Bidentate complexation modeling of heavy metal adsorption and competition on goethite
Document Type
Article
Publication Date
4-1-2006
Abstract
Accurate sorption modeling is critical for environmental risk assessment and development of sound remedial technologies. Adsorption to iron oxide phases is one of the important sorption processes regulating the bioavailability and toxicity of metal ions in natural systems. In this study, we used spectroscopically derived bidentate surface species to constrain surface complexation modeling in addressing Ni(II) and Zn(II) adsorption and competition on goethite surfaces. The 2-pKa triple layer model successfully predicted adsorption in single adsorbate systems. The curvature in adsorption isotherms was accurately depicted using two types of sites: high affinity and low affinity, and mononuclear bidentate surface complexes. A constrained set of parameters was found for each metal (log KL = -6.63 and log K H = -2.45 for Ni, log KL = -3.92 and log KH = 2.14 for Zn) that successfully described adsorption over a large range of experimental conditions, covering 6 to 7 orders of magnitude in concentration, ionic strength from 10-3 to 10-2, and environmentally relevant pH range between 4 and 6.5. Adsorption competition was predicted using the bidentate surface species with parameters calibrated using single adsorbate data. © 2006 American Chemical Society.
Identifier
33645781578 (Scopus)
Publication Title
Environmental Science and Technology
External Full Text Location
https://doi.org/10.1021/es051916e
ISSN
0013936X
PubMed ID
16646455
First Page
2213
Last Page
2218
Issue
7
Volume
40
Recommended Citation
Xu, Ying; Axe, Lisa; Yee, Nathan; and Dyer, James A., "Bidentate complexation modeling of heavy metal adsorption and competition on goethite" (2006). Faculty Publications. 19016.
https://digitalcommons.njit.edu/fac_pubs/19016
