Input 03-helium_atom.02-ground_state.inp
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.500000000000000e-07 | 0.000000000000000e+00 | PASS |
Total energy | -2.238251080000000e+00 | -2.238251080000000e+00 | 1.500000000000000e-07 | 0.000000000000000e+00 | PASS |