Input 01-propagators.03-etrs_taylor.inp
Commits >
Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 >
Run foss_omp_autotools: [foss2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766760e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.953992523340276e-14 | PASS |
Energy [step 20] | -1.060637205318231e+01 | -1.060637205318229e+01 | 1.060000000000000e-13 | -2.309263891220326e-14 | PASS |
Multipoles [step 0] | 2.068790451448255e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | 1.480806962646111e-15 | PASS |
Multipoles [step 20] | -1.265536606512512e-01 | -1.265536606512539e-01 | 4.510000000000000e-15 | 2.720046410331634e-15 | PASS |
Forces [step 0] | 8.537673799433332e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -2.220446049250313e-16 | PASS |
Forces [step 20] | 7.966960326023287e-02 | 7.966960326023198e-02 | 5.860000000000000e-15 | 8.881784197001252e-16 | PASS |