Input 12-electronic_subsystem_propagators.03-aetrs.inp
Commits >
Commit fb3b67f6830f0e047754886f078a46875acffbf8 >
Run foss-serial-debug: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766759e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 20] | -1.060637197121569e+01 | -1.060637197121568e+01 | 1.060000000000000e-13 | -1.065814103640150e-14 | PASS |
| Multipoles [step 0] | 2.621652284910507e-15 | 0.000000000000000e+00 | 5.000000000000000e-15 | 2.621652284910507e-15 | PASS |
| Multipoles [step 20] | -1.265533510651999e-01 | -1.265533510652042e-01 | 5.070000000000000e-15 | 4.329869796038111e-15 | PASS |