Input 01-propagators.03-etrs_taylor.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 0] |
-1.060686608766760e+01 |
-1.060686608766762e+01 |
1.060000000000000e-13 |
2.309263891220326e-14 |
PASS |
| Energy [step 20] |
-1.060637205318230e+01 |
-1.060637205318229e+01 |
1.060000000000000e-13 |
-5.329070518200751e-15 |
PASS |
| Multipoles [step 0] |
-9.618268705905049e-16 |
5.879834888021430e-16 |
4.510000000000000e-15 |
-1.549810359392648e-15 |
PASS |
| Multipoles [step 20] |
-1.265536606512555e-01 |
-1.265536606512456e-01 |
1.130000000000000e-14 |
-9.853229343548264e-15 |
PASS |
| Forces [step 0] |
8.537673799433110e-02 |
8.537673799434686e-02 |
2.170000000000000e-14 |
-1.576516694967722e-14 |
PASS |
| Forces [step 20] |
7.966960326022754e-02 |
7.966960326024397e-02 |
1.810000000000000e-14 |
-1.643130076445232e-14 |
PASS |