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

Commits > Commit efc44ae2259e56922145db535c825ce53e4127cb > Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]

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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