Input 12-electronic_subsystem_propagators.02-expmid.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run intel-2022a_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205383e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.197442310920451e-14 PASS
Energy [step 20] -1.060645465229320e+01 -1.060645465229320e+01 5.300000000000000e-13 1.776356839400250e-15 PASS
Multipoles [step 0] 3.535882524274836e-16 6.744248104320451e-16 4.500000000000000e-15 -3.208365580045615e-16 PASS
Multipoles [step 20] -1.108552941390267e-01 -1.108552941390270e-01 5.540000000000000e-15 2.914335439641036e-16 PASS
Compare to other inputs