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Insight into peroxydisulfate activation by N-BC@Fe3S4 for enrofloxacin degradation through radical and non-radical pathway
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-04 DOI: 10.1016/j.inoche.2026.116285
Zimu Li , Rui Sun , Tianyu Zheng , Yian Zhou , Zhiyang Jiao , Xuan Xing , Yanhong Wu
Nitrogen-doped biochar loaded with Fe3S4 (N-BC@Fe3S4) was synthesized for peroxydisulfate (PDS) activation to remove antibiotics of enrofloxacin (ENR). Physical and chemical characteristics of N-BC@Fe3S4 were examined using scanning electronic microscopy (SEM), X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FTIR), Raman and X-ray photoelectron spectroscopy (XPS), individually. A comprehensive assessment of operating variables on ENR degradation efficiency was conducted, including PDS concentration, catalyst dosage, initial pH, inorganic anions, humic acid (HA) and diverse water matrices. Under the optimal reaction conditions, N-BC@Fe3S4/PDS system exhibited a notably high degradation rate constant for ENR, reaching 0.0538 min−1, which was 1.51 and 22.42 times greater than that in BC@Fe3S4/PDS and BC/PDS systems. Quenching experiments and electron paramagnetic resonance (EPR) measurements confirmed the involvement of SO4, •OH, and •O2 in both N-BC@Fe3S4/PDS and BC@Fe3S4/PDS systems, while 1O2 was only appeared in N-BC@Fe3S4/PDS system. These observations demonstrated that radical species were produced via PDS activation by Fe2+ released from Fe3S4, whereas non-radical oxidant of 1O2 originated from PDS activation mediated by nitrogen functional groups on BC. In addition, degradation pathway was proposed combined active sites identified by DFT calculation and intermediates analyzed by LC-MS detection. Results showed that piperazine ring cleavage and quinolone moieties transformation were two dominate pathway for ENR degradation. These results demonstrated that N-BC@Fe3S4 was a high-performance catalyst for antibiotics degradation, with great potential for practical application.
合成了负载Fe3S4 (N-BC@Fe3S4)的氮掺杂生物炭,进行过硫酸氢盐(PDS)活化去除恩诺沙星(ENR)中的抗生素。利用扫描电镜(SEM)、x射线衍射(XRD)、傅里叶变换红外光谱(FTIR)、拉曼光谱(Raman)和x射线光电子能谱(XPS)分别对N-BC@Fe3S4的理化性质进行了表征。综合评价了PDS浓度、催化剂用量、初始pH、无机阴离子、腐植酸(HA)和不同水基质等操作变量对ENR降解效率的影响。在最优反应条件下,N-BC@Fe3S4/PDS体系对ENR的降解速率常数达到0.0538 min−1,分别是BC@Fe3S4/PDS和BC/PDS体系的1.51倍和22.42倍。猝灭实验和电子顺磁共振(EPR)测量证实,在N-BC@Fe3S4/PDS和BC@Fe3S4/PDS体系中均存在SO4•−、•OH和•O2−,而1O2只出现在N-BC@Fe3S4/PDS体系中。这些结果表明,自由基是由Fe3S4释放的Fe2+激活PDS产生的,而非自由基氧化物质1O2则是由BC上氮官能团介导的PDS激活产生的。并结合DFT计算确定的活性位点和LC-MS检测分析的中间体,提出了降解途径。结果表明,哌嗪环裂解和喹诺酮基转化是ENR降解的两个主要途径。这些结果表明N-BC@Fe3S4是一种高性能的抗生素降解催化剂,具有很大的实际应用潜力。
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引用次数: 0
Interface engineering of a 2D/2D Co(OH)2/Fe-Ni heterostructure as a robust bifunctional electrocatalyst for overall water splitting
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-04 DOI: 10.1016/j.inoche.2026.116303
Min Ling , Yuan-Sheng Cheng , Xi Cao
The development of highly efficient, low-cost, and stable bifunctional electrocatalysts is crucial for the widespread application of overall water splitting. In this work, we designed and prepared a composite material consisting of a Co(OH)2 film deposited on a FeNi alloy sheet, which is further supported by a Ni foam substrate. The resulting catalyst exposes abundant active sites and exhibits outstanding electrocatalytic performance for both the oxygen evolution reaction (OER) and the hydrogen evolution reaction (HER) in alkaline media. Specifically, for OER, the catalyst requires overpotentials of only 218 mV and 249 mV to achieve current densities of 10 mA cm−2 and 100 mA cm−2, respectively, outperforming commercial RuO2 (276 mV and 362 mV). Similarly, it demonstrates excellent HER activity, requiring overpotentials of just 174 mV and 289 mV to reach current densities of −10 mA cm−2 and -100 mA cm−2. Moreover, in a two-electrode configuration, the 2D/2D Co(OH)2/Fe-Ni/NF nanosheet assembly enables overall water splitting at a low cell voltage of 1.63 V to achieve 10 mA cm−2, along with excellent stability exceeding 24 h.
