Input 12-electronic_subsystem_propagators.03-aetrs.inp
Commits >
Commit 18848dd43b1805cec78813204483223eec09e06c >
Run intel_omp_autotools: [intel2022a-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] | -1.265533510652026e-01 | -1.265533510651940e-01 | 1.310000000000000e-14 | -8.604228440844963e-15 | PASS |