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

Commits > Commit f4bc596bdcf3afff33b833944576bfd5457df1bc > Run foss_cmake: [foss2023a-mpi, foss-full-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 -8.889775384400000e-01 -8.889465539750000e-01 8.700000000000000e-04 -3.098446500005014e-05 PASS
dRDMFT total mode occupation 8.308903250800000e-02 8.322159703800000e-02 2.200000000000000e-03 -1.325645300000039e-04 PASS
dRDMFT highest occupation number 1.923988947212000e+00 1.922992034259500e+00 1.400000000000000e-02 9.969129525000398e-04 PASS
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