Input 21-scissor.03-spectrum.inp
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Electronic sum rule | 2.651762000000000e+00 | 2.651761000000000e+00 | 1.330000000000000e-05 | 1.000000000139778e-06 | PASS |
| Static polarizability | 1.023054500000000e+01 | 1.023054100000000e+01 | 5.120000000000000e-06 | 3.999999998782755e-06 | PASS |
| Energy 2 | 2.000000000000000e+00 | 2.000000000000000e+00 | 2.000000000000000e-02 | 0.000000000000000e+00 | PASS |
| Sigma 2 | 6.478033399999999e-02 | 6.478031200000001e-02 | 3.240000000000000e-08 | 2.199999998842017e-08 | PASS |
| Energy 4 | 4.000000000000000e+00 | 4.000000000000000e+00 | 4.000000000000000e-02 | 0.000000000000000e+00 | PASS |
| Sigma 4 | 2.405210400000000e-01 | 2.405209600000000e-01 | 1.200000000000000e-07 | 7.999999998564711e-08 | PASS |
| Energy 6 | 6.000000000000000e+00 | 6.000000000000000e+00 | 6.000000000000000e-02 | 0.000000000000000e+00 | PASS |
| Sigma 6 | 4.772231000000000e-01 | 4.772229300000000e-01 | 2.390000000000000e-07 | 1.700000000215418e-07 | PASS |
| Energy 8 | 8.000000000000000e+00 | 8.000000000000000e+00 | 8.000000000000000e-02 | 0.000000000000000e+00 | PASS |
| Sigma 8 | 7.089097900000000e-01 | 7.089095500000000e-01 | 3.540000000000000e-07 | 2.399999999846969e-07 | PASS |
| Energy 10 | 1.000000000000000e+01 | 1.000000000000000e+01 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 10 | 8.734435800000000e-01 | 8.734432800000000e-01 | 4.370000000000000e-07 | 2.999999999531155e-07 | PASS |