Input 12-electronic_subsystem_propagators.03-aetrs.inp
Commits >
Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 >
Run intel_omp_autotools: [intel2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -1.953992523340276e-14 | PASS |
| Energy [step 20] | -1.060637197121569e+01 | -1.060637197121568e+01 | 1.060000000000000e-13 | -1.243449787580175e-14 | PASS |
| Multipoles [step 0] | 1.125740126117769e-15 | 0.000000000000000e+00 | 5.000000000000000e-15 | 1.125740126117769e-15 | PASS |
| Multipoles [step 20] | -1.265533510651995e-01 | -1.265533510652042e-01 | 5.070000000000000e-15 | 4.662936703425657e-15 | PASS |