Input 12-electronic_subsystem_propagators.03-aetrs.inp
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_opt_autotools: [foss2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766759e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | 1.243449787580175e-14 | PASS |
Energy [step 20] | -1.060637197121568e+01 | -1.060637197121568e+01 | 1.060000000000000e-13 | -1.776356839400250e-15 | PASS |
Multipoles [step 0] | 1.116835871830743e-15 | 0.000000000000000e+00 | 5.000000000000000e-15 | 1.116835871830743e-15 | PASS |
Multipoles [step 20] | -1.265533510652006e-01 | -1.265533510652018e-01 | 3.540000000000000e-15 | 1.193489751472043e-15 | PASS |