Input 17-oep-photons.02-kli.inp
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-min-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 | -4.895830763000000e+01 | -4.895830759000000e+01 | 1.000000000000000e-04 | -4.000000330961484e-08 | PASS |
| Eigenvalue 1 | -5.756100000000000e+00 | -5.756100000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Eigenvalue 5 | -4.103160000000000e-01 | -4.103160000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Photon number | 1.197233040000000e-02 | 1.197232890000000e-02 | 1.000000000000000e-04 | 1.499999999210466e-09 | PASS |
| Photon exchange | 6.985600000000000e-03 | 6.985605740000000e-03 | 1.000000000000000e-04 | -5.740000000482859e-09 | PASS |