Input 01-propagators.04-etrs_lanczos.inp
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_valgrind_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766759e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 3.197442310920451e-14 | PASS |
| Energy [step 20] | -1.060637200596972e+01 | -1.060637200596971e+01 | 1.060000000000000e-13 | -1.421085471520200e-14 | PASS |
| Multipoles [step 0] | 7.391954480158793e-16 | 1.824331091466839e-16 | 4.490000000000000e-15 | 5.567623388691955e-16 | PASS |
| Multipoles [step 20] | -1.265864295118501e-01 | -1.265864295118192e-01 | 4.360000000000000e-14 | -3.091971123581061e-14 | PASS |
| Forces [step 0] | 8.537673799433243e-02 | 8.537673799433354e-02 | 5.130000000000000e-15 | -1.110223024625157e-15 | PASS |
| Forces [step 20] | 7.967423673800944e-02 | 7.967423673803031e-02 | 4.640000000000000e-14 | -2.087219286295294e-14 | PASS |