Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766761e+01 | 1.060000000000000e-13 | -7.105427357601002e-15 | PASS |
| Energy [step 20] | -1.060638479805075e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | -1.776356839400250e-15 | PASS |
| Multipoles [step 0] | -3.510011190391033e-15 | 0.000000000000000e+00 | 1.000000000000000e-14 | -3.510011190391033e-15 | PASS |
| Multipoles [step 20] | -1.269180738429657e-01 | -1.269180738429604e-01 | 1.000000000000000e-14 | -5.301314942585122e-15 | PASS |
| Forces [step 0] | 8.537673799432888e-02 | 8.537673799433310e-02 | 1.000000000000000e-14 | -4.218847493575595e-15 | PASS |
| Forces [step 20] | 7.982464236113263e-02 | 7.982464236112929e-02 | 1.000000000000000e-14 | 3.330669073875470e-15 | PASS |