Input 16-dressed-rdmft.03-rdmft.inp

Commits > Commit 235dfa244e23366de619648bda83df5634b8df23 > Run foss-cmake-zen4: [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 -8.889785857400000e-01 -8.889465539750000e-01 8.700000000000000e-04 -3.203176499999572e-05 PASS
dRDMFT total mode occupation 8.317742135099999e-02 8.322159703800000e-02 2.200000000000000e-03 -4.417568700000596e-05 PASS
dRDMFT highest occupation number 1.923056905163000e+00 1.922992034259500e+00 1.400000000000000e-02 6.487090350004721e-05 PASS
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