Input 02-propagators.02-cnsparskit.inp
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433598e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 2.442490654175344e-15 | PASS |
| Forces [step 20] | 7.964959635257340e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -2.400857290751901e-15 | PASS |
| Energy [step 1] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | -3.552713678800501e-15 | PASS |
| Energy [step 20] | -1.060637261154881e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | -1.065814103640150e-14 | PASS |
| Multipoles [step 1] | 8.169753935860502e-16 | 5.879834888021430e-16 | 4.510000000000000e-15 | 2.289919047839072e-16 | PASS |
| Multipoles [step 20] | -1.265304528942173e-01 | -1.265304528942195e-01 | 6.870000000000000e-15 | 2.164934898019055e-15 | PASS |