Input 02-fock-darwin.04-ground_state.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
Eigenvalue 1 | 6.215340000000000e+00 | 6.215340000000000e+00 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
Eigenvalue 4 | 1.187556800000000e+01 | 1.187556800000000e+01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |