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

Commits > Commit b15abc005d0b5301cd748c91bbd98ee634ebaa25 > Run spack_intel-2023a_serial_omp

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
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