foss-2022a_omp

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Total energy -4.991684500000000e-01 -4.991953300000000e-01 1.000000000000000e-04 2.688000000000690e-05 PASS
Compare to other inputs