Input 16-dressed-rdmft.03-rdmft.inp
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run intel_omp_autotools: [intel2023a-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 | -8.889739965400000e-01 | -8.889465539750000e-01 | 8.700000000000000e-04 | -2.744256499997988e-05 | PASS |
dRDMFT total mode occupation | 8.315925513500000e-02 | 8.322159703800000e-02 | 2.200000000000000e-03 | -6.234190300000164e-05 | PASS |
dRDMFT highest occupation number | 1.923417104851000e+00 | 1.922992034259500e+00 | 1.400000000000000e-02 | 4.250705915000985e-04 | PASS |