开发高效、低成本、稳定的双功能电催化剂是全面水分解技术广泛应用的关键。在这项工作中,我们设计并制备了一种由沉积在FeNi合金片上的Co(OH)2薄膜组成的复合材料,该复合材料由Ni泡沫衬底进一步支撑。所得催化剂暴露出丰富的活性位点,在碱性介质中对析氧反应(OER)和析氢反应(HER)均表现出优异的电催化性能。具体来说,对于OER,催化剂只需要218 mV和249 mV的过电位就可以分别达到10 mA cm - 2和100 mA cm - 2的电流密度,优于商用RuO2 (276 mV和362 mV)。同样,它也表现出优异的HER活性,只需要174 mV和289 mV的过电位就可以达到-10 mA cm - 2和-100 mA cm - 2的电流密度。此外,在双电极配置下,2D/2D Co(OH)2/Fe-Ni/NF纳米片组件可以在1.63 V的低电池电压下实现整体水分解,达到10 mA cm - 2,并具有超过24小时的优异稳定性。
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引用次数: 0
Harnessing interpretable machine learning: SHapley additive exPlanations (SHAP)-driven insights, transformative impact, and controversies in adsorption-based environmental remediation
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-03 DOI: 10.1016/j.inoche.2026.116269
Mohammad Khajavian , Jin-Hyeok Jang , Jae-Young Kwon , Jung-Min Lee , Sangyoup Lee , Moon-Hyun Hwang , Euntae Yang , Jae Kyung Jang , Kyu-Jung Chae
Machine learning (ML) provides powerful predictive capabilities for environmental remediation, enabling the diagnosis of contamination sources and optimization of treatment processes for pollutants such as heavy metals, dyes, and pharmaceuticals. However, the black-box nature of many ML models limits their mechanistic interpretability, hindering application in process design. This review systematically synthesizes and critically evaluates the use of Shapley Additive exPlanations (SHAP) to address this gap in adsorption-based water treatment. Whereas previous reviews have established the broad utility of ML, a dedicated assessment of SHAP's methodological aspects and its role in deriving mechanistic insight is lacking. The consolidated evidence from diverse studies shows that SHAP analysis reliably identifies key predictors of adsorption behavior, including parameters such as surface area and pH that determine contaminant–adsorbent interactions. A critical review of studies addressing controversies and divergent perspectives in SHAP-based interpretability revealed that, although SHAP is widely employed to extract mechanistic insights, its application frequently overlooks important methodological limitations. The review concludes by outlining future research directions for leveraging SHAP to advance fundamental understanding and optimize remediation strategies.
机器学习(ML)为环境修复提供了强大的预测能力,能够诊断污染源并优化重金属、染料和药物等污染物的处理过程。然而,许多机器学习模型的黑箱特性限制了它们的机制可解释性,阻碍了在过程设计中的应用。这篇综述系统地综合和批判性地评估了沙普利添加剂解释(Shapley Additive exPlanations, SHAP)的使用,以解决吸附型水处理中的这一差距。尽管以前的评论已经建立了ML的广泛用途,但缺乏对SHAP方法方面及其在获得机制洞察力方面的作用的专门评估。来自不同研究的综合证据表明,SHAP分析可靠地确定了吸附行为的关键预测因素,包括决定污染物-吸附剂相互作用的表面积和pH等参数。一项针对基于SHAP的可解释性的争议和不同观点的研究的批判性回顾表明,尽管SHAP被广泛用于提取机制见解,但其应用经常忽略了重要的方法局限性。最后,概述了利用SHAP推进基础认识和优化修复策略的未来研究方向。
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引用次数: 0
Promoted permanganate activation by nano TiO2 as Lewis acid catalysts for efficient degradation of levofloxacin
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-03 DOI: 10.1016/j.inoche.2026.116302
Zhongduo Xiong , Xiaochuan Zhou , Hang Zhao , Shuaiqi Zhao , Xiuying Liu , Xiaoxia Li , Aihua Xu , Xinchao Ruan
The heterogeneous activation of permanganate (KMnO4) with redox or non-redox metal oxides to degrade toxic pollutants in aqueous solution has garnered increased attention recently. However, how Lewis acid (LA) site in metal oxides interacts with KMnO4 to enhance its reactivity remains unclear. To clarify the mechanism of KMnO4 activation with LA catalysts, the degradation of levofloxacin (LEVO) by KMnO4 with titanium dioxide (TiO2), a water-resistant solid acid catalyst, was investigated in this study. An improved degradation efficiency, a low activation energy of 25.2 kJ/Mol, and a high KMnO4 utilization of 61.6% were observed with KMnO4/TiO2 system, compared with KMnO4 alone. The presence of strong Lewis acidity on TiO2 surface was confirmed by various technologies, and the density functional theory calculation and electrochemical experiments further revealed that the coordinatively unsaturated Ti4+ species interacted with KMnO4 as LA sites to stretch its MnO bonds and increase its oxidation potential, thereby achieving a high electron transfer reactivity. The system also showed a high adaptability under various conditions including recycling experiments, treatment of several pollutants and various solution pH, and a decreased toxicity of the products. These findings provided an improved understanding of LA sites in KMnO4 activation and its application to degrade pollutants
高锰酸盐(KMnO4)与氧化还原或非氧化还原金属氧化物的非均相活化降解水溶液中的有毒污染物近年来受到越来越多的关注。然而,金属氧化物中的路易斯酸(LA)位点如何与KMnO4相互作用以增强其反应活性尚不清楚。为了阐明LA催化剂活化KMnO4的机理,研究了KMnO4与耐水固体酸催化剂二氧化钛(TiO2)对左氧氟沙星(LEVO)的降解。与单独使用KMnO4相比,KMnO4/TiO2体系的降解效率更高,活化能低至25.2 kJ/Mol, KMnO4利用率高达61.6%。通过各种技术证实TiO2表面存在强Lewis酸,密度泛函理论计算和电化学实验进一步揭示了配位不饱和Ti4+与KMnO4作为LA位点相互作用,拉伸其MnO键,提高其氧化电位,从而获得较高的电子转移反应活性。该系统在各种条件下也表现出很高的适应性,包括回收实验,处理多种污染物和不同的溶液pH,并降低了产品的毒性。这些发现为KMnO4活化中的LA位点及其降解污染物的应用提供了更好的理解
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引用次数: 0
Catalytic activity of diazapyridinophane ligand-coordinated iron(II) and copper(II) complexes towards the selective oxidation of alcohols using sodium metaperiodate
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-03 DOI: 10.1016/j.inoche.2026.116295
Agnishwar Mangal , Gayetri Sarkar , Nayana Mukherjee , Souvik Chatterjee , Suraj Kumar Agrawalla , Chandra Shekhar Purohit , Bhaskar Biswas , Hari Sankar Das
Tetraazamacrocyclic pyridinophanes can function as chemically robust polydentate ligands in metal coordination chemistry, proffering a malleable coordination sphere that exerts a considerable influence on catalytic organic transformations. In this work, we report N,N-di-tert-butyl-2,11-diaza[3.3](2,6)-pyridinophane (LN4tBu2) ligand coordinated iron(II) and copper(II) complexes as efficient catalysts to effectuate the selective oxidation of alcohols using an oxidant sodium metaperiodate. The iron(II) complex shows better catalytic activity compared to copper(II) complex and proceeds via the formation of reactive iron(IV)-oxo species which is indirectly isolated as an oxo-bridged binuclear complex with FeCl2 and characterized by single-crystal X-ray diffraction study. Our protocol exhibits a broad substrate scope and functional group compatibility under mild conditions with expeditious reaction times. Mechanistic investigations reveal that alcohol oxidation is a two-electron process, culminating in hydride transfer followed by proton transfer, facilitated by the iron(IV)-oxo species.
