Input 02-propagators.02-cnsparskit.inp
Commits >
Commit 94d58911903c32860449c62a795f2d74d19217f9 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799432888e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -4.662936703425657e-15 | PASS |
| Forces [step 20] | 7.964959635257163e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -4.177214130152151e-15 | PASS |
| Energy [step 1] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.776356839400250e-15 | PASS |
| Energy [step 20] | -1.060637261154879e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | 1.065814103640150e-14 | PASS |
| Multipoles [step 1] | -3.510011190391033e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | -4.097994679193176e-15 | PASS |
| Multipoles [step 20] | -1.265304528942257e-01 | -1.265304528942195e-01 | 6.870000000000000e-15 | -6.217248937900877e-15 | PASS |