Input 20-qedft-breit-2d.01-etac-px.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Total Energy | 2.998474440000000e+00 | 2.998474443000000e+00 | 1.000000000000000e-04 | -3.000000248221113e-09 | PASS |
| Eigenvalues energy | 2.998400510000000e+00 | 2.998401000000000e+00 | 1.000000000000000e-04 | -4.899999996865745e-07 | PASS |
| Photon exchange | 5.206000000000000e-05 | 5.206000000000000e-05 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |