Input 06-restart.02-restart_gs_mixrho.inp
Commits >
Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 4.320000000000000e-05 | 0.000000000000000e+00 | PASS |
Eigenvalue [up] | -1.554300000000000e-02 | -1.557300000000000e-02 | 3.300000000000000e-05 | 3.000000000000225e-05 | PASS |
Eigenvalue [dn] | -8.531999999999999e-02 | -8.534900000000001e-02 | 4.270000000000000e-05 | 2.900000000001512e-05 | PASS |