Input 02-propagators.02-cnsparskit.inp
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run intel_omp_autotools: [intel2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433509e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 1.554312234475219e-15 | PASS |
| Forces [step 20] | 7.964959635257385e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -1.956768080901838e-15 | PASS |
| Energy [step 1] | -1.060686608766760e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.598721155460225e-14 | PASS |
| Energy [step 20] | -1.060637261154881e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | -1.065814103640150e-14 | PASS |
| Multipoles [step 1] | 1.416870527154446e-15 | 1.824331091466839e-16 | 4.490000000000000e-15 | 1.234437418007762e-15 | PASS |
| Multipoles [step 20] | -1.265304528942181e-01 | -1.265304528942171e-01 | 6.810000000000000e-15 | -9.992007221626409e-16 | PASS |