Input 01-propagators.06-aetrs.inp
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
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 | 2.309263891220326e-14 | PASS |
| Energy [step 20] | -1.060637353666412e+01 | -1.060637353666412e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
| Multipoles [step 0] | 9.548515542698657e-16 | 5.879834888021430e-16 | 4.510000000000000e-15 | 3.668680654677227e-16 | PASS |
| Multipoles [step 20] | -1.265509663990616e-01 | -1.265509663990618e-01 | 5.590000000000000e-15 | 1.665334536937735e-16 | PASS |
| Forces [step 0] | 8.537673799433465e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 1.110223024625157e-15 | PASS |
| Forces [step 20] | 7.966840852244594e-02 | 7.966840852244794e-02 | 8.059999999999999e-15 | -1.998401444325282e-15 | PASS |