Input 07-casida-photons.06-spectrum.inp

Commits > Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 > Run spack_intel-2022a_serial_omp

Matches

Name Value Reference Precision Difference Status
Casida spectrum x 1.265008000000000e+01 1.265014000000000e+01 1.000000000000000e-04 -5.999999999950489e-05 PASS
Casida spectrum y 4.191456000000000e-01 4.191558000000000e-01 1.000000000000000e-04 -1.020000000001575e-05 PASS
Casida spectrum z 4.047809000000000e-01 4.047906000000000e-01 1.000000000000000e-04 -9.700000000001374e-06 PASS
Casida spectrum tot 4.491337000000000e+00 4.491362000000000e+00 1.000000000000000e-04 -2.499999999994174e-05 PASS
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