Input 16-dressed-rdmft.03-rdmft.inp
Commits >
Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 >
Run foss-cmake-zen4: [foss2023a-serial, foss-full]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-03 | 0.000000000000000e+00 | PASS |
dRDMFT converged energy | -8.890071248000000e-01 | -8.889465539750000e-01 | 8.700000000000000e-04 | -6.057082499999478e-05 | PASS |
dRDMFT total mode occupation | 8.308606749600000e-02 | 8.322159703800000e-02 | 2.200000000000000e-03 | -1.355295419999958e-04 | PASS |
dRDMFT highest occupation number | 1.923796932302000e+00 | 1.922992034259500e+00 | 1.400000000000000e-02 | 8.048980425001684e-04 | PASS |