Input 12-electronic_subsystem_propagators.03-aetrs.inp
Commits >
Commit 18848dd43b1805cec78813204483223eec09e06c >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766763e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -3.197442310920451e-14 | PASS |
| Energy [step 20] | -1.060637197121569e+01 | -1.060637197121568e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
| Multipoles [step 0] | -9.533494599225229e-16 | 0.000000000000000e+00 | 5.000000000000000e-15 | -9.533494599225229e-16 | PASS |
| Multipoles [step 20] | -1.265533510652060e-01 | -1.265533510651940e-01 | 1.310000000000000e-14 | -1.196265309033606e-14 | PASS |