Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run foss_mpi_omp_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766761e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
| Energy [step 20] | -1.060638479805072e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | 3.197442310920451e-14 | PASS |
| Multipoles [step 0] | 1.001070320388875e-15 | 0.000000000000000e+00 | 1.000000000000000e-14 | 1.001070320388875e-15 | PASS |
| Multipoles [step 20] | -1.269180738429632e-01 | -1.269180738429524e-01 | 1.300000000000000e-14 | -1.076916333886402e-14 | PASS |
| Forces [step 0] | 8.537673799432888e-02 | 8.537673799434686e-02 | 2.170000000000000e-14 | -1.798561299892754e-14 | PASS |
| Forces [step 20] | 7.982464236111841e-02 | 7.982464236114084e-02 | 2.470000000000000e-14 | -2.242650509742816e-14 | PASS |