在金属配位化学中,四氮杂环吡啶烷可以作为一种化学稳健的多齿配体,提供了一种可延展的配位球,对催化有机转化具有相当大的影响。在这项工作中,我们报道了N,N-二叔丁基-2,11-双氮[3.3](2,6)-吡啶烷(LN4tBu2)配体配位铁(II)和铜(II)配合物作为有效催化剂,在氧化剂偏碘酸钠的作用下实现醇的选择性氧化。与铜(II)配合物相比,铁(II)配合物表现出更好的催化活性,并通过与FeCl2间接分离为氧桥双核配合物的活性铁(IV)-氧进行反应,并通过单晶x射线衍射研究进行了表征。我们的方案在温和的条件下具有广泛的底物范围和官能团相容性,反应时间短。机理研究表明,醇氧化是一个双电子过程,最终在氢化物转移和质子转移中结束,由铁(IV)-氧促进。
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引用次数: 0
Highly florescent Ho,N co-doped carbon quantum dots for sensitive and selective curcumin sensing: Morphology, mechanism, smartphone RGB and biofluid applications
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-03 DOI: 10.1016/j.inoche.2026.116296
Bindu Dhuva, Jyoti Duhan, Sangeeta Obrai
In this study, a highly selective fluorescent probe was developed to detect curcumin, demonstrating high recovery percentages in real samples. Hydrothermal provides a straightforward and cost-effective method for synthesizing holmium and nitrogen co-doped carbon dots (Ho,N-CQDs). The Ho,N-CQDs have a maximum emission wavelength of 408 nm and an excitation wavelength of 330 nm. Multiple analytical techniques were used to characterize the as-prepared Ho,N-CQDs, including transmission electron microscopy, X-ray diffraction, scanning electron microscopy, infrared spectroscopy, X-ray photoelectron spectroscopy, UV–visible spectroscopy, and photoluminescence spectroscopy. The Ho,N-CQDs based fluorescence sensor successfully detects Curcumin in aqueous solution with a linear range of 0–62.4 × 10−8 M and a detection limit of 1.94 × 10−8M (19.4 nM). Specific amino acids, vitamins and other biochemical do not interfere with Curcumin (Cumn) detection, resulting in high selectivity. The Ho,N-CQDs fluorescence switch sensor showed outstanding accuracy and precision in urine and blood samples, with recoveries ranging from 97.07% to 101.1%.
