Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
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] | -1.059306110576121e+01 | -1.059306110576122e+01 | 1.060000000000000e-13 | 7.105427357601002e-15 | PASS |
| Multipoles [step 0] | -1.170343729155372e-15 | 1.824331091466839e-16 | 4.490000000000000e-15 | -1.352776838302056e-15 | PASS |
| Multipoles [step 20] | -1.269354346362588e-01 | -1.269354346362595e-01 | 3.850000000000000e-15 | 7.216449660063518e-16 | PASS |
| Forces [step 0] | 8.537673799433465e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 1.110223024625157e-15 | PASS |
| Forces [step 20] | 7.713299237647542e-02 | 7.713299237647830e-02 | 9.040000000000000e-15 | -2.886579864025407e-15 | PASS |