Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 > Run cmake_foss_2022a_min_mpi

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205381e+01 -1.060684240205380e+01 5.000000000000000e-13 -1.065814103640150e-14 PASS
Energy [step 20] -1.060634826182158e+01 -1.060634826182150e+01 5.000000000000000e-13 -8.171241461241152e-14 PASS
Multipoles [step 0] 4.317019154263454e-16 0.000000000000000e+00 5.000000000000000e-15 4.317019154263454e-16 PASS
Multipoles [step 20] -1.265537671052362e-01 -1.265537671052304e-01 5.000000000000000e-14 -5.856426454897701e-15 PASS
Compare to other inputs