Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Run foss-min-parallel: [foss2023b-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766762e+01 -1.060686608766760e+01 1.060000000000000e-13 -2.309263891220326e-14 PASS
Energy [step 20] -1.060637197121568e+01 -1.060637197121568e+01 1.060000000000000e-13 -1.776356839400250e-15 PASS
Multipoles [step 0] 2.593265446132475e-15 0.000000000000000e+00 5.000000000000000e-15 2.593265446132475e-15 PASS
Multipoles [step 20] -1.265533510652007e-01 -1.265533510652018e-01 3.540000000000000e-15 1.082467449009528e-15 PASS
Compare to other inputs