Input 09-angular_momentum.01-gs.inp

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Run spack_foss-2022a_mpi

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Initial energy -2.319595865000000e+01 -2.319595865000000e+01 1.160000000000000e-07 0.000000000000000e+00 PASS
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