Input 01-propagators.03-etrs_taylor.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 0] |
-1.060686608766758e+01 |
-1.060686608766762e+01 |
1.060000000000000e-13 |
3.730349362740526e-14 |
PASS |
| Energy [step 20] |
-1.060637205318227e+01 |
-1.060637205318229e+01 |
1.060000000000000e-13 |
1.953992523340276e-14 |
PASS |
| Multipoles [step 0] |
1.718541202898848e-15 |
1.824331091466839e-16 |
4.490000000000000e-15 |
1.536108093752164e-15 |
PASS |
| Multipoles [step 20] |
-1.265536606512490e-01 |
-1.265536606512522e-01 |
3.510000000000000e-15 |
3.247402347028583e-15 |
PASS |
| Forces [step 0] |
8.537673799433776e-02 |
8.537673799433354e-02 |
5.130000000000000e-15 |
4.218847493575595e-15 |
PASS |
| Forces [step 20] |
7.966960326023287e-02 |
7.966960326023464e-02 |
2.440000000000000e-15 |
-1.776356839400250e-15 |
PASS |