Input 01-quadratic_box.01-ground_state.inp
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss_debug_autotools: [foss2023a-serial]
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 |