Input 01-quadratic_box.04-spin_polarized.inp

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run foss-mpi-min: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-05 0.000000000000000e+00 PASS
Total energy 7.759249940000000e+00 7.759258320000000e+00 2.000000000000000e-05 -8.379999999696963e-06 PASS
Compare to other inputs