Input 15-crank_nicolson.05-freeze_sae.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-5.571785867386744e-01 |
-5.571785867386825e-01 |
4.400000000000000e-14 |
8.104628079763643e-15 |
PASS |
| Energy [step 5] |
-5.157175387707195e-01 |
-5.157175387707220e-01 |
2.970000000000000e-14 |
2.553512956637860e-15 |
PASS |
| Energy [step 10] |
-5.157175387705640e-01 |
-5.157175387705686e-01 |
2.910000000000000e-14 |
4.551914400963142e-15 |
PASS |
| Energy [step 15] |
-5.157175387705267e-01 |
-5.157175387705311e-01 |
3.190000000000000e-14 |
4.329869796038111e-15 |
PASS |
| Energy [step 20] |
-5.157175387705498e-01 |
-5.157175387705559e-01 |
3.990000000000000e-14 |
6.106226635438361e-15 |
PASS |
| Dipole [step 1] |
-8.921168857356325e-16 |
-7.379220068245151e-16 |
4.900000000000000e-15 |
-1.541948789111174e-16 |
PASS |
| Dipole [step 5] |
-1.928249235315493e-01 |
-1.928249235315500e-01 |
9.640000000000000e-14 |
6.661338147750939e-16 |
PASS |
| Dipole [step 10] |
-3.545506487499295e-01 |
-3.545506487499300e-01 |
1.770000000000000e-14 |
4.996003610813204e-16 |
PASS |
| Dipole [step 15] |
-4.859711921536388e-01 |
-4.859711921536400e-01 |
2.430000000000000e-14 |
1.221245327087672e-15 |
PASS |
| Dipole [step 20] |
-6.087147749202587e-01 |
-6.087147749202590e-01 |
3.040000000000000e-14 |
3.330669073875470e-16 |
PASS |