Input 02-fock-darwin.03-ground_state.inp

Commits > Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 > Run spack_foss-2022a_serial_debug

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 1 8.691680000000001e-01 8.691680000000001e-01 1.000000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 3 2.116862000000000e+00 2.116862000000000e+00 1.000000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 5 3.101960000000000e+00 3.101960000000000e+00 1.000000000000000e-05 0.000000000000000e+00 PASS
Eigenvalue 7 3.476506000000000e+00 3.476506000000000e+00 1.000000000000000e-05 0.000000000000000e+00 PASS
Compare to other inputs