Journal
JOURNAL OF HAZARDOUS MATERIALS
Volume 430, Issue -, Pages -Publisher
ELSEVIER
DOI: 10.1016/j.jhazmat.2022.128500
Keywords
Quinolone antibiotics; Adsorption; Thermal activation; Kaolin; Computer simulation; Density functional calculation theory
Categories
Funding
- Start-up Grant for Young Talented Researchers of Qingdao University [QDPYHT-5-065]
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Quinolone antibiotics pose potential hazards to the environment and human health. This study combined experimental and theoretical approaches to investigate the adsorption properties of norfloxacin, ciprofloxacin, and ofloxacin on modified thermally activated kaolin. Factors influencing adsorption were discussed, and the adsorption processes were well described by the pseudo-second order kinetic and Langmuir model. Adsorption removal efficiency for the three antibiotics reached high percentages. Cations were found to inhibit adsorption, but good adsorption capacity was maintained after several cycles. Simulation results revealed the adsorption mechanism, shedding new light on the removal of quinolone antibiotics and providing a low-cost and efficient solution using modified kaolin.
Quinolone antibiotics (QNs) can be potential hazard to environment and human. Combination of experimental and theoretical studies was used to analyze the adsorption properties of norfloxacin, ciprofloxacin and ofloxacin on modified thermally activated kaolin (KL). Main factors (calcination temperature, dose, pH, cations and regeneration) affecting the adsorption were discussed. Adsorption processes fit the pseudo-second order kinetic and Langmuir model well. The adsorption removal of norfloxacin, ciprofloxacin and ofloxacin can reach 88.53%, 89.43% and 91.46%, respectively. Cations inhibited adsorption, and AlS-KLB can maintain 80% efficiency in five cycles under optimal conditions. Simulations showed that the materials had good adsorption capacity for QNs, and the (1) of KL had the best capacity. Simulations explain the adsorption mechanism: F, H, O atoms of QNs are covalently bonded to O atoms from KL, Al2O3 and Al (OH)(3), C atoms from amorphous carbon and H atoms from C-H and Al (OH)(3). The Al atoms of Al2O3 and Al, Si atoms of KL are ionically bonded to F, H, O atoms of QNs. This study shed new light on the removal of QNs by providing low-cost and efficient modified KL and elucidating the adsorption mechanism in conjunction with DFT simulations.
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