Input 02-propagators.02-cnsparskit.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Forces [step 1] |
8.537491810749254e-02 |
8.537491810749601e-02 |
8.300000000000000e-15 |
-3.469446951953614e-15 |
PASS |
| Forces [step 20] |
7.964818149493436e-02 |
7.964818149493391e-02 |
4.400000000000000e-15 |
4.440892098500626e-16 |
PASS |
| Energy [step 1] |
-1.060684240205383e+01 |
-1.060684240205380e+01 |
5.300000000000000e-14 |
-3.197442310920451e-14 |
PASS |
| Energy [step 20] |
-1.060634890211196e+01 |
-1.060634890211200e+01 |
5.300000000000000e-12 |
3.907985046680551e-14 |
PASS |
| Multipoles [step 1] |
2.062177211219381e-15 |
2.282730401188460e-15 |
4.670000000000000e-15 |
-2.205531899690792e-16 |
PASS |
| Multipoles [step 20] |
-1.265308695811634e-01 |
-1.265308695811640e-01 |
6.330000000000000e-15 |
6.106226635438361e-16 |
PASS |