Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Run foss-min-parallel: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -2.842170943040401e-14 PASS
Energy [step 20] -1.060637197121568e+01 -1.060637197121568e+01 1.060000000000000e-13 -1.776356839400250e-15 PASS
Multipoles [step 0] -7.408878198444934e-16 0.000000000000000e+00 5.000000000000000e-15 -7.408878198444934e-16 PASS
Multipoles [step 20] -1.265533510652020e-01 -1.265533510652018e-01 3.540000000000000e-15 -1.665334536937735e-16 PASS
Compare to other inputs