Input 14-absorption-spinors.04-spectrum.inp
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run intel_omp_autotools: [intel2023a-serial]
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 | 1.557697600000000e+01 | 7.790000000000000e-06 | 1.199999999990098e-05 | FAIL |
| Energy 1 | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 1 | 5.626811200000000e-02 | 5.626808100000000e-02 | 2.810000000000000e-08 | 3.100000000449965e-08 | FAIL |
| Anisotropy 1 | 6.375587100000001e-02 | 6.375581000000001e-02 | 3.190000000000000e-08 | 6.099999999564787e-08 | FAIL |
| Energy 2 | 2.000000000000000e+00 | 2.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 2 | 1.959166300000000e-01 | 1.959163900000000e-01 | 9.800000000000000e-08 | 2.400000000124525e-07 | FAIL |
| 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 | 3.356466500000000e-01 | 1.680000000000000e-07 | 5.800000000277805e-07 | FAIL |
| Anisotropy 3 | 3.392693000000000e-01 | 3.392687200000000e-01 | 1.700000000000000e-07 | 5.799999999722694e-07 | FAIL |
| Energy 4 | 4.000000000000000e+00 | 4.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 4 | 3.763945700000000e-01 | 3.763940800000000e-01 | 1.880000000000000e-07 | 4.899999999641302e-07 | FAIL |
| Anisotropy 4 | 3.572510200000000e-01 | 3.572506500000000e-01 | 1.790000000000000e-07 | 3.699999999717818e-07 | FAIL |
| Energy 5 | 5.000000000000000e+00 | 5.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 5 | 2.830281400000000e-01 | 2.830283400000000e-01 | 1.420000000000000e-07 | -2.000000000057511e-07 | FAIL |
| Anisotropy 5 | 2.544255200000000e-01 | 2.544257600000000e-01 | 1.270000000000000e-07 | -2.399999999846969e-07 | FAIL |
| Energy 6 | 6.000000000000000e+00 | 6.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 6 | 1.258700400000000e-01 | 1.258708200000000e-01 | 6.290000000000000e-08 | -7.800000000057761e-07 | FAIL |
| Anisotropy 6 | 1.091250800000000e-01 | 1.091257700000000e-01 | 5.460000000000000e-08 | -6.899999999976369e-07 | FAIL |
| Energy 7 | 7.000000000000000e+00 | 7.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 7 | 1.506891700000000e-02 | 1.506942600000000e-02 | 7.530000000000000e-09 | -5.090000000009670e-07 | FAIL |
| Anisotropy 7 | 1.594755900000000e-02 | 1.594791200000000e-02 | 7.970000000000000e-09 | -3.530000000015465e-07 | FAIL |
| Energy 8 | 8.000000000000000e+00 | 8.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 8 | -6.918869300000000e-03 | -6.918995400000000e-03 | 3.460000000000000e-09 | 1.261000000000664e-07 | FAIL |
| Anisotropy 8 | 9.046546799999999e-03 | 9.046483899999999e-03 | 4.520000000000000e-09 | 6.290000000019891e-08 | FAIL |
| Energy 9 | 9.000000000000000e+00 | 9.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Sigma 9 | 1.346786400000000e-02 | 1.346759200000000e-02 | 6.730000000000000e-09 | 2.719999999990785e-07 | FAIL |
| Anisotropy 9 | 2.066281700000000e-02 | 2.066263000000000e-02 | 1.030000000000000e-07 | 1.869999999987160e-07 | FAIL |
| 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 | 1.963064900000000e-02 | 9.820000000000000e-09 | -1.259999999995987e-07 | FAIL |