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Unveiling the green synthesis of WO3 nanoparticles by using beetroot (Beta vulgaris) extract for photocatalytic oxidation of rhodamine B. 揭示甜菜根(β vulgaris)提取物光催化氧化罗丹明B的WO3纳米颗粒的绿色合成。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-10 DOI: 10.1016/j.chemosphere.2024.143890
Fadhila Anggraini, Is Fatimah, Galih Dwiki Ramanda, Nunung Nurlaela, Hiroko Kawaii Wijayanti, Suresh Sagadevan, Won-Chun Oh, Ruey-An Doong
{"title":"Unveiling the green synthesis of WO<sub>3</sub> nanoparticles by using beetroot (Beta vulgaris) extract for photocatalytic oxidation of rhodamine B.","authors":"Fadhila Anggraini, Is Fatimah, Galih Dwiki Ramanda, Nunung Nurlaela, Hiroko Kawaii Wijayanti, Suresh Sagadevan, Won-Chun Oh, Ruey-An Doong","doi":"10.1016/j.chemosphere.2024.143890","DOIUrl":"10.1016/j.chemosphere.2024.143890","url":null,"abstract":"<p><p>Tungsten oxide (WO<sub>3</sub>) nanoparticles (WO<sub>3</sub>NPs) were prepared using beetroot (Beta vulgaris) extract. The synthesis was optimized by evaluating the effect of pH during the reduction of the WO<sub>3</sub> precursor and sintering temperature. Physicochemical characterization of the formed nanoparticles was performed using X-ray diffraction (XRD), scanning electron microscopy (SEM), X-ray photoelectron spectroscopy (XPS), and UV-visible diffuse reflectance UV-visible spectroscopy. Furthermore, the prepared WO<sub>3</sub>NPs were employed as photocatalyst for rhodamine B removal over the photocatalytic oxidation mechanism. Synthesis optimization revealed that a single phase of WO<sub>3</sub>NPs obtained by reduction at pH 4 and a sintering temperature of 550 °C. XRD and XPS measurements revealed that the single-phase WO<sub>3</sub>NPs was obtained with a crystallite size of 26.4 nm. SEM and transmission electron microscopy (TEM) indicated polymorphic forms, predominantly as nanorods, with a mean particle size of 24 nm. The WO<sub>3</sub>NPs have a band gap energy of 2.9 eV, supporting their performance as a photocatalyst. Evaluation of the photocatalytic activities of WO<sub>3</sub>NPs represents high activity and reusability of the material. A removal efficiency of 99.67% was achieved during 30 min of treatment under UV light illumination. A study on the effect of scavengers revealed the important role of hydroxy radicals in the photocatalysis mechanism. WO<sub>3</sub>NPs can be recycled and reused for photocatalysis, maintaining photoactivity for five cycles.</p>","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143890"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142804086","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Retraction notice to "Adsorptive removal of Pb(II) ions onto surface modified adsorbents derived from Cassia fistula seeds: Optimization and modelling study" [Chemosphere 283 (2021) 131276]. “决明子种子表面改性吸附剂吸附去除Pb(II)离子:优化和建模研究”[Chemosphere 283(2021) 131276]。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-14 DOI: 10.1016/j.chemosphere.2024.143825
R V Hemavathy, A Saravanan, P Senthil Kumar, Dai-Viet N Vo, S Karishma, S Jeevanantham
{"title":"Retraction notice to \"Adsorptive removal of Pb(II) ions onto surface modified adsorbents derived from Cassia fistula seeds: Optimization and modelling study\" [Chemosphere 283 (2021) 131276].","authors":"R V Hemavathy, A Saravanan, P Senthil Kumar, Dai-Viet N Vo, S Karishma, S Jeevanantham","doi":"10.1016/j.chemosphere.2024.143825","DOIUrl":"10.1016/j.chemosphere.2024.143825","url":null,"abstract":"","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143825"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142831127","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Investigation of adsorption parameters of saxitoxin onto loblolly pine-derived biochar synthesized at various pyrolysis temperature. 不同热解温度下火炬松生物炭对石笋毒素吸附参数的研究
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-20 DOI: 10.1016/j.chemosphere.2024.143965
Cadianne Chambers, Savannah Grimes, Russell C Smith, Ayden Weil, M Toufiq Reza