在本研究中,开发了一种高选择性荧光探针来检测姜黄素,在实际样品中具有很高的回收率。水热法为合成氮、钬共掺杂碳点(Ho,N-CQDs)提供了一种简单、经济的方法。Ho,N-CQDs的最大发射波长为408 nm,激发波长为330 nm。采用透射电镜、x射线衍射、扫描电镜、红外光谱、x射线光电子能谱、紫外可见光谱、光致发光光谱等多种分析技术对制备的Ho,N-CQDs进行了表征。基于Ho,N-CQDs的荧光传感器在0 ~ 62.4 × 10−8M的线性范围内检测到水溶液中的姜黄素,检测限为1.94 × 10−8M (19.4 nM)。特定的氨基酸、维生素等生化不干扰姜黄素(Cumn)的检测,具有高选择性。Ho,N-CQDs荧光开关传感器在尿液和血液样品中具有良好的准确度和精密度,加样回收率为97.07% ~ 101.1%。
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引用次数: 0
Microwave absorption characteristics of hard and soft ferrite (SrFe12O19 and cu-doped coZn ferrite) nanocomposites in Ku band
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-03 DOI: 10.1016/j.inoche.2026.116291
Karambir Singh , Manisha Dabla , Ankush Chauhan , Bijoy Kumar Kuanr , Khalid Mujasam Batoo , Pankaj Thakur , Vinod Kumar , Ritesh Verma
Herein, we synthesized a nanocomposite of hard and soft ferrite using strontium ferrite (SrFe₁₂O₁₉) and copper doped cobalt zinc ferrite (CCZF), i.e., 1-x(SrFe12O19)-x(Co0.3Zn0.5Cu0.2Fe2O4) where x is 0%, 10%, 20%, 40%, 60%, 80% and 100%. The pristine samples are synthesized using co-precipitation method, whereas the composites are prepared by solid state reaction technique. The structural parameters are obtained for all the samples using X-ray Diffraction (XRD) technique. The formation of a hexagonal structure for SrFe₁₂O₁₉ and a cubic structure for CCZF was observed. It also suggested the presence of both phases in nanocomposites. The crystallite size for the hexagonal phase varied between 24.01 ± 0.5 nm and 40.05 ± 0.5 nm, whereas for the cubic phase it varied between 16.79 ± 0.5 nm and 39.78 ± 0.5 nm. The Scanning Electron Microscopy (SEM) showed that hexagonal grains and cubic grains were formed for pristine samples, whereas, for nanocomposites, both the phases were present. The chemical purity in all the samples was confirmed using Energy Dispersive X-ray Spectroscopy (EDX). Fourier Transform infrared (FTIR) spectroscopy showed the presence of two prominent peaks, one is v1 ranging between 503.97 cm−1 and 540.91 cm−1 and v2 ranging between 408.89 cm−1 and 435.89 cm−1. The magnetic parameters are obtained using a vibrating sample magnetometer (VSM) that showed the variation of saturation magnetization (Ms) value from 47.748 emu/g to 40.596 emu/g, coercivity (Hc) value from 1080.83 Oe to 40.48 Oe and squarness ratio (SQR) from 0.401 to 0.059 with an increase in soft phase concentration in the nanocomposite. High frequency permittivity (ε) and permeability (μ) plots showed the stable behaviour, consistent with the presence of interfacial magnetic interactions between both the phases in nanocomposites. To investigate the microwave absorption characteristics, reflection loss is obtained for all the samples and the minimum reflection loss value is obtained for the composition with 40% CCZF concentration in the nanocomposite, which is −35.74 dB at 14.85 GHz at a thickness of 3 mm. Thus, the optimal composition of SrFe₁₂O₁₉ and CCZF may be considered as a potential candidate for microwave absorption applications.
