Input 14-quadrupole-pot.01-hydrogen-gs.inp

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Run foss_min_autotools: [foss2023b-serial]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 4.000000000000000e-08 0.000000000000000e+00 PASS
Total energy -4.906136200000000e-01 -4.906136200000000e-01 2.450000000000000e-07 0.000000000000000e+00 PASS
Eigenvalue 1 -4.906140000000000e-01 -4.906140000000000e-01 2.450000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 2 -3.936400000000000e-02 -3.936400000000000e-02 1.970000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 3 -3.936400000000000e-02 -3.936400000000000e-02 1.970000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 4 5.740000000000000e-04 5.740000000000000e-04 2.870000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 5 3.974500000000000e-02 3.974500000000000e-02 1.990000000000000e-05 0.000000000000000e+00 PASS
Compare to other inputs