Input 16-dressed-rdmft.03-rdmft.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run foss-parallel-debug: [foss2023a-mpi]
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 | -8.889774551600000e-01 | -8.889465539750000e-01 | 8.700000000000000e-04 | -3.090118500004291e-05 | PASS |
dRDMFT total mode occupation | 8.324890962400000e-02 | 8.322159703800000e-02 | 2.200000000000000e-03 | 2.731258600000008e-05 | PASS |
dRDMFT highest occupation number | 1.922713569735000e+00 | 1.922992034259500e+00 | 1.400000000000000e-02 | -2.784645244999773e-04 | PASS |