Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 38482cef62d365e560a63bc8ea1cbd919ea4f861 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766758e+01 | -1.060686608766761e+01 | 1.060000000000000e-13 | 3.197442310920451e-14 | PASS |
Energy [step 20] | -1.060638479805074e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | 8.881784197001252e-15 | PASS |
Multipoles [step 0] | -1.140935246670208e-15 | 0.000000000000000e+00 | 1.000000000000000e-14 | -1.140935246670208e-15 | PASS |
Multipoles [step 20] | -1.269180738429550e-01 | -1.269180738429604e-01 | 1.000000000000000e-14 | 5.356826093816380e-15 | PASS |
Forces [step 0] | 8.537673799433732e-02 | 8.537673799433310e-02 | 1.000000000000000e-14 | 4.218847493575595e-15 | PASS |
Forces [step 20] | 7.982464236113307e-02 | 7.982464236112929e-02 | 1.000000000000000e-14 | 3.774758283725532e-15 | PASS |