Input 02-propagators.02-cnsparskit.inp
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run intel_omp_autotools: [intel2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433199e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -1.554312234475219e-15 | PASS |
| Forces [step 20] | 7.964959635257429e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -1.512678871051776e-15 | PASS |
| Energy [step 1] | -1.060686608766761e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 20] | -1.060637261154881e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | -1.065814103640150e-14 | PASS |
| Multipoles [step 1] | 4.685978167995319e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | 4.097994679193176e-15 | PASS |
| Multipoles [step 20] | -1.265304528942141e-01 | -1.265304528942195e-01 | 6.870000000000000e-15 | 5.412337245047638e-15 | PASS |