Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766761e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 5.329070518200751e-15 | PASS |
| Energy [step 20] | -1.059306110576121e+01 | -1.059306110576122e+01 | 1.060000000000000e-13 | 1.065814103640150e-14 | PASS |
| Multipoles [step 0] | -3.902819473849961e-15 | 1.824331091466839e-16 | 4.490000000000000e-15 | -4.085252582996645e-15 | PASS |
| Multipoles [step 20] | -1.269354346362605e-01 | -1.269354346362595e-01 | 3.850000000000000e-15 | -9.992007221626409e-16 | PASS |
| Forces [step 0] | 8.537673799433820e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 4.662936703425657e-15 | PASS |
| Forces [step 20] | 7.713299237648075e-02 | 7.713299237647830e-02 | 9.040000000000000e-15 | 2.442490654175344e-15 | PASS |