Input 12-electronic_subsystem_propagators.02-expmid.inp

Commits > Commit d6f4833c99197407842d58e82c91c418d3d73b88 > Run spack_intel-2023a_impi

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 8.881784197001252e-15 PASS
Multipoles [step 0] -1.395107906152285e-15 6.744248104320451e-16 4.500000000000000e-15 -2.069532716584330e-15 PASS
Multipoles [step 20] -1.108552941390272e-01 -1.108552941390270e-01 5.540000000000000e-15 -1.804112415015879e-16 PASS
Compare to other inputs