Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766761e+01 | -1.060686608766761e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
| Energy [step 20] | -1.060638479805073e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | 1.776356839400250e-14 | PASS |
| Multipoles [step 0] | 3.669018214247366e-16 | 0.000000000000000e+00 | 1.000000000000000e-14 | 3.669018214247366e-16 | PASS |
| Multipoles [step 20] | -1.269180738429551e-01 | -1.269180738429604e-01 | 1.000000000000000e-14 | 5.301314942585122e-15 | PASS |
| Forces [step 0] | 8.537673799433643e-02 | 8.537673799433310e-02 | 1.000000000000000e-14 | 3.330669073875470e-15 | PASS |
| Forces [step 20] | 7.982464236113396e-02 | 7.982464236112929e-02 | 1.000000000000000e-14 | 4.662936703425657e-15 | PASS |