Input 03-helium_atom.02-ground_state.inp

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Run GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.500000000000000e-07 0.000000000000000e+00 PASS
Total energy -2.238251080000000e+00 -2.238251080000000e+00 1.500000000000000e-07 0.000000000000000e+00 PASS
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