Input 13-extsource-bessel.01-carbon-gs.inp
Commits >
Commit c1843387c3c25bf42356cee40f04165a0aff5f6f >
Run foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 4.000000000000000e-08 | 0.000000000000000e+00 | PASS |
| Initial energy | -5.392727800000000e+00 | -5.392727800000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |