An Amberlite IRA-400 Cl(-) ion-exchange resin modified with Prosopis juliflora seeds as an efficient Pb(2+) adsorbent: adsorption, kinetics, thermodynamics, and computational modeling studies by density functional theory

以刺槐种子改性的Amberlite IRA-400 Cl(-)离子交换树脂作为高效Pb(2+)吸附剂:基于密度泛函理论的吸附、动力学、热力学和计算建模研究

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Abstract

A Prosopis juliflora-seed-modified Amberlite IRA-400 Cl(-) ion-exchange resin (hereafter denoted as SMA resin) is used for the removal of Pb(2+) from wastewater. SEM, EDX, FT-IR, BET, XRD, and XPS analyses were used to characterize the SMA resin. Parameters such as Pb(2+) concentration, pH, temperature, and time are optimized. The obtained results show that the SMA resin has high efficiency for the removal of Pb(2+) (73.45%) at a concentration of 100 mg L(-1) and a dosage of 0.01 g at pH 6. Thermodynamic studies indicate that the adsorption was spontaneous with negative ΔH° and ΔS° values at all temperatures; pseudo-second-order kinetics and the Langmuir adsorption isotherm provided the best fit (q (max) = 106 mg g(-1) and R (2) = 0.99) from 298 to 338 K. In addition, a diffusion-controlled mechanism at 298 K was observed from intra-particle studies. A desorption and recovery process has been applied successfully to the SMA adsorbent. The obtained results showed desorption of 90.7% at pH 2.5 with 86.3% recovery over six cycles. Furthermore, the DFT results suggest that all the functional groups of the SMA resin possibly bind with Pb(2+) and, of these, the -C[double bond, length as m-dash]O group shows the highest binding energy towards Pb(2+). Moreover, the high-efficiency removal of Pb(2+) from synthetic wastewater using the proposed SMA resin was demonstrated to show the real-life application potential.

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