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

Commits > Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 > Run foss-serial-min: [foss2022a-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 1.557699500000000e+01 1.557697600000000e+01 7.790000000000000e-06 1.899999999999125e-05 FAIL
Energy 1 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 1 5.626818500000000e-02 5.626808100000000e-02 2.810000000000000e-08 1.040000000007701e-07 FAIL
Anisotropy 1 6.375587500000000e-02 6.375581000000001e-02 3.190000000000000e-08 6.499999999354245e-08 FAIL
Energy 2 2.000000000000000e+00 2.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 2 1.959166700000000e-01 1.959163900000000e-01 9.800000000000000e-08 2.799999999913982e-07 FAIL
Anisotropy 2 2.111041700000000e-01 2.111039000000000e-01 1.060000000000000e-06 2.699999999966618e-07 PASS
Energy 3 3.000000000000000e+00 3.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 3 3.356469600000000e-01 3.356466500000000e-01 1.680000000000000e-07 3.100000000033631e-07 FAIL
Anisotropy 3 3.392690100000000e-01 3.392687200000000e-01 1.700000000000000e-07 2.899999999583791e-07 FAIL
Energy 4 4.000000000000000e+00 4.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 4 3.763941900000000e-01 3.763940800000000e-01 1.880000000000000e-07 1.099999999976120e-07 PASS
Anisotropy 4 3.572507600000000e-01 3.572506500000000e-01 1.790000000000000e-07 1.099999999976120e-07 PASS
Energy 5 5.000000000000000e+00 5.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 5 2.830282200000000e-01 2.830283400000000e-01 1.420000000000000e-07 -1.199999999923484e-07 PASS
Anisotropy 5 2.544256800000000e-01 2.544257600000000e-01 1.270000000000000e-07 -8.000000001340268e-08 PASS
Energy 6 6.000000000000000e+00 6.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 6 1.258706100000000e-01 1.258708200000000e-01 6.290000000000000e-08 -2.100000000004876e-07 FAIL
Anisotropy 6 1.091255900000000e-01 1.091257700000000e-01 5.460000000000000e-08 -1.800000000024005e-07 FAIL
Energy 7 7.000000000000000e+00 7.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 7 1.506929100000000e-02 1.506942600000000e-02 7.530000000000000e-09 -1.350000000000656e-07 FAIL
Anisotropy 7 1.594780200000000e-02 1.594791200000000e-02 7.970000000000000e-09 -1.100000000010815e-07 FAIL
Energy 8 8.000000000000000e+00 8.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 8 -6.919052200000000e-03 -6.918995400000000e-03 3.460000000000000e-09 -5.680000000028718e-08 FAIL
Anisotropy 8 9.046507500000000e-03 9.046483899999999e-03 4.520000000000000e-09 2.360000000110885e-08 FAIL
Energy 9 9.000000000000000e+00 9.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 9 1.346756600000000e-02 1.346759200000000e-02 6.730000000000000e-09 -2.600000000019254e-08 FAIL
Anisotropy 9 2.066257100000000e-02 2.066263000000000e-02 1.030000000000000e-07 -5.900000000017003e-08 PASS
Energy 10 1.000000000000000e+01 1.000000000000000e+01 1.000000000000000e-01 0.000000000000000e+00 PASS
Sigma 10 1.898194900000000e-02 1.898199000000000e-02 9.490000000000000e-08 -4.100000000270554e-08 PASS
Anisotropy 10 1.963058000000000e-02 1.963064900000000e-02 9.820000000000000e-09 -6.899999999837592e-08 FAIL
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