Input 01-propagators.06-aetrs.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 0] |
-1.060686608766761e+01 |
-1.060686608766762e+01 |
1.060000000000000e-13 |
8.881784197001252e-15 |
PASS |
| Energy [step 20] |
-1.060637353666412e+01 |
-1.060637353666412e+01 |
1.060000000000000e-13 |
-3.552713678800501e-15 |
PASS |
| Multipoles [step 0] |
-7.786503985530469e-16 |
5.879834888021430e-16 |
4.510000000000000e-15 |
-1.366633887355190e-15 |
PASS |
| Multipoles [step 20] |
-1.265509663990623e-01 |
-1.265509663990618e-01 |
5.590000000000000e-15 |
-5.273559366969494e-16 |
PASS |
| Forces [step 0] |
8.537673799433643e-02 |
8.537673799433354e-02 |
1.250000000000000e-14 |
2.886579864025407e-15 |
PASS |
| Forces [step 20] |
7.966840852244506e-02 |
7.966840852244794e-02 |
8.059999999999999e-15 |
-2.886579864025407e-15 |
PASS |