Microstructure of Al-substituted goethite and its adsorption performance for Pb(II) and As(V)

Naturally occurring goethite commonly undergoes Al-substitution, while how changes in microstructure in-duced by Al-substitution affect the interactive reaction of Pb(II) or As(V) at the goethite-water interface remains poorly understood. This study reveals the structural properties of Al-substituted goethite and its adsorption be-havior for Pb(II) and As(V) by multiple characterization techniques and Charge Distribution-Multisite Surface Complexation (CD-MUSIC) modeling. Al-substitution caused an obvious decrease in the length-to-width ratio in goethite particles and a slight decrease in the proportion of (110) facets. The presence of Al-O sites and higher surface roughness induced by Al-substitution contributed to a higher inner Stern layer capacitance (C-1) and sur -face charge density of goethite. CD-MUSIC modeling results further revealed that the affinity constant of Pb(II) complex (log K-Pb) at the goethite-water interface and the adsorption capacity of goethite for Pb(II) decreased with increasing amount of Al-substitution, while an opposite tendency was observed for As(V) adsorption. The dominant species of both Pb(II) and As(V) on goethite were bidentate complexes, and Al-substitution had a minor impact on the abundance of Pb(II) and As(V) complexes on the surface of goethite. Overall, these experi-mental and modeling results provide new and important insights into the interfacial reactivity of Al-substituted goethite and facilitate the prediction of the environmental fate of heavy metals. (c) 2021 Published by Elsevier B.V.