Input 06-caetrs.02-kick.inp
Commits >
Commit f22bb0bcca4b53614d336c5e83de089ff68b1baa >
Run foss-cmake-zen4: [foss2023a-serial, ci-foss-min]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.056293727506790e+01 | -1.056293727506791e+01 | 1.060000000000000e-13 | 5.329070518200751e-15 | PASS |
| Energy [step 5] | -1.040745483159455e+01 | -1.040745483159455e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
| Energy [step 10] | -1.040743417507011e+01 | -1.040743417507012e+01 | 1.060000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 15] | -1.040742113639585e+01 | -1.040742113639586e+01 | 1.060000000000000e-13 | 5.329070518200751e-15 | PASS |
| Energy [step 20] | -1.040741451973632e+01 | -1.040741451973633e+01 | 1.060000000000000e-13 | 8.881784197001252e-15 | PASS |
| Dipole [step 1] | -1.326274295465960e-15 | 1.780638116610150e-16 | 4.000000000000000e-14 | -1.504338107126975e-15 | PASS |
| Dipole [step 5] | -7.295426719525311e-01 | -7.295426719525250e-01 | 4.000000000000000e-14 | -6.106226635438361e-15 | PASS |
| Dipole [step 10] | -1.337803863058586e+00 | -1.337803863058600e+00 | 4.000000000000000e-14 | 1.354472090042691e-14 | PASS |
| Dipole [step 15] | -1.828601499014719e+00 | -1.828601499014715e+00 | 4.000000000000000e-14 | -3.774758283725532e-15 | PASS |
| Dipole [step 20] | -2.205209055720855e+00 | -2.205209055720854e+00 | 4.000000000000000e-14 | -8.881784197001252e-16 | PASS |