Input 01-quadratic_box.01-ground_state.inp
Commits >
Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 >
Run foss-cmake-zen4: [foss2023a-serial, foss-min]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Eigenvalue | 9.999209999999999e-01 | 9.999209999999999e-01 | 5.000000000000000e-05 | 0.000000000000000e+00 | PASS |
Occupation | 1.000000000000000e+00 | 1.000000000000000e+00 | 5.000000000000000e-05 | 0.000000000000000e+00 | PASS |