Input 14-absorption-spinors.04-spectrum.inp
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Electronic sum rule | 9.606390000000000e-01 | 9.606390000000000e-01 | 4.800000000000000e-05 | 0.000000000000000e+00 | PASS |
| Static polarizability | 1.557698800000000e+01 | 1.557698800000000e+01 | 7.790000000000000e-06 | 0.000000000000000e+00 | PASS |
| Energy 1 | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 1 | 5.626811200000000e-02 | 5.626811100000000e-02 | 2.810000000000000e-08 | 9.999999994736442e-10 | PASS |
| Anisotropy 1 | 6.375587100000001e-02 | 6.375587000000001e-02 | 1.100000000000000e-09 | 9.999999994736442e-10 | PASS |
| Energy 2 | 2.000000000000000e+00 | 2.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 2 | 1.959166300000000e-01 | 1.959166400000000e-01 | 9.800000000000000e-08 | -9.999999994736442e-09 | PASS |
| Anisotropy 2 | 2.111042500000000e-01 | 2.111039000000000e-01 | 1.060000000000000e-06 | 3.499999999823089e-07 | PASS |
| Energy 3 | 3.000000000000000e+00 | 3.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 3 | 3.356472300000000e-01 | 3.356472300000000e-01 | 1.680000000000000e-07 | 0.000000000000000e+00 | PASS |
| Anisotropy 3 | 3.392693000000000e-01 | 3.392693000000000e-01 | 1.700000000000000e-06 | 0.000000000000000e+00 | PASS |
| Energy 4 | 4.000000000000000e+00 | 4.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 4 | 3.763945700000000e-01 | 3.763945700000000e-01 | 1.880000000000000e-07 | 0.000000000000000e+00 | PASS |
| Anisotropy 4 | 3.572510200000000e-01 | 3.572510200000000e-01 | 1.790000000000000e-07 | 0.000000000000000e+00 | PASS |
| Energy 5 | 5.000000000000000e+00 | 5.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 5 | 2.830281400000000e-01 | 2.830281400000000e-01 | 1.420000000000000e-07 | 0.000000000000000e+00 | PASS |
| Anisotropy 5 | 2.544255200000000e-01 | 2.544255200000000e-01 | 1.270000000000000e-09 | 0.000000000000000e+00 | PASS |
| Energy 6 | 6.000000000000000e+00 | 6.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 6 | 1.258700400000000e-01 | 1.258700400000000e-01 | 1.260000000000000e-15 | 0.000000000000000e+00 | PASS |
| Anisotropy 6 | 1.091250800000000e-01 | 1.091250800000000e-01 | 5.460000000000000e-08 | 0.000000000000000e+00 | PASS |
| Energy 7 | 7.000000000000000e+00 | 7.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 7 | 1.506891700000000e-02 | 1.506891700000000e-02 | 1.510000000000000e-16 | -1.734723475976807e-18 | PASS |
| Anisotropy 7 | 1.594755900000000e-02 | 1.594755900000000e-02 | 7.970000000000000e-09 | 0.000000000000000e+00 | PASS |
| Energy 8 | 8.000000000000000e+00 | 8.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 8 | -6.918869300000000e-03 | -6.918869300000000e-03 | 3.460000000000000e-09 | 0.000000000000000e+00 | PASS |
| Anisotropy 8 | 9.046546700000000e-03 | 9.046546750000000e-03 | 5.500000000000000e-11 | -5.000000066757160e-11 | PASS |
| Energy 9 | 9.000000000000000e+00 | 9.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 9 | 1.346786400000000e-02 | 1.346786400000000e-02 | 6.730000000000000e-10 | 0.000000000000000e+00 | PASS |
| Anisotropy 9 | 2.066281700000000e-02 | 2.066281700000000e-02 | 1.030000000000000e-08 | 0.000000000000000e+00 | PASS |
| Energy 10 | 1.000000000000000e+01 | 1.000000000000000e+01 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 10 | 1.898190300000000e-02 | 1.898199000000000e-02 | 9.490000000000000e-08 | -8.700000000277930e-08 | PASS |
| Anisotropy 10 | 1.963052300000000e-02 | 1.963052300000000e-02 | 9.820000000000000e-09 | 0.000000000000000e+00 | PASS |