Input 01-propagators.06-aetrs.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 0] |
-1.060686608766760e+01 |
-1.060686608766762e+01 |
1.060000000000000e-13 |
1.776356839400250e-14 |
PASS |
Energy [step 20] |
-1.060637353666413e+01 |
-1.060637353666412e+01 |
1.060000000000000e-13 |
-8.881784197001252e-15 |
PASS |
Multipoles [step 0] |
-7.776088123022037e-16 |
1.824331091466839e-16 |
4.490000000000000e-15 |
-9.600419214488876e-16 |
PASS |
Multipoles [step 20] |
-1.265509663990622e-01 |
-1.265509663990613e-01 |
2.080000000000000e-15 |
-9.436895709313831e-16 |
PASS |
Forces [step 0] |
8.537673799433554e-02 |
8.537673799433354e-02 |
5.130000000000000e-15 |
1.998401444325282e-15 |
PASS |
Forces [step 20] |
7.966840852244594e-02 |
7.966840852244794e-02 |
4.150000000000000e-15 |
-1.998401444325282e-15 |
PASS |