Input 01-propagators.03-etrs_taylor.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] |
-1.060637205318229e+01 |
-1.060637205318229e+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] |
-1.265536606512558e-01 |
-1.265536606512456e-01 |
1.130000000000000e-14 |
-1.024180740216707e-14 |
PASS |
Forces [step 0] |
8.537673799433065e-02 |
8.537673799434686e-02 |
2.170000000000000e-14 |
-1.620925615952729e-14 |
PASS |
Forces [step 20] |
7.966960326022754e-02 |
7.966960326024397e-02 |
1.810000000000000e-14 |
-1.643130076445232e-14 |
PASS |