Input 16-sparskit.02-kick.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058497392618079e+01 |
-1.058497392618078e+01 |
1.060000000000000e-13 |
-1.065814103640150e-14 |
PASS |
| Energy [step 5] |
-1.042952412811270e+01 |
-1.042952412811269e+01 |
1.040000000000000e-13 |
-1.421085471520200e-14 |
PASS |
| Energy [step 10] |
-1.042951822881428e+01 |
-1.042951822881430e+01 |
1.040000000000000e-13 |
2.309263891220326e-14 |
PASS |
| Energy [step 15] |
-1.042951650355473e+01 |
-1.042951650355473e+01 |
1.040000000000000e-13 |
-1.776356839400250e-15 |
PASS |
| Energy [step 20] |
-1.042951654541481e+01 |
-1.042951654541481e+01 |
1.040000000000000e-13 |
1.776356839400250e-15 |
PASS |
| Dipole [step 1] |
6.010063540590193e-15 |
-4.333620525691201e-16 |
7.190000000000000e-15 |
6.443425593159314e-15 |
PASS |
| Dipole [step 5] |
-7.295369601119452e-01 |
-7.295369601119552e-01 |
7.300000000000000e-15 |
9.992007221626409e-15 |
FAIL |
| Dipole [step 10] |
-1.339262937921840e+00 |
-1.339262937921843e+00 |
1.340000000000000e-14 |
3.108624468950438e-15 |
PASS |
| Dipole [step 15] |
-1.833828192687659e+00 |
-1.833828192687674e+00 |
1.830000000000000e-14 |
1.487698852997710e-14 |
PASS |
| Dipole [step 20] |
-2.215299399796869e+00 |
-2.215299399796875e+00 |
2.220000000000000e-14 |
6.217248937900877e-15 |
PASS |