Input 07-qoct+tddft.01-ground_state.inp

Commits > Commit b15abc005d0b5301cd748c91bbd98ee634ebaa25 > Run spack_intel-2022a_serial_omp

Matches

Name Value Reference Precision Difference Status
Total energy 3.350893350000000e+00 3.350893320000000e+00 1.000000000000000e-04 3.000000026176508e-08 PASS
Eigenvalue 1.372935000000000e+00 1.372935000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Eigenvalue 1.481456000000000e+00 1.481456000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
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