Input 21-scissor.03-spectrum.inp

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Run spack_foss-2023a_serial

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 1.023054400000000e+01 1.023054100000000e+01 5.120000000000000e-06 2.999999999531155e-06 PASS
Energy 2 2.000000000000000e+00 2.000000000000000e+00 2.000000000000000e-02 0.000000000000000e+00 PASS
Sigma 2 6.478033300000000e-02 6.478031200000001e-02 3.240000000000000e-08 2.099999998894653e-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 4.772230900000000e-01 4.772229300000000e-01 2.390000000000000e-07 1.600000000268054e-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 8.734435699999999e-01 8.734432800000000e-01 4.370000000000000e-07 2.899999999028680e-07 PASS
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