Name |
Value |
Reference |
Precision |
Difference |
Status |
Energy [step 1] |
-1.271322167167138e+00 |
-1.271322167167000e+00 |
1.000000000000000e-04 |
-1.383337888682945e-13 |
PASS |
Energy [step 50] |
-1.261322168663095e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-9.525713551283843e-14 |
PASS |
Energy [step 100] |
-1.261322168663124e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.241229341530925e-13 |
PASS |
Energy [step 150] |
-1.261322168663153e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.525446435834965e-13 |
PASS |
Energy [step 200] |
-1.261322168663182e+00 |
-1.261322168663000e+00 |
1.000000000000000e-04 |
-1.818545314336006e-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 |