Slađana D. Savić , Filip Ž. Vlahović , Tamara D. Vasović , Mihajlo V. Jakanovski , Miloš R. Ognjanović , Dragan D. Manojlović , Goran M. Roglić , Dalibor M. Stanković
{"title":"pbo2包覆Ti/Sb-SnO2电极有效去除水中的心得安:实验和生态毒理学评估的DFT机制见解","authors":"Slađana D. Savić , Filip Ž. Vlahović , Tamara D. Vasović , Mihajlo V. Jakanovski , Miloš R. Ognjanović , Dragan D. Manojlović , Goran M. Roglić , Dalibor M. Stanković","doi":"10.1016/j.jwpe.2025.108321","DOIUrl":null,"url":null,"abstract":"<div><div>Widely used and highly toxic beta-blocker, propranolol (PRL), was efficiently removed from water using a stable Ti/Sb-SnO<sub>2</sub>/PbO<sub>2</sub> anode for the first time. Over a 90-min treatment, >94 % of PRL was degraded at 50 mA/cm<sup>2</sup>. Current density and PRL concentration were found to be crucial for the PRL degradation rate, while Na<sub>2</sub>SO<sub>4</sub> concentration and the initial pH value had a minimal effect on the outcome. Under optimized conditions, a high production of reactive species was achieved. HO<sup>•</sup> dominated the initial 40 min, whereas<span><math><mspace></mspace><msubsup><mi>SO</mi><mn>4</mn><mrow><mo>•</mo><mo>−</mo></mrow></msubsup></math></span> and <span><math><msubsup><mi>O</mi><mn>2</mn><mrow><mo>•</mo><mo>−</mo></mrow></msubsup></math></span> became more relevant as the process continued. Degradation intermediates were unraveled and the degradation mechanism was thoroughly described, innovatively integrating both experimental and theoretical insights. Despite increased toxicity of the treated PRL solution, the overall environmental impact remains low thanks to high levels of acute toxicity, that is, 0.23 g/dm<sup>3</sup>. In comparison to deionized water, the degradation rates in spiked tap water (86 %) and rain samples (84 %) were lower, which also affected the mineralization rate. The anode's excellent reusability was confirmed by 10 repeated experiments with over 81 % of PRL removed. This research presents an encouraging approach to mitigating pharmaceutical pollution in various water bodies using a simple, efficient, and scalable experimental setup.</div></div>","PeriodicalId":17528,"journal":{"name":"Journal of water process engineering","volume":"77 ","pages":"Article 108321"},"PeriodicalIF":6.7000,"publicationDate":"2025-07-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Efficient removal of propranolol from water using PbO2-coated Ti/Sb-SnO2 electrode: Mechanistic insights from experiments and DFT with ecotoxicological assessment\",\"authors\":\"Slađana D. Savić , Filip Ž. Vlahović , Tamara D. Vasović , Mihajlo V. Jakanovski , Miloš R. Ognjanović , Dragan D. Manojlović , Goran M. Roglić , Dalibor M. Stanković\",\"doi\":\"10.1016/j.jwpe.2025.108321\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Widely used and highly toxic beta-blocker, propranolol (PRL), was efficiently removed from water using a stable Ti/Sb-SnO<sub>2</sub>/PbO<sub>2</sub> anode for the first time. Over a 90-min treatment, >94 % of PRL was degraded at 50 mA/cm<sup>2</sup>. Current density and PRL concentration were found to be crucial for the PRL degradation rate, while Na<sub>2</sub>SO<sub>4</sub> concentration and the initial pH value had a minimal effect on the outcome. Under optimized conditions, a high production of reactive species was achieved. HO<sup>•</sup> dominated the initial 40 min, whereas<span><math><mspace></mspace><msubsup><mi>SO</mi><mn>4</mn><mrow><mo>•</mo><mo>−</mo></mrow></msubsup></math></span> and <span><math><msubsup><mi>O</mi><mn>2</mn><mrow><mo>•</mo><mo>−</mo></mrow></msubsup></math></span> became more relevant as the process continued. Degradation intermediates were unraveled and the degradation mechanism was thoroughly described, innovatively integrating both experimental and theoretical insights. Despite increased toxicity of the treated PRL solution, the overall environmental impact remains low thanks to high levels of acute toxicity, that is, 0.23 g/dm<sup>3</sup>. In comparison to deionized water, the degradation rates in spiked tap water (86 %) and rain samples (84 %) were lower, which also affected the mineralization rate. The anode's excellent reusability was confirmed by 10 repeated experiments with over 81 % of PRL removed. This research presents an encouraging approach to mitigating pharmaceutical pollution in various water bodies using a simple, efficient, and scalable experimental setup.