{"title":"Investigation of adsorption parameters of saxitoxin onto loblolly pine-derived biochar synthesized at various pyrolysis temperature.","authors":"Cadianne Chambers, Savannah Grimes, Russell C Smith, Ayden Weil, M Toufiq Reza","doi":"10.1016/j.chemosphere.2024.143965","DOIUrl":"10.1016/j.chemosphere.2024.143965","url":null,"abstract":"<p><p>This study highlights the use of loblolly pine derived biochar for the removal of harmful algal bloom toxin, Saxitoxin (STX), from water. Biochar samples were prepared at varying pyrolysis temperatures (400, 600 and 800 °C) for 60 min. As pyrolysis temperature increases, enhancement in surface porosity was observed (S<sub>BET</sub> = 7.26 ± 0.2 m<sup>2</sup>/g to 408.15 ± 6.19 m<sup>2</sup>/g) while a decline in oxygen-containing functional groups was observed (1517.80 ± 14.98 μmol/g to 823.01 ± 7.72 μmol/g). This study aimed to discover the effects of adsorption parameters such as biochar dosage amount, contact time, initial concentration and initial pH on Saxitoxin adsorption. These studies revealed impressive results with >90 % toxin removal with dosage rate of 0.01 g/L, contact time of 30 min, and increasing percent removal with increasing initial STX concentration and initial pH in water. Maximum uptake was calculated for P400 with adsorption capacity of 314.37 μg/g. This showed that surface functionality showed higher affinity for STX uptake, which may be possible due to hydrogen bonding, electrostatic interactions, ion-exchange, and π-π interactions. Applied kinetic models indicated both physisorption and chemisorption interactions with best fit supporting the Elovich models. Complementary, adsorption isotherm analysis confirmed the multilayer adsorption behavior of the Freundlich model. Therefore, these findings support the viable use of biochar material for the remediation of STX waters.</p>","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143965"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142857341","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Perfluorooctanesulfonic acid (PFOS) removal from aqueous solution through N-doped porous copper-carbon composite derived from recycled copper obtained from fly ash incinerator: Water decontamination via municipal waste remnants. 通过从飞灰焚化炉获得的回收铜衍生的n掺杂多孔铜碳复合材料从水溶液中去除全氟辛烷磺酸:通过城市废物残留物对水进行净化。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-19 DOI: 10.1016/j.chemosphere.2024.143963
Mohammad Ali Yavari, Hossein Molla Nadali Pishnamaz, Majid Baghdadi, Mohammad Ali Abdoli
{"title":"Perfluorooctanesulfonic acid (PFOS) removal from aqueous solution through N-doped porous copper-carbon composite derived from recycled copper obtained from fly ash incinerator: Water decontamination via municipal waste remnants.","authors":"Mohammad Ali Yavari, Hossein Molla Nadali Pishnamaz, Majid Baghdadi, Mohammad Ali Abdoli","doi":"10.1016/j.chemosphere.2024.143963","DOIUrl":"10.1016/j.chemosphere.2024.143963","url":null,"abstract":"<p><p>Invincible growth in waste production is the consequence of overpopulation, which should be addressed to reduce the occupied landfill surface needed for their disposal and to alleviate the leachate of extremely hazardous material into the soil and water bodies. In this study, copper (Cu) was extracted from fly ash of a municipal solid waste incinerator by an electro-chemical method, which was optimized to recover the highest amount of Cu, and then it was chelated with 4-aminobenzoic acid (AM) and terephthalic acid (TM) in an aqueous phase. The obtained composites were then heated to form a porous calcinated copper-carbon composite and utilized to adsorb the forever contaminant of PFOS from aqueous solutions. As the calcinated composite of Cu/AM with a ratio of 1:1 removed a greater amount of PFOS from the aqueous solution than Cu/TA, it was utilized as the ultimate adsorbent. The platform adsorbent was subjected to multiple characterizations, including XRD, FESEM, elemental mapping, TEM, BET, EDS, ICP-OES, FTIR, DLS, and point of zero charges, as well as optimization of several operational parameters involving pH, adsorbent dosage, initial PFOS concentration, and contact time. At the neutral pH, under the optimal conditions (adsorbent dosage of 1 g L<sup>-1</sup> and 5 h), 97.23% of PFOS was eliminated from the solution spiked with 5 mg L<sup>-1</sup> of PFOS. The equilibrium data were best fitted with Frundlich isotherm, and the maximum adsorption capacity of 402 mg g<sup>-1</sup> was achieved. The optimal conditions were also applied to PFOA, demonstrating high adsorption of different types of PFAS. The recovery tests of the adsorbent conducted 5 times on the solution spiked with 10 mg L<sup>-1</sup> of PFOS showed a slight decrease in PFOS removal at least for 5 regeneration cycles, demonstrating the high adsorption capacity and its reusability, thereby validating its feasibility for large-scale applications.