Input 16-dressed-rdmft.03-rdmft.inp
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run foss_cmake: [foss2022a-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 | -8.889598885700000e-01 | -8.889465539750000e-01 | 8.700000000000000e-04 | -1.333459499996970e-05 | PASS |
dRDMFT total mode occupation | 8.334603069800001e-02 | 8.322159703800000e-02 | 2.200000000000000e-03 | 1.244336600000062e-04 | PASS |
dRDMFT highest occupation number | 1.922409063260000e+00 | 1.922992034259500e+00 | 1.400000000000000e-02 | -5.829709994999988e-04 | PASS |