Input 04-oep.03-jellium-full_exx.inp
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run GCI_foss_autotools: [foss2022a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Total energy | -3.354830500000000e-01 | -3.354830800000000e-01 | 1.680000000000000e-07 | 2.999999998420932e-08 | PASS |
Exchange | -1.027130740000000e+00 | -1.027130860000000e+00 | 1.320000000000000e-07 | 1.199999999368373e-07 | PASS |
Eigenvalue 1 | -2.545870000000000e-01 | -2.545870000000000e-01 | 1.270000000000000e-05 | 0.000000000000000e+00 | PASS |
Eigenvalue 2 | -1.888670000000000e-01 | -1.888670000000000e-01 | 9.439999999999999e-06 | 0.000000000000000e+00 | PASS |