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

Commits > Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 > Run cmake_foss_2022a_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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