Input 16-dressed-rdmft.03-rdmft.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_cmake: [foss2023a-mpi, foss-min-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 | -8.889808289300000e-01 | -8.889465539750000e-01 | 8.700000000000000e-04 | -3.427495499996880e-05 | PASS |
dRDMFT total mode occupation | 8.311878707799999e-02 | 8.322159703800000e-02 | 2.200000000000000e-03 | -1.028099600000054e-04 | PASS |
dRDMFT highest occupation number | 1.923439363488000e+00 | 1.922992034259500e+00 | 1.400000000000000e-02 | 4.473292285001040e-04 | PASS |