Input 01-propagators.03-etrs_taylor.inp
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.776356839400250e-15 | PASS |
| Energy [step 20] | -1.060637205318229e+01 | -1.060637205318229e+01 | 1.060000000000000e-13 | 0.000000000000000e+00 | PASS |
| Multipoles [step 0] | -3.510011190391033e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | -4.097994679193176e-15 | PASS |
| Multipoles [step 20] | -1.265536606512388e-01 | -1.265536606512456e-01 | 1.130000000000000e-14 | 6.800116025829084e-15 | PASS |
| Forces [step 0] | 8.537673799436396e-02 | 8.537673799434686e-02 | 2.170000000000000e-14 | 1.709743457922741e-14 | PASS |
| Forces [step 20] | 7.966960326026040e-02 | 7.966960326024397e-02 | 1.810000000000000e-14 | 1.643130076445232e-14 | PASS |