Input 21-scissor.03-spectrum.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
Electronic sum rule |
2.542644000000000e+00 |
2.542638000000000e+00 |
1.270000000000000e-05 |
5.999999999950489e-06 |
PASS |
Static polarizability |
9.788231000000000e+00 |
9.788202000000000e+00 |
4.890000000000000e-05 |
2.899999999961267e-05 |
PASS |
Energy 2 |
2.000000000000000e+00 |
2.000000000000000e+00 |
2.000000000000000e-02 |
0.000000000000000e+00 |
PASS |
Sigma 2 |
6.186155900000000e-02 |
6.186155900000000e-02 |
3.090000000000000e-08 |
0.000000000000000e+00 |
PASS |
Energy 4 |
4.000000000000000e+00 |
4.000000000000000e+00 |
4.000000000000000e-02 |
0.000000000000000e+00 |
PASS |
Sigma 4 |
2.298911400000000e-01 |
2.298911400000000e-01 |
1.150000000000000e-07 |
0.000000000000000e+00 |
PASS |
Energy 6 |
6.000000000000000e+00 |
6.000000000000000e+00 |
6.000000000000000e-02 |
0.000000000000000e+00 |
PASS |
Sigma 6 |
4.568350900000000e-01 |
4.568350900000000e-01 |
2.280000000000000e-07 |
0.000000000000000e+00 |
PASS |
Energy 8 |
8.000000000000000e+00 |
8.000000000000000e+00 |
8.000000000000000e-02 |
0.000000000000000e+00 |
PASS |
Sigma 8 |
6.801468500000000e-01 |
6.801452000000000e-01 |
3.400000000000000e-06 |
1.649999999964180e-06 |
PASS |
Energy 10 |
1.000000000000000e+01 |
1.000000000000000e+01 |
1.000000000000000e-01 |
0.000000000000000e+00 |
PASS |
Sigma 10 |
8.405641800000000e-01 |
8.405641800000000e-01 |
4.200000000000000e-07 |
0.000000000000000e+00 |
PASS |