Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
-1.271322167167109e+00 |
-1.271322167167000e+00 |
1.000000000000000e-04 |
-1.092459456231154e-13 |
PASS |
Energy [step 50] |
-1.261322168663061e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-6.106226635438361e-14 |
PASS |
Energy [step 100] |
-1.261322168663086e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-8.615330671091215e-14 |
PASS |
Energy [step 150] |
-1.261322168663117e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.170175067954915e-13 |
PASS |
Energy [step 200] |
-1.261322168663148e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.481037514849959e-13 |
PASS |
Density matrix [step 50] |
8.223000000000000e-01 |
8.223000000000000e-01 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Density matrix [step 100] |
8.215000000000000e-01 |
8.215000000000000e-01 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Density matrix [step 150] |
8.210000000000000e-01 |
8.210000000000000e-01 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Density matrix [step 200] |
8.206000000000000e-01 |
8.206000000000000e-01 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |