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

Commits > Commit 1bf2bc61d0085049d6bd7294e2825d85d95584e0 > Run intel_mpi_autotools: [intel2023a-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 -8.889751875900000e-01 -8.889465539750000e-01 8.700000000000000e-04 -2.863361500005102e-05 PASS
dRDMFT total mode occupation 8.289105545800000e-02 8.322159703800000e-02 2.200000000000000e-03 -3.305415799999961e-04 PASS
dRDMFT highest occupation number 1.925049615260000e+00 1.922992034259500e+00 1.400000000000000e-02 2.057581000500130e-03 PASS
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