Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
-1.271322167167127e+00 |
-1.271322167167000e+00 |
1.000000000000000e-04 |
-1.265654248072678e-13 |
PASS |
Energy [step 50] |
-1.261322168663082e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-8.193445921733655e-14 |
PASS |
Energy [step 100] |
-1.261322168663112e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.121325254871408e-13 |
PASS |
Energy [step 150] |
-1.261322168663141e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.412203687323199e-13 |
PASS |
Energy [step 200] |
-1.261322168663170e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.698641227676490e-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 |