Input 15-crank_nicolson.05-freeze_sae.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-5.571938259893935e-01 |
-5.571938259894010e-01 |
2.390000000000000e-14 |
7.549516567451064e-15 |
PASS |
| Energy [step 5] |
-5.157327347418418e-01 |
-5.157327347418511e-01 |
2.490000000000000e-14 |
9.325873406851315e-15 |
PASS |
| Energy [step 10] |
-5.157327347416908e-01 |
-5.157327347416979e-01 |
3.030000000000000e-14 |
7.105427357601002e-15 |
PASS |
| Energy [step 15] |
-5.157327347416801e-01 |
-5.157327347416708e-01 |
2.780000000000000e-14 |
-9.325873406851315e-15 |
PASS |
| Energy [step 20] |
-5.157327347417183e-01 |
-5.157327347416979e-01 |
2.250000000000000e-14 |
-2.042810365310288e-14 |
PASS |
| Dipole [step 1] |
-1.648851709465035e-15 |
-7.379220068245151e-16 |
5.560000000000000e-15 |
-9.109297026405198e-16 |
PASS |
| Dipole [step 5] |
-1.928247888208911e-01 |
-1.928247888208892e-01 |
4.590000000000000e-15 |
-1.887379141862766e-15 |
PASS |
| Dipole [step 10] |
-3.545495747886702e-01 |
-3.545495747886674e-01 |
4.430000000000000e-15 |
-2.775557561562891e-15 |
PASS |
| Dipole [step 15] |
-4.859689858458489e-01 |
-4.859689858458459e-01 |
4.950000000000000e-15 |
-2.942091015256665e-15 |
PASS |
| Dipole [step 20] |
-6.087120870676919e-01 |
-6.087120870676892e-01 |
6.960000000000000e-15 |
-2.664535259100376e-15 |
PASS |