Input 02-propagators.02-cnsparskit.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Forces [step 1] |
8.537673799432888e-02 |
8.537673799434686e-02 |
2.170000000000000e-14 |
-1.798561299892754e-14 |
PASS |
| Forces [step 20] |
7.964959635257074e-02 |
7.964959635258606e-02 |
1.730000000000000e-14 |
-1.532107773982716e-14 |
PASS |
| Energy [step 1] |
-1.060686608766762e+01 |
-1.060686608766762e+01 |
1.060000000000000e-13 |
3.552713678800501e-15 |
PASS |
| Energy [step 20] |
-1.060637261154880e+01 |
-1.060637261154880e+01 |
1.060000000000000e-13 |
0.000000000000000e+00 |
PASS |
| Multipoles [step 1] |
1.001070320388875e-15 |
5.879834888021430e-16 |
4.510000000000000e-15 |
4.130868315867319e-16 |
PASS |
| Multipoles [step 20] |
-1.265304528942223e-01 |
-1.265304528942126e-01 |
1.210000000000000e-14 |
-9.658940314238862e-15 |
PASS |