Input 02-propagators.03-rungekutta2.inp
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run foss_mpi_omp_autotools: [foss2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Forces [step 1] | 8.537673799432888e-02 | 8.537673799434686e-02 | 2.170000000000000e-14 | -1.798561299892754e-14 | PASS |
Forces [step 20] | 7.965092836545429e-02 | 7.965092836546894e-02 | 1.860000000000000e-14 | -1.465494392505207e-14 | PASS |
Energy [step 1] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 3.552713678800501e-15 | PASS |
Energy [step 20] | -1.060634085760743e+01 | -1.060634085760742e+01 | 1.060000000000000e-13 | -1.243449787580175e-14 | PASS |
Multipoles [step 1] | 1.001070320388875e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | 4.130868315867319e-16 | PASS |
Multipoles [step 20] | -1.266331163444906e-01 | -1.266331163444809e-01 | 1.100000000000000e-14 | -9.742207041085749e-15 | PASS |