Input 02-propagators.04-rungekutta4.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Forces [step 1] | 8.537673799436396e-02 | 8.537673799434686e-02 | 2.170000000000000e-14 | 1.709743457922741e-14 | PASS |
Forces [step 20] | 7.965998233985605e-02 | 7.965998233983873e-02 | 1.910000000000000e-14 | 1.731947918415244e-14 | PASS |
Energy [step 1] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 1.776356839400250e-15 | PASS |
Energy [step 20] | -1.060637180959050e+01 | -1.060637180959051e+01 | 1.060000000000000e-13 | 8.881784197001252e-15 | PASS |
Multipoles [step 1] | -3.510011190391033e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | -4.097994679193176e-15 | PASS |
Multipoles [step 20] | -1.265424097632489e-01 | -1.265424097632556e-01 | 1.150000000000000e-14 | 6.689093723366568e-15 | PASS |