Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
3.915739296787645e+00 |
3.915739296788000e+00 |
1.000000000000000e-04 |
-3.552713678800501e-13 |
PASS |
Energy [step 50] |
3.935727829705701e+00 |
3.935727829706000e+00 |
1.000000000000000e-04 |
-2.993161274389422e-13 |
PASS |
Energy [step 100] |
3.935727829644946e+00 |
3.935727829645000e+00 |
1.000000000000000e-04 |
-5.373479439185758e-14 |
PASS |
Density matrix (Re) [step 50] |
8.235000000000001e-02 |
8.235000000000001e-02 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Density matrix (Im) [step 50] |
4.152000000000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-04 |
4.152000000000000e-19 |
PASS |
Density matrix (Re) [step 100] |
8.223000000000000e-02 |
8.223000000000000e-02 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Density matrix (Im) [step 100] |
-9.567000000000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-04 |
-9.567000000000000e-20 |
PASS |