Input 01-propagators.06-aetrs.inp
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766763e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | -7.105427357601002e-15 | PASS |
| Energy [step 20] | -1.060637353666412e+01 | -1.060637353666412e+01 | 1.060000000000000e-13 | -1.776356839400250e-15 | PASS |
| Multipoles [step 0] | -3.735878793820202e-17 | 1.824331091466839e-16 | 4.490000000000000e-15 | -2.197918970848859e-16 | PASS |
| Multipoles [step 20] | -1.265509663990620e-01 | -1.265509663990613e-01 | 2.080000000000000e-15 | -7.494005416219807e-16 | PASS |
| Forces [step 0] | 8.537673799433465e-02 | 8.537673799433354e-02 | 5.130000000000000e-15 | 1.110223024625157e-15 | PASS |
| Forces [step 20] | 7.966840852244550e-02 | 7.966840852244794e-02 | 4.150000000000000e-15 | -2.442490654175344e-15 | PASS |