Input 21-qedft-breit-3d.01-pxlda-hydrogen.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
SCF convergence |
1.000000000000000e+00 |
1.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Total Energy |
-4.404965900000000e-01 |
-4.404965900000000e-01 |
2.300000000000000e-07 |
0.000000000000000e+00 |
PASS |
Eigenvalues energy |
-6.235058800000000e-01 |
-6.235058800000000e-01 |
3.200000000000000e-08 |
0.000000000000000e+00 |
PASS |
Photon exchange |
4.482205000000000e-02 |
4.482205000000000e-02 |
2.300000000000000e-07 |
0.000000000000000e+00 |
PASS |