Sorption behavior of oxytetracycline on microplastics and the influence of environmental factors in groundwater: Experimental investigation and molecular dynamics simulation.

IF 3.5 3区 环境科学与生态学 Q2 ENVIRONMENTAL SCIENCES
Fengjia Liu, Dan Zhang, Yufei Ma, Mengyao Jing, Guijuan Li, Shengke Yang
{"title":"Sorption behavior of oxytetracycline on microplastics and the influence of environmental factors in groundwater: Experimental investigation and molecular dynamics simulation.","authors":"Fengjia Liu, Dan Zhang, Yufei Ma, Mengyao Jing, Guijuan Li, Shengke Yang","doi":"10.1016/j.jconhyd.2024.104489","DOIUrl":null,"url":null,"abstract":"<p><p>Microplastics (MPs) and antibiotics can enter groundwater through the interaction of soil and surface water, and MPs as carriers of antibiotics can promote the migration of antibiotics and thus generate more serious ecological risks. Therefore, this paper used experimental and molecular dynamics (MD) simulation methods to investigate the sorption between four common types of MPs in groundwater, namely polyamide (PA), polystyrene (PS), polyvinyl chloride (PVC), and polyethylene (PE), and oxytetracycline (OTC) with high detection rate in groundwater. Additionally, the impact of environmental factors on sorption was examined. The sorption kinetics of the four types of MPs followed the pseudo-second-order kinetics model, and the sorption isotherms of OTC on PA, PE, and PVC were highly linear, suggesting that the electrostatic interaction was the main sorption mechanism. Both experimental and simulation results indicated that PA had the highest affinity for OTC, due to the effect of the formation of hydrogen bonding between the amide groups of PA and OTC. The primary way pH affected sorption was by altering the form in which OTC exists. The effects of the representative substances of protein-like component (bovine serum albumin) and humus-like component (humic acid) in dissolved organic matter varied but were generally inhibitory. Ions could influence the sorption process by competitive sorption or forming complexes with the OTC.</p>","PeriodicalId":15530,"journal":{"name":"Journal of contaminant hydrology","volume":"269 ","pages":"104489"},"PeriodicalIF":3.5000,"publicationDate":"2024-12-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of contaminant hydrology","FirstCategoryId":"93","ListUrlMain":"https://doi.org/10.1016/j.jconhyd.2024.104489","RegionNum":3,"RegionCategory":"环境科学与生态学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"ENVIRONMENTAL SCIENCES","Score":null,"Total":0}
引用次数: 0

Abstract

Microplastics (MPs) and antibiotics can enter groundwater through the interaction of soil and surface water, and MPs as carriers of antibiotics can promote the migration of antibiotics and thus generate more serious ecological risks. Therefore, this paper used experimental and molecular dynamics (MD) simulation methods to investigate the sorption between four common types of MPs in groundwater, namely polyamide (PA), polystyrene (PS), polyvinyl chloride (PVC), and polyethylene (PE), and oxytetracycline (OTC) with high detection rate in groundwater. Additionally, the impact of environmental factors on sorption was examined. The sorption kinetics of the four types of MPs followed the pseudo-second-order kinetics model, and the sorption isotherms of OTC on PA, PE, and PVC were highly linear, suggesting that the electrostatic interaction was the main sorption mechanism. Both experimental and simulation results indicated that PA had the highest affinity for OTC, due to the effect of the formation of hydrogen bonding between the amide groups of PA and OTC. The primary way pH affected sorption was by altering the form in which OTC exists. The effects of the representative substances of protein-like component (bovine serum albumin) and humus-like component (humic acid) in dissolved organic matter varied but were generally inhibitory. Ions could influence the sorption process by competitive sorption or forming complexes with the OTC.

求助全文
约1分钟内获得全文 求助全文
来源期刊
Journal of contaminant hydrology
Journal of contaminant hydrology 环境科学-地球科学综合
CiteScore
6.80
自引率
2.80%
发文量
129
审稿时长
68 days
期刊介绍: The Journal of Contaminant Hydrology is an international journal publishing scientific articles pertaining to the contamination of subsurface water resources. Emphasis is placed on investigations of the physical, chemical, and biological processes influencing the behavior and fate of organic and inorganic contaminants in the unsaturated (vadose) and saturated (groundwater) zones, as well as at groundwater-surface water interfaces. The ecological impacts of contaminants transported both from and to aquifers are of interest. Articles on contamination of surface water only, without a link to groundwater, are out of the scope. Broad latitude is allowed in identifying contaminants of interest, and include legacy and emerging pollutants, nutrients, nanoparticles, pathogenic microorganisms (e.g., bacteria, viruses, protozoa), microplastics, and various constituents associated with energy production (e.g., methane, carbon dioxide, hydrogen sulfide). The journal''s scope embraces a wide range of topics including: experimental investigations of contaminant sorption, diffusion, transformation, volatilization and transport in the surface and subsurface; characterization of soil and aquifer properties only as they influence contaminant behavior; development and testing of mathematical models of contaminant behaviour; innovative techniques for restoration of contaminated sites; development of new tools or techniques for monitoring the extent of soil and groundwater contamination; transformation of contaminants in the hyporheic zone; effects of contaminants traversing the hyporheic zone on surface water and groundwater ecosystems; subsurface carbon sequestration and/or turnover; and migration of fluids associated with energy production into groundwater.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信