Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 6fea4ae0129736a1dfe4fc8183ca68b9f7403b45 >
Run foss-cmake-zen4: [foss2023a-serial, foss-full]
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] | -1.060638479805078e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | -2.664535259100376e-14 | PASS |
| Multipoles [step 0] | 2.481417964172745e-15 | 0.000000000000000e+00 | 1.000000000000000e-14 | 2.481417964172745e-15 | PASS |
| Multipoles [step 20] | -1.269180738429607e-01 | -1.269180738429604e-01 | 1.000000000000000e-14 | -3.330669073875470e-16 | PASS |
| Forces [step 0] | 8.537673799433199e-02 | 8.537673799433310e-02 | 1.000000000000000e-14 | -1.110223024625157e-15 | PASS |
| Forces [step 20] | 7.982464236112952e-02 | 7.982464236112929e-02 | 1.000000000000000e-14 | 2.220446049250313e-16 | PASS |