Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run foss-cmake-zen4: [foss2023a-serial, foss-min]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766759e+01 | -1.060686608766761e+01 | 1.060000000000000e-13 | 1.598721155460225e-14 | PASS |
| Energy [step 20] | -1.060638479805077e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | -2.309263891220326e-14 | PASS |
| Multipoles [step 0] | 2.481417964172745e-15 | 0.000000000000000e+00 | 1.000000000000000e-14 | 2.481417964172745e-15 | PASS |
| Multipoles [step 20] | -1.269180738429406e-01 | -1.269180738429524e-01 | 1.300000000000000e-14 | 1.176836406102666e-14 | PASS |
| Forces [step 0] | 8.537673799436662e-02 | 8.537673799434686e-02 | 2.170000000000000e-14 | 1.976196983832779e-14 | PASS |
| Forces [step 20] | 7.982464236116238e-02 | 7.982464236114084e-02 | 2.470000000000000e-14 | 2.153832667772804e-14 | PASS |