Input 01-propagators.06-aetrs.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 0] |
-1.060684240205383e+01 |
-1.060684240205380e+01 |
5.300000000000000e-14 |
-2.664535259100376e-14 |
PASS |
Energy [step 20] |
-1.060634982716839e+01 |
-1.060634982716840e+01 |
5.300000000000000e-13 |
1.243449787580175e-14 |
PASS |
Multipoles [step 0] |
2.161271162037792e-15 |
2.282730401188460e-15 |
4.670000000000000e-15 |
-1.214592391506677e-16 |
PASS |
Multipoles [step 20] |
-1.265513823243646e-01 |
-1.265513823243620e-01 |
6.330000000000000e-15 |
-2.581268532253489e-15 |
PASS |
Forces [step 0] |
8.537491810749209e-02 |
8.537491810749601e-02 |
8.799999999999999e-15 |
-3.913536161803677e-15 |
PASS |
Forces [step 20] |
7.966699321588244e-02 |
7.966699321588180e-02 |
4.000000000000000e-14 |
6.383782391594650e-16 |
PASS |