Input 01-propagators.06-aetrs.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cmake: [foss2022a-serial, foss-min]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766760e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.776356839400250e-14 | PASS |
| Energy [step 20] | -1.060637353666413e+01 | -1.060637353666412e+01 | 1.060000000000000e-13 | -8.881784197001252e-15 | PASS |
| Multipoles [step 0] | -7.776088123022037e-16 | 1.824331091466839e-16 | 4.490000000000000e-15 | -9.600419214488876e-16 | PASS |
| Multipoles [step 20] | -1.265509663990622e-01 | -1.265509663990613e-01 | 4.000000000000000e-15 | -9.436895709313831e-16 | PASS |
| Forces [step 0] | 8.537673799433554e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 1.998401444325282e-15 | PASS |
| Forces [step 20] | 7.966840852244594e-02 | 7.966840852244794e-02 | 8.059999999999999e-15 | -1.998401444325282e-15 | PASS |