Input 01-propagators.03-etrs_taylor.inp
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
Energy [step 20] | -1.060637205318230e+01 | -1.060637205318229e+01 | 1.060000000000000e-13 | -7.105427357601002e-15 | PASS |
Multipoles [step 0] | -2.071004988595665e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | -2.658988477397808e-15 | PASS |
Multipoles [step 20] | -1.265536606512579e-01 | -1.265536606512539e-01 | 4.510000000000000e-15 | -4.024558464266192e-15 | PASS |
Forces [step 0] | 8.537673799432843e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -5.107025913275720e-15 | PASS |
Forces [step 20] | 7.966960326022887e-02 | 7.966960326023198e-02 | 5.860000000000000e-15 | -3.108624468950438e-15 | PASS |