Input 15-crank_nicolson.05-freeze_sae.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-5.571785867386930e-01 |
-5.571785867386825e-01 |
4.400000000000000e-14 |
-1.054711873393899e-14 |
PASS |
| Energy [step 5] |
-5.157175387707177e-01 |
-5.157175387707220e-01 |
2.970000000000000e-14 |
4.329869796038111e-15 |
PASS |
| Energy [step 10] |
-5.157175387705489e-01 |
-5.157175387705686e-01 |
2.910000000000000e-14 |
1.965094753586527e-14 |
PASS |
| Energy [step 15] |
-5.157175387704992e-01 |
-5.157175387705311e-01 |
3.190000000000000e-14 |
3.186340080674199e-14 |
PASS |
| Energy [step 20] |
-5.157175387705445e-01 |
-5.157175387705559e-01 |
3.990000000000000e-14 |
1.143529715363911e-14 |
PASS |
| Dipole [step 1] |
-1.175417574247005e-15 |
-7.379220068245151e-16 |
2.190000000000000e-15 |
-4.374955674224901e-16 |
PASS |
| Dipole [step 5] |
-1.928249235315500e-01 |
-1.928249235315500e-01 |
9.640000000000000e-14 |
-2.775557561562891e-17 |
PASS |
| Dipole [step 10] |
-3.545506487499309e-01 |
-3.545506487499300e-01 |
1.770000000000000e-14 |
-8.881784197001252e-16 |
PASS |
| Dipole [step 15] |
-4.859711921536394e-01 |
-4.859711921536400e-01 |
2.430000000000000e-14 |
6.106226635438361e-16 |
PASS |
| Dipole [step 20] |
-6.087147749202598e-01 |
-6.087147749202590e-01 |
3.040000000000000e-14 |
-7.771561172376096e-16 |
PASS |