Input 14-absorption-spinors.04-spectrum.inp

Commits > Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 > Run foss_cmake: [foss2022a-serial, foss-min]

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 1.557697800000000e+01 1.557697600000000e+01 7.790000000000000e-06 2.000000000279556e-06 PASS
Energy 1 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 1 5.626809100000000e-02 5.626808100000000e-02 2.810000000000000e-08 1.000000000167534e-08 PASS
Anisotropy 1 6.375579100000001e-02 6.375581000000001e-02 3.190000000000000e-08 -1.900000000387703e-08 PASS
Energy 2 2.000000000000000e+00 2.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 2 1.959164200000000e-01 1.959163900000000e-01 9.800000000000000e-08 3.000000001196490e-08 PASS
Anisotropy 2 2.111039500000000e-01 2.111039000000000e-01 1.060000000000000e-06 5.000000000143778e-08 PASS
Energy 3 3.000000000000000e+00 3.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 3 3.356466800000000e-01 3.356466500000000e-01 1.680000000000000e-07 2.999999998420932e-08 PASS
Anisotropy 3 3.392687500000000e-01 3.392687200000000e-01 1.700000000000000e-07 2.999999998420932e-08 PASS
Energy 4 4.000000000000000e+00 4.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 4 3.763940900000000e-01 3.763940800000000e-01 1.880000000000000e-07 9.999999994736442e-09 PASS
Anisotropy 4 3.572506700000000e-01 3.572506500000000e-01 1.790000000000000e-07 1.999999998947288e-08 PASS
Energy 5 5.000000000000000e+00 5.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 5 2.830283300000000e-01 2.830283400000000e-01 1.420000000000000e-07 -9.999999994736442e-09 PASS
Anisotropy 5 2.544257700000000e-01 2.544257600000000e-01 1.270000000000000e-07 9.999999994736442e-09 PASS
Energy 6 6.000000000000000e+00 6.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 6 1.258708000000000e-01 1.258708200000000e-01 6.290000000000000e-08 -1.999999998947288e-08 PASS
Anisotropy 6 1.091257500000000e-01 1.091257700000000e-01 5.460000000000000e-08 -2.000000000335067e-08 PASS
Energy 7 7.000000000000000e+00 7.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 7 1.506942900000000e-02 1.506942600000000e-02 7.530000000000000e-09 3.000000000155656e-09 PASS
Anisotropy 7 1.594790900000000e-02 1.594791200000000e-02 7.970000000000000e-09 -3.000000001890379e-09 PASS
Energy 8 8.000000000000000e+00 8.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 8 -6.918995700000000e-03 -6.918995400000000e-03 3.460000000000000e-09 -2.999999996686209e-10 PASS
Anisotropy 8 9.046485500000000e-03 9.046483899999999e-03 4.520000000000000e-09 1.600000000545609e-09 PASS
Energy 9 9.000000000000000e+00 9.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 9 1.346759300000000e-02 1.346759200000000e-02 6.730000000000000e-09 9.999999994736442e-10 PASS
Anisotropy 9 2.066263200000000e-02 2.066263000000000e-02 1.030000000000000e-07 1.999999998947288e-09 PASS
Energy 10 1.000000000000000e+01 1.000000000000000e+01 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 10 1.898198900000000e-02 1.898199000000000e-02 9.490000000000000e-08 -1.000000002943091e-09 PASS
Anisotropy 10 1.963064800000000e-02 1.963064900000000e-02 9.820000000000000e-09 -9.999999994736442e-10 PASS
Compare to other inputs