Input 03-helium_atom.01-ground_state.inp
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run foss_mpi_debug_autotools: [foss2023a-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 | -2.840451490000000e+00 | -2.840451490000000e+00 | 1.500000000000000e-07 | 0.000000000000000e+00 | PASS |