</p>","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143963"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142857344","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Retraction notice to "Enhancement of lipid accumulation in microalga Desmodesmus sp. VV2: Response surface methodology and artificial neural network modeling for biodiesel production" [Chemosphere 293 (2022) 133477]. 关于 "Enhancement of lipid accumulation in microalga Desmodesmus sp:生物柴油生产的响应面方法和人工神经网络建模" [Chemosphere 293 (2022) 133477]。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-14 DOI: 10.1016/j.chemosphere.2024.143837
Elamathi Vimali, Arumugasamy Senthil Kumar, Nagamalai Sakthi Vignesh, Balasubramaniem Ashokkumar, Amarajothi Dhakshinamoorthy, Aswathy Udayan, Muthu Arumugam, Arivalagan Pugazhendhi, Perumal Varalakshmi
{"title":"Retraction notice to \"Enhancement of lipid accumulation in microalga Desmodesmus sp. VV2: Response surface methodology and artificial neural network modeling for biodiesel production\" [Chemosphere 293 (2022) 133477].","authors":"Elamathi Vimali, Arumugasamy Senthil Kumar, Nagamalai Sakthi Vignesh, Balasubramaniem Ashokkumar, Amarajothi Dhakshinamoorthy, Aswathy Udayan, Muthu Arumugam, Arivalagan Pugazhendhi, Perumal Varalakshmi","doi":"10.1016/j.chemosphere.2024.143837","DOIUrl":"10.1016/j.chemosphere.2024.143837","url":null,"abstract":"","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143837"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142831221","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Retraction notice to "Utilization of agricultural lignocellulosic wastes for biofuels and green diesel production" [Chemosphere 290(2022) 133246]. 关于 "利用农业木质纤维素废弃物生产生物燃料和绿色柴油 "的撤稿通知 [Chemosphere 290(2022) 133246]。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-14 DOI: 10.1016/j.chemosphere.2024.143827
Chaitanya Kumar Reddy Pocha, Shir Reen Chia, Wen Yi Chia, Apurav Krishna Koyande, Saifuddin Nomanbhay, Kit Wayne Chew
{"title":"Retraction notice to \"Utilization of agricultural lignocellulosic wastes for biofuels and green diesel production\" [Chemosphere 290(2022) 133246].","authors":"Chaitanya Kumar Reddy Pocha, Shir Reen Chia, Wen Yi Chia, Apurav Krishna Koyande, Saifuddin Nomanbhay, Kit Wayne Chew","doi":"10.1016/j.chemosphere.2024.143827","DOIUrl":"10.1016/j.chemosphere.2024.143827","url":null,"abstract":"","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143827"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142831223","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Assessing PFAS in drinking water: Insights from the Czech Republic's risk-based monitoring approach. 评估饮用水中的PFAS:来自捷克共和国基于风险的监测方法的见解。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-26 DOI: 10.1016/j.chemosphere.2024.143969
Frantisek Kozisek, Darina Dvorakova, Filip Kotal, Hana Jeligova, Lenka Mayerova, Veronika Svobodova, Martina Jurikova, Veronika Gomersall, Jana Pulkrabova
{"title":"Assessing PFAS in drinking water: Insights from the Czech Republic's risk-based monitoring approach.","authors":"Frantisek Kozisek, Darina Dvorakova, Filip Kotal, Hana Jeligova, Lenka Mayerova, Veronika Svobodova, Martina Jurikova, Veronika Gomersall, Jana Pulkrabova","doi":"10.1016/j.chemosphere.2024.143969","DOIUrl":"10.1016/j.chemosphere.2024.143969","url":null,"abstract":"<p><p>This study investigates the presence of perfluoroalkyl substances (PFAS) in the drinking water supplies in the Czech Republic using a risk-based monitoring approach. Tap water samples (n = 27) from sources close to areas potentially contaminated with PFAS were analysed. A total of 28 PFAS were measured using ultra-performance liquid chromatography with tandem mass spectrometry after solid phase extraction. Total PFAS concentrations (∑PFAS) varied from undetectable to 90.8 ng/L, with perfluoropentanoic acid (PFPeA), perfluorohexanoic acid (PFHxA), perfluoroheptanoic acid (PFHpA) and perfluorobutane sulfonic acid (PFBS) being