Input 15-crank_nicolson.04-freeze_states.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
-1.022657179873565e+01 |
-1.022657179873567e+01 |
1.020000000000000e-13 |
1.776356839400250e-14 |
PASS |
Energy [step 5] |
-1.014067705119930e+01 |
-1.014067705119932e+01 |
1.010000000000000e-13 |
2.486899575160351e-14 |
PASS |
Energy [step 10] |
-1.013381790798761e+01 |
-1.013381790798763e+01 |
1.010000000000000e-13 |
1.776356839400250e-14 |
PASS |
Energy [step 15] |
-1.012563491015761e+01 |
-1.012563491015765e+01 |
1.010000000000000e-13 |
4.440892098500626e-14 |
PASS |
Energy [step 20] |
-1.011739812323842e+01 |
-1.011739812323845e+01 |
1.010000000000000e-13 |
3.375077994860476e-14 |
PASS |
Dipole [step 1] |
-1.845745778439323e-15 |
-1.039108394869460e-15 |
5.830000000000000e-15 |
-8.066373835698627e-16 |
PASS |
Dipole [step 5] |
-3.955586853259902e-01 |
-3.955586853259905e-01 |
6.110000000000000e-15 |
2.775557561562891e-16 |
PASS |
Dipole [step 10] |
-7.406750729061528e-01 |
-7.406750729061549e-01 |
7.410000000000000e-15 |
2.109423746787797e-15 |
PASS |
Dipole [step 15] |
-1.039084057464608e+00 |
-1.039084057464601e+00 |
1.140000000000000e-14 |
-6.661338147750939e-15 |
PASS |
Dipole [step 20] |
-1.295829936532784e+00 |
-1.295829936532786e+00 |
1.300000000000000e-14 |
1.998401444325282e-15 |
PASS |