Input 04-jellium.01-ground_state.inp

Commits > Commit 85779d3dd9ec6e18544835020e079bae8c405b87 > Run spack_foss-2022a_cuda_mpi_omp

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Total energy -5.765200100000000e-01 -5.765203200000000e-01 1.000000000000000e-04 3.100000000033631e-07 PASS
Eigenvalue [s] -1.677000000000000e-01 -1.676980000000000e-01 1.000000000000000e-04 -1.999999999974245e-06 PASS
Eigenvalue [p] -1.226370000000000e-01 -1.226360000000000e-01 1.000000000000000e-04 -1.000000000001000e-06 PASS
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