Input 01-propagators.06-aetrs.inp
Commits >
Commit 38482cef62d365e560a63bc8ea1cbd919ea4f861 >
Run foss_cmake: [foss2022a-serial, foss-min]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766761e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 8.881784197001252e-15 | PASS |
| Energy [step 20] | -1.060637353666412e+01 | -1.060637353666412e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
| Multipoles [step 0] | -7.786503985530469e-16 | 5.879834888021430e-16 | 4.510000000000000e-15 | -1.366633887355190e-15 | PASS |
| Multipoles [step 20] | -1.265509663990623e-01 | -1.265509663990618e-01 | 5.590000000000000e-15 | -5.273559366969494e-16 | PASS |
| Forces [step 0] | 8.537673799433643e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 2.886579864025407e-15 | PASS |
| Forces [step 20] | 7.966840852244506e-02 | 7.966840852244794e-02 | 8.059999999999999e-15 | -2.886579864025407e-15 | PASS |