Input 19-qedft-breit-1d.01-etac-px.inp
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run intel_autotools: [intel2023a-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 | 1.113353330000000e+00 | 1.113353330000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Eigenvalues energy | 5.915798200000000e-01 | 5.915800000000000e-01 | 1.000000000000000e-04 | -1.800000000162782e-07 | PASS |
Photon exchange | 6.062648000000000e-01 | 6.062648000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |