Input 01-quadratic_box.04-spin_polarized.inp

Commits > Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 > Run spack_foss-2023a_serial_debug

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-05 0.000000000000000e+00 PASS
Total energy 7.759250060000000e+00 7.759258320000000e+00 2.000000000000000e-05 -8.259999999538081e-06 PASS
Compare to other inputs