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lines changed Original file line number Diff line number Diff line change @@ -270,7 +270,7 @@ These options tune the QEq solver and apply to both `qeq` and `hybrid` charge me
270270| ` --qeq-tolerance <TOL> ` | float | ` 1e-6 ` | Convergence tolerance for charge equilibration. |
271271| ` --qeq-max-iter <N> ` | integer | ` 100 ` | Maximum iterations for QEq solver. |
272272| ` --qeq-lambda <λ> ` | float | ` 0.5 ` | Orbital screening parameter λ (Rappe–Goddard). |
273- | ` --qeq-hydrogen-scf ` | flag | off | Enable hydrogen SCF (nonlinear hardness update). |
273+ | ` --qeq-hydrogen-scf ` | boolean | ` true ` | Enable hydrogen SCF (nonlinear hardness update). |
274274| ` --qeq-basis <TYPE> ` | ` gto ` , ` sto ` | ` sto ` | Basis function type for Coulomb integrals. |
275275| ` --qeq-damping <STRATEGY> ` | string | ` auto ` | SCF damping strategy. |
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