Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
-1.271322167167119e+00 |
-1.271322167167000e+00 |
1.000000000000000e-04 |
-1.187938636348917e-13 |
PASS |
Energy [step 50] |
-1.261322168663076e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-7.549516567451064e-14 |
PASS |
Energy [step 100] |
-1.261322168663105e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.045830089196897e-13 |
PASS |
Energy [step 150] |
-1.261322168663134e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.338928967697939e-13 |
PASS |
Energy [step 200] |
-1.261322168663161e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.605382493607976e-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 |