Input 24-adsic_freeze_orbitals.01-gs.inp

Commits > Commit bb686499811dbfe67b92ca3aeb5b2659998636fa > Run GCI_foss_debug_autotools: [foss2023a-serial]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Initial energy -1.977413220000000e+00 -1.977413220000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Compare to other inputs