Input 01-propagators.06-aetrs.inp
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
| Energy [step 20] | -1.060637353666411e+01 | -1.060637353666412e+01 | 1.060000000000000e-13 | 7.105427357601002e-15 | PASS |
| Multipoles [step 0] | -2.071004988595665e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | -2.658988477397808e-15 | PASS |
| Multipoles [step 20] | -1.265509663990664e-01 | -1.265509663990618e-01 | 5.590000000000000e-15 | -4.635181127810029e-15 | PASS |
| Forces [step 0] | 8.537673799432843e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -5.107025913275720e-15 | PASS |
| Forces [step 20] | 7.966840852244106e-02 | 7.966840852244794e-02 | 8.059999999999999e-15 | -6.883382752675971e-15 | PASS |