Input 24-adsic_freeze_orbitals.01-gs.inp

Commits > Commit 0eb882d93dcc47f8554e98f5f256d6c6053dae9c > Run spack_foss-2023b_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