Input 15-crank_nicolson.05-freeze_sae.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-5.571785867386664e-01 |
-5.571785867386825e-01 |
3.360000000000000e-14 |
1.609823385706477e-14 |
PASS |
| Energy [step 5] |
-5.157175387707168e-01 |
-5.157175387707220e-01 |
2.970000000000000e-14 |
5.218048215738236e-15 |
PASS |
| Energy [step 10] |
-5.157175387705658e-01 |
-5.157175387705686e-01 |
2.910000000000000e-14 |
2.775557561562891e-15 |
PASS |
| Energy [step 15] |
-5.157175387705205e-01 |
-5.157175387705311e-01 |
3.190000000000000e-14 |
1.054711873393899e-14 |
PASS |
| Energy [step 20] |
-5.157175387705774e-01 |
-5.157175387705559e-01 |
3.990000000000000e-14 |
-2.142730437526552e-14 |
PASS |
| Dipole [step 1] |
-1.146834397466965e-16 |
-7.379220068245151e-16 |
2.190000000000000e-15 |
6.232385670778186e-16 |
PASS |
| Dipole [step 5] |
-1.928249235315491e-01 |
-1.928249235315500e-01 |
9.640000000000000e-14 |
8.604228440844963e-16 |
PASS |
| Dipole [step 10] |
-3.545506487499276e-01 |
-3.545506487499300e-01 |
1.770000000000000e-14 |
2.331468351712829e-15 |
PASS |
| Dipole [step 15] |
-4.859711921536417e-01 |
-4.859711921536400e-01 |
2.430000000000000e-14 |
-1.665334536937735e-15 |
PASS |
| Dipole [step 20] |
-6.087147749202619e-01 |
-6.087147749202590e-01 |
3.040000000000000e-14 |
-2.886579864025407e-15 |
PASS |