Input 02-propagators.02-cnsparskit.inp
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Run foss-cmake-zen4: [foss2023a-serial, foss-full]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433021e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -3.330669073875470e-15 | PASS |
| Forces [step 20] | 7.964959635257074e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -5.065392549852277e-15 | PASS |
| Energy [step 1] | -1.060686608766759e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 3.197442310920451e-14 | PASS |
| Energy [step 20] | -1.060637261154880e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | 3.552713678800501e-15 | PASS |
| Multipoles [step 1] | -1.279023274011054e-16 | 5.879834888021430e-16 | 4.510000000000000e-15 | -7.158858162032484e-16 | PASS |
| Multipoles [step 20] | -1.265304528942248e-01 | -1.265304528942195e-01 | 6.870000000000000e-15 | -5.273559366969494e-15 | PASS |