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负载氧化锰生物炭对抗生素的选择性吸附及其定量构效关系模型的机理。

Selective adsorption of antibiotics on manganese oxide-loaded biochar and mechanism based on quantitative structure-property relationship model.

机构信息

College of Environment and Ecology, Chongqing University, Chongqing 400045, PR China.

College of Environment and Ecology, Chongqing University, Chongqing 400045, PR China; Key Laboratory of the Three Gorges Reservoir's Eco-Environments, Ministry of Education, Chongqing University, Chongqing 400045, PR China.

出版信息

Bioresour Technol. 2023 Jan;367:128262. doi: 10.1016/j.biortech.2022.128262. Epub 2022 Nov 4.

Abstract

In this study, MnCl-impregnated biomass was oxygen-limited pyrolyzed to produce manganese oxide-loaded biochar (MBC), its adsorption behaviors and influencing factors on tetracycline (TTC), norfloxacin (NOR), and sulfamethoxazole (SMX) were systematically investigated. Three antibiotics exhibited enhanced adsorption behavior on MBC, with maximum adsorption capacity as accurately described by Sips isotherm: TTC (534 mg/g) > NOR (67 mg/g) > SMX (28 mg/g). Hydrogen bonding, n/π-π interactions, electrostatic interaction, surface coordination, and hydrophobic interaction are the major mechanisms for the improved adsorption. Manganese oxide particles on MBC promoted surface coordination and hydrogen bonding. Antibiotic molecules with more hydroxyl oxygen-containing functional groups are more susceptible to migrate to biochar surfaces and to be adhered. Moreover, the quantitative structure-property relationship (QSPR) model was constructed and revealed that hydrogen bonding and π-π interactions were crucial for tetracycline antibiotics selective adsorption. Hence, MBC was a prospective adsorbent with promising applications for antibiotic removal in sewage processing.

摘要

在这项研究中,用 MnCl2 浸渍的生物质在缺氧条件下热解,制备了负载氧化锰的生物炭(MBC),系统研究了其对四环素(TTC)、诺氟沙星(NOR)和磺胺甲恶唑(SMX)的吸附行为及影响因素。三种抗生素在 MBC 上表现出增强的吸附行为,最大吸附容量可由 Sips 等温线准确描述:TTC(534mg/g)>NOR(67mg/g)>SMX(28mg/g)。氢键、n/π-π 相互作用、静电相互作用、表面配位和疏水相互作用是提高吸附的主要机制。MBC 上的氧化锰颗粒促进了表面配位和氢键。具有更多羟基含氧官能团的抗生素分子更容易迁移到生物炭表面并被吸附。此外,构建了定量构效关系(QSPR)模型,表明氢键和π-π 相互作用对四环素类抗生素的选择性吸附至关重要。因此,MBC 是一种有前景的吸附剂,有望应用于污水处理中抗生素的去除。

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