Input 16-dressed-rdmft.03-rdmft.inp
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Run foss-serial-debug: [foss2023a-serial]
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 | -8.890066352800000e-01 | -8.889465539750000e-01 | 8.700000000000000e-04 | -6.008130500001485e-05 | PASS |
dRDMFT total mode occupation | 8.309036158499999e-02 | 8.322159703800000e-02 | 2.200000000000000e-03 | -1.312354530000059e-04 | PASS |
dRDMFT highest occupation number | 1.923795355315000e+00 | 1.922992034259500e+00 | 1.400000000000000e-02 | 8.033210555000725e-04 | PASS |