Input 12-electronic_subsystem_propagators.03-aetrs.inp
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run intel_autotools: [intel2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766759e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | 8.881784197001252e-15 | PASS |
Energy [step 20] | -1.060637197121569e+01 | -1.060637197121568e+01 | 1.060000000000000e-13 | -8.881784197001252e-15 | PASS |
Multipoles [step 0] | 2.688422299720623e-15 | 0.000000000000000e+00 | 5.000000000000000e-15 | 2.688422299720623e-15 | PASS |
Multipoles [step 20] | -1.265533510651992e-01 | -1.265533510652018e-01 | 3.540000000000000e-15 | 2.609024107869118e-15 | PASS |