Adsorption behaviors and mechanism of heavy metals onto attapulgite functionalized by polyamine silane.

Pollution from heavy‐metal ions has become a major challenge to the global fight against environmental pollution. Given the availability of various low‐cost and environmentally friendly adsorbents, adsorption has become the most efficient technology for the removal of heavy metals from water. In this study, attapulgite (ATP) was directly functionalized by coupling with an aminosilane agent. Analysis showed this maneuver provided a suitable adsorbent for the removal of lead ion (Pb2+) from an aqueous solution. The effects of several parameters including solution pH, contacting time, adsorbent dosage, and initial Pb2+ ion concentration were investigated. Batch sorption results showed that the adsorption process was rapid and over 98% of Pb2+ was removed within 30 min at the optimal pH 4.0. The maximum adsorption capacity at 25°C, calculated by the Langmuir isotherm, was 82.17, 78.80, 61.13, and 28.56 mg/g for γ‐divinyltriaminepropyl‐methyldimethoxylsilane‐grafted attapulgite (KH‐103‐ATP), γ‐aminopropyl‐methyldiethoxysilane‐grafted attapulgite (KH‐912‐ATP), N‐(β‐aminoethyl‐γ‐aminopropyl)‐methyl‐dimethoxysilane‐grafted attapulgite (KH‐602‐ATP), and ATP, respectively. Moreover, molecular dynamics simulations of adsorption behaviors of heavy‐metal ions at attapulgite surfaces (010) modified by aminosilane agents were carried out. Both the PMF value and diffusion coefficient of metal ions suggest that KH‐103‐ATP owns the highest rate constant and capacity compared with the other two. And the analysis of free energy and results of XPS characterization revealed that Pb2+ formed covalent bonds with the nitrogen atom of aminosilane agents. [ABSTRACT FROM AUTHOR]