Input 02-propagators.02-cnsparskit.inp
Commits >
Commit 370adda2f0c97e5430265c4ac8d8eb630d5276fb >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433421e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 6.661338147750939e-16 | PASS |
| Forces [step 20] | 7.964959635257562e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -1.804112415015879e-16 | PASS |
| Energy [step 1] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
| Energy [step 20] | -1.060637261154881e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | -7.105427357601002e-15 | PASS |
| Multipoles [step 1] | -1.105506311493976e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | -1.693489800296119e-15 | PASS |
| Multipoles [step 20] | -1.265304528942174e-01 | -1.265304528942195e-01 | 6.870000000000000e-15 | 2.081668171172169e-15 | PASS |