Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
3.915739296787768e+00 |
3.915739296788000e+00 |
1.000000000000000e-04 |
-2.318145675417327e-13 |
PASS |
Energy [step 50] |
3.935727829705796e+00 |
3.935727829706000e+00 |
1.000000000000000e-04 |
-2.042810365310288e-13 |
PASS |
Energy [step 100] |
3.935727829644967e+00 |
3.935727829645000e+00 |
1.000000000000000e-04 |
-3.241851231905457e-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] |
2.264000000000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-04 |
2.264000000000000e-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] |
-1.740000000000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-04 |
-1.740000000000000e-20 |
PASS |