the most abundant, detected in over 70% of samples. Risk-based monitoring in drinking water showed that commercial wells had higher PFAS levels compared to tap water, particularly C4-C9 perfluorocarboxylic acids (PFCAs), possibly due to proximity to industrial areas. However, the hypothesis that risk-based monitoring is more effective than random monitoring was not confirmed, possibly because specific sources did not produce the target PFAS or because of the wide range and less obvious sources of potential contamination. The study also assessed exposure risks and compliance with regulatory thresholds. Weekly intake estimates for adults and children indicated that regular consumption of most contaminated water sample would exceed the tolerable weekly intake. Compared to EU regulations, none of the tap water samples exceeded the 'Sum of PFAS' parametric value of 100 ng/L, though one sample approached this limit. In addition, surface water samples from the Jizera River (n = 21) showed a wider range of PFAS, with C7-C10 PFCAs, PFBS, and perfluorooctane sulfonic acid (PFOS) in every sample, with higher PFOS concentrations at a median of 2.56 ng/L. ∑PFAS concentrations increased downstream, rising from 1.08 ng/L near the spring to 26 ng/L downstream. This comprehensive analysis highlights the need for detailed/areal monitoring to also address hidden or non-obvious sources of PFAS contamination.</p>","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143969"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142857298","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Retraction notice to "Pyrolysis: An effective technique for degradation of COVID-19 medical wastes" [Chemosphere 275 (2021) 130092]. 《热解:一种降解新型冠状病毒医疗废弃物的有效技术》撤回通知[Chemosphere 275(2021) 130092]。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-16 DOI: 10.1016/j.chemosphere.2024.143824
Selvakumar Dharmaraj, Veeramuthu Ashokkumar, Rajesh Pandiyan, Heli Siti Halimatul Munawaroh, Kit Wayne Chew, Wei-Hsin Chen, Chawalit Ngamcharussrivichai
{"title":"Retraction notice to \"Pyrolysis: An effective technique for degradation of COVID-19 medical wastes\" [Chemosphere 275 (2021) 130092].","authors":"Selvakumar Dharmaraj, Veeramuthu Ashokkumar, Rajesh Pandiyan, Heli Siti Halimatul Munawaroh, Kit Wayne Chew, Wei-Hsin Chen, Chawalit Ngamcharussrivichai","doi":"10.1016/j.chemosphere.2024.143824","DOIUrl":"10.1016/j.chemosphere.2024.143824","url":null,"abstract":"","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143824"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11885206/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142848650","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Developmental toxicity of alkylated PAHs and substituted phenanthrenes: Structural nuances drive diverse toxicity and AHR activation. 烷基化多环芳烃和取代菲的发育毒性:结构上的细微差别驱动不同的毒性和AHR活化。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-10 DOI: 10.1016/j.chemosphere.2024.143894
Mackenzie L Morshead, Lisa Truong, Michael T Simonich, Jessica E Moran, Kim A Anderson, Robyn L Tanguay
{"title":"Developmental toxicity of alkylated PAHs and substituted phenanthrenes: Structural nuances drive diverse toxicity and AHR activation.","authors":"Mackenzie L Morshead, Lisa Truong, Michael T Simonich, Jessica E Moran, Kim A Anderson, Robyn L Tanguay","doi":"10.1016/j.chemosphere.2024.143894","DOIUrl":"10.1016/j.chemosphere.2024.143894","url":null,"abstract":"<p><p>Polycyclic aromatic hydrocarbons (PAHs) are a diverse class of chemicals that occur in complex mixtures including parent and substituted PAHs. To understand the hazard posed by complex environmental PAH mixtures, we must first understand the structural drivers of activity and mode of action of individual PAHs. Understanding the toxicity of alkylated PAHs is important as they often occur in higher abundance in environmental matrices and can be more biologically active than their parent compounds. 