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

Commits > Commit 8f782d5cf55620fdc67b764848371cb8de44e683 > Run spack_intel-2022a_impi_omp

Matches

Name Value Reference Precision Difference Status
Casida spectrum x 1.265021000000000e+01 1.265014000000000e+01 1.000000000000000e-04 6.999999999912632e-05 PASS
Casida spectrum y 4.191706000000000e-01 4.191558000000000e-01 1.000000000000000e-04 1.479999999998149e-05 PASS
Casida spectrum z 4.048046000000000e-01 4.047906000000000e-01 1.000000000000000e-04 1.400000000001400e-05 PASS
Casida spectrum tot 4.491396000000000e+00 4.491362000000000e+00 1.000000000000000e-04 3.400000000031156e-05 PASS
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