Input 16-dressed-rdmft.02-hf.inp

Commits > Commit 7ddcca10159cfd3a5f031627bc95daf6cfe3e221 > Run spack_foss-2022a_mpi

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-03 0.000000000000000e+00 PASS
dHF converged energy -7.805470438000000e-01 -7.805470438150000e-01 1.000000000000000e-08 1.500000124110556e-11 PASS
dHF highest occupation number 2.000000000000000e+00 2.000000000000000e+00 1.000000000000000e-08 0.000000000000000e+00 PASS
dHF total mode occupation 6.668976086900000e-02 6.669029538700000e-02 1.100000000000000e-06 -5.345180000004834e-07 PASS
Compare to other inputs