104 alkylated PAHs were screened from 11 different parent compounds with emphasis on substituted phenanthrenes and their structurally dependent toxicity differences. Using a high-throughput early life stage zebrafish assay, embryos were exposed to concentrations between 0.1 and 100 μM and assessed for morphological and behavioral outcomes. The aryl hydrocarbon receptor (AHR) is often implicated in the toxicity of PAHs and the induction of cytochrome P4501A (cyp1a) is an excellent biomarker of Ahr activation. Embryos were evaluated for cyp1a induction using a fluorescence reporter line. Alkyl and polar phenanthrene derivatives were further assessed for spatial cyp1a expression and Ahr dependence of morphological effects. In the alkyl PAH screen 35 (33.7%) elicited a morphological or behavioral response and of those 23 (65%) also induced cyp1a. 31 (29.8%) of the chemicals only induced cyp1a. Toxicity varied substantially in response to substitution location, the amount of ring substitutions and alkyl chain length. Cyp1a induction varied by parent compound group and was a poor indicator of morphological or behavioral outcomes. Polar phenanthrenes were more biologically active than alkylated phenanthrene derivatives and their toxicity was not dependent upon the Ahr2, Ahr1a or Ahr1b when tested individually, despite cyp1a induction by 50% of polar phenanthrenes. Our results demonstrated that induction of cyp1a did not always correlate with PAH toxicity or Ahr dependence and that the type and location of phenanthrene substitution determined potency.</p>","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"143894"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11732715/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142792878","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Assessing the environmental determinants of micropollutant contamination in streams using explainable machine learning and network analysis. 使用可解释的机器学习和网络分析评估溪流中微污染物污染的环境决定因素。
Chemosphere Pub Date : 2025-02-01 Epub Date: 2024-12-31 DOI: 10.1016/j.chemosphere.2024.144041
Min Jeong Ban, Dong Hoon Lee, Byung-Tae Lee, Joo-Hyon Kang
{"title":"Assessing the environmental determinants of micropollutant contamination in streams using explainable machine learning and network analysis.","authors":"Min Jeong Ban, Dong Hoon Lee, Byung-Tae Lee, Joo-Hyon Kang","doi":"10.1016/j.chemosphere.2024.144041","DOIUrl":"10.1016/j.chemosphere.2024.144041","url":null,"abstract":"<p><p>Even at trace concentrations, micropollutants, including pesticides and pharmaceuticals, pose considerable ecological risks, and the increasing presence of synthetic chemical substances in aquatic systems has emerged as a growing concern. Moreover, limited machine-learning (ML) approaches exist for analyzing environmental data, and the increasing complexity of ML models has made it challenging to understand predictor-outcome relationships. In particular, understanding complex interactions among multiple variables remains challenging. This study applies and integrates explainable ML techniques and network analysis to identify the sources of micropollutants in a large watershed and determine the factors affecting micropollutant levels. We assessed the performance of four ML algorithms-support vector machine, random forest, extreme gradient boosting (XGB), and autoencoder-XGB-in predicting micropollutant levels based on the spatial characteristics of the watershed. We applied the synthetic minority oversampling technique to address the data imbalance. The XGB model demonstrated superior predictive performance, particularly for high concentration levels, achieving an accuracy of 87%-99%. Shapley additive explanations (SHAP) analysis identified temperature and rainfall as significant factors. Moreover, agricultural activities contributed to pesticide pollution, whereas urban activities contributed to pharmaceutical contamination. The network analysis corroborated the SHAP findings and revealed event-specific contamination characteristics. This included distinct discharge pathways during a dry summer event and shared pathways during a wet winter event. This approach enhances an understanding of contamination sources and pathways and subsequently aids in developing control measures and making informed policy decisions to preserve water quality in mixed land-use areas.</p>","PeriodicalId":93933,"journal":{"name":"Chemosphere","volume":" ","pages":"144041"},"PeriodicalIF":0.0,"publicationDate":"2025-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142904319","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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