</div></div>\",\"PeriodicalId\":17528,\"journal\":{\"name\":\"Journal of water process engineering\",\"volume\":\"77 \",\"pages\":\"Article 108321\"},\"PeriodicalIF\":6.7000,\"publicationDate\":\"2025-07-22\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of water process engineering\",\"FirstCategoryId\":\"5\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S2214714425013935\",\"RegionNum\":2,\"RegionCategory\":\"工程技术\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"ENGINEERING, CHEMICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of water process engineering","FirstCategoryId":"5","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S2214714425013935","RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"ENGINEERING, CHEMICAL","Score":null,"Total":0}
Efficient removal of propranolol from water using PbO2-coated Ti/Sb-SnO2 electrode: Mechanistic insights from experiments and DFT with ecotoxicological assessment
Widely used and highly toxic beta-blocker, propranolol (PRL), was efficiently removed from water using a stable Ti/Sb-SnO2/PbO2 anode for the first time. Over a 90-min treatment, >94 % of PRL was degraded at 50 mA/cm2. Current density and PRL concentration were found to be crucial for the PRL degradation rate, while Na2SO4 concentration and the initial pH value had a minimal effect on the outcome. Under optimized conditions, a high production of reactive species was achieved. HO• dominated the initial 40 min, whereas and became more relevant as the process continued. Degradation intermediates were unraveled and the degradation mechanism was thoroughly described, innovatively integrating both experimental and theoretical insights. Despite increased toxicity of the treated PRL solution, the overall environmental impact remains low thanks to high levels of acute toxicity, that is, 0.23 g/dm3. In comparison to deionized water, the degradation rates in spiked tap water (86 %) and rain samples (84 %) were lower, which also affected the mineralization rate. The anode's excellent reusability was confirmed by 10 repeated experiments with over 81 % of PRL removed. This research presents an encouraging approach to mitigating pharmaceutical pollution in various water bodies using a simple, efficient, and scalable experimental setup.
期刊介绍:
The Journal of Water Process Engineering aims to publish refereed, high-quality research papers with significant novelty and impact in all areas of the engineering of water and wastewater processing . Papers on advanced and novel treatment processes and technologies are particularly welcome. The Journal considers papers in areas such as nanotechnology and biotechnology applications in water, novel oxidation and separation processes, membrane processes (except those for desalination) , catalytic processes for the removal of water contaminants, sustainable processes, water reuse and recycling, water use and wastewater minimization, integrated/hybrid technology, process modeling of water treatment and novel treatment processes. Submissions on the subject of adsorbents, including standard measurements of adsorption kinetics and equilibrium will only be considered if there is a genuine case for novelty and contribution, for example highly novel, sustainable adsorbents and their use: papers on activated carbon-type materials derived from natural matter, or surfactant-modified clays and related minerals, would not fulfil this criterion. The Journal particularly welcomes contributions involving environmentally, economically and socially sustainable technology for water treatment, including those which are energy-efficient, with minimal or no chemical consumption, and capable of water recycling and reuse that minimizes the direct disposal of wastewater to the aquatic environment. Papers that describe novel ideas for solving issues related to water quality and availability are also welcome, as are those that show the transfer of techniques from other disciplines. The Journal will consider papers dealing with processes for various water matrices including drinking water (except desalination), domestic, urban and industrial wastewaters, in addition to their residues. It is expected that the journal will be of particular relevance to chemical and process engineers working in the field. The Journal welcomes Full Text papers, Short Communications, State-of-the-Art Reviews and Letters to Editors and Case Studies