Input 01-propagators.06-aetrs.inp
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run intel_mpi_autotools: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766765e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | -3.375077994860476e-14 | PASS |
| Energy [step 20] | -1.060637353666412e+01 | -1.060637353666412e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
| Multipoles [step 0] | -1.170343729155372e-15 | 1.824331091466839e-16 | 4.490000000000000e-15 | -1.352776838302056e-15 | PASS |
| Multipoles [step 20] | -1.265509663990624e-01 | -1.265509663990613e-01 | 4.000000000000000e-15 | -1.054711873393899e-15 | 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 |