Input 15-crank_nicolson.04-freeze_states.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.022657179873566e+01 |
-1.022657179873567e+01 |
1.020000000000000e-13 |
8.881784197001252e-15 |
PASS |
| Energy [step 5] |
-1.014067705119931e+01 |
-1.014067705119932e+01 |
1.010000000000000e-13 |
1.421085471520200e-14 |
PASS |
| Energy [step 10] |
-1.013381790798761e+01 |
-1.013381790798763e+01 |
1.010000000000000e-13 |
2.309263891220326e-14 |
PASS |
| Energy [step 15] |
-1.012563491015763e+01 |
-1.012563491015765e+01 |
1.010000000000000e-13 |
2.131628207280301e-14 |
PASS |
| Energy [step 20] |
-1.011739812323843e+01 |
-1.011739812323845e+01 |
1.010000000000000e-13 |
1.598721155460225e-14 |
PASS |
| Dipole [step 1] |
-1.585313850408897e-15 |
-1.039108394869460e-15 |
5.830000000000000e-15 |
-5.462054555394374e-16 |
PASS |
| Dipole [step 5] |
-3.955586853259913e-01 |
-3.955586853259905e-01 |
6.110000000000000e-15 |
-8.326672684688674e-16 |
PASS |
| Dipole [step 10] |
-7.406750729061542e-01 |
-7.406750729061549e-01 |
7.410000000000000e-15 |
6.661338147750939e-16 |
PASS |
| Dipole [step 15] |
-1.039084057464595e+00 |
-1.039084057464601e+00 |
1.140000000000000e-14 |
6.217248937900877e-15 |
PASS |
| Dipole [step 20] |
-1.295829936532783e+00 |
-1.295829936532786e+00 |
1.300000000000000e-14 |
3.330669073875470e-15 |
PASS |