Input 12-electronic_subsystem_propagators.02-expmid.inp

Commits > Commit 6186e1f92bb6a84e4a2e679736ea9db4d0c9eca5 > Run spack_foss-2023a_mpi_opt

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205382e+01 -1.060684240205380e+01 5.300000000000000e-14 -2.131628207280301e-14 PASS
Energy [step 20] -1.060645465229319e+01 -1.060645465229320e+01 5.300000000000000e-13 1.421085471520200e-14 PASS
Multipoles [step 0] 2.444677761007791e-16 6.744248104320451e-16 4.500000000000000e-15 -4.299570343312660e-16 PASS
Multipoles [step 20] -1.108552941390265e-01 -1.108552941390270e-01 5.540000000000000e-15 4.579669976578771e-16 PASS
Compare to other inputs