本文以锶铁氧体(SrFe₁₂O₁₉)和铜掺杂钴锌铁氧体(CCZF)为原料,即1-x(SrFe12O19)-x(Co0.3Zn0.5Cu0.2Fe2O4),其中x分别为0%、10%、20%、40%、60%、80%和100%,合成了软硬铁氧体纳米复合材料。原始样品采用共沉淀法合成,复合材料采用固相反应法制备。利用x射线衍射(XRD)技术获得了样品的结构参数。观察到SrFe₁₂O₁₉形成六角形结构,CCZF形成立方结构。这也表明纳米复合材料中存在这两种相。六方相的晶粒尺寸在24.01±0.5 nm ~ 40.05±0.5 nm之间,立方相的晶粒尺寸在16.79±0.5 nm ~ 39.78±0.5 nm之间。扫描电镜(SEM)显示,原始样品形成了六方晶和立方晶,而纳米复合材料则形成了这两种相。利用能量色散x射线光谱(EDX)确定了样品的化学纯度。傅里叶变换红外光谱(FTIR)显示了两个突出的峰的存在,一个是v1,范围在503.97 cm−1和540.91 cm−1之间,v2范围在408.89 cm−1和435.89 cm−1之间。利用振动样品磁强计(VSM)获得的磁性参数表明,随着软相浓度的增加,纳米复合材料的饱和磁化强度(Ms)从47.748 emu/g增加到40.596 emu/g,矫顽力(Hc)从1080.83 Oe增加到40.48 Oe,平方比(SQR)从0.401增加到0.059。高频介电常数(ε′)和磁导率(μ′)图显示出稳定的行为,这与纳米复合材料中两相之间存在界面磁相互作用相一致。为了研究微波吸收特性,得到了所有样品的反射损耗,其中CCZF浓度为40%的纳米复合材料在14.85 GHz时的最小反射损耗值为- 35.74 dB,厚度为3 mm。因此,SrFe₁₂O₁₉和CCZF的最佳组成可以被认为是微波吸收应用的潜在候选者。
{"title":"Microwave absorption characteristics of hard and soft ferrite (SrFe12O19 and cu-doped coZn ferrite) nanocomposites in Ku band","authors":"Karambir Singh ,&nbsp;Manisha Dabla ,&nbsp;Ankush Chauhan ,&nbsp;Bijoy Kumar Kuanr ,&nbsp;Khalid Mujasam Batoo ,&nbsp;Pankaj Thakur ,&nbsp;Vinod Kumar ,&nbsp;Ritesh Verma","doi":"10.1016/j.inoche.2026.116291","DOIUrl":"10.1016/j.inoche.2026.116291","url":null,"abstract":"<div><div>Herein, we synthesized a nanocomposite of hard and soft ferrite using strontium ferrite (SrFe₁₂O₁₉) and copper doped cobalt zinc ferrite (CCZF), i.e., 1-x(SrFe<sub>12</sub>O<sub>19</sub>)-x(Co<sub>0.3</sub>Zn<sub>0.5</sub>Cu<sub>0.2</sub>Fe<sub>2</sub>O<sub>4</sub>) where x is 0%, 10%, 20%, 40%, 60%, 80% and 100%. The pristine samples are synthesized using co-precipitation method, whereas the composites are prepared by solid state reaction technique. The structural parameters are obtained for all the samples using X-ray Diffraction (XRD) technique. The formation of a hexagonal structure for SrFe₁₂O₁₉ and a cubic structure for CCZF was observed. It also suggested the presence of both phases in nanocomposites. The crystallite size for the hexagonal phase varied between 24.01 ± 0.5 nm and 40.05 ± 0.5 nm, whereas for the cubic phase it varied between 16.79 ± 0.5 nm and 39.78 ± 0.5 nm. The Scanning Electron Microscopy (SEM) showed that hexagonal grains and cubic grains were formed for pristine samples, whereas, for nanocomposites, both the phases were present. The chemical purity in all the samples was confirmed using Energy Dispersive X-ray Spectroscopy (EDX). Fourier Transform infrared (FTIR) spectroscopy showed the presence of two prominent peaks, one is <span><math><mrow><msub><mi>v</mi><mn>1</mn></msub></mrow></math></span> ranging between 503.97 cm<sup>−1</sup> and 540.91 cm<sup>−1</sup> and <span><math><mrow><msub><mi>v</mi><mn>2</mn></msub></mrow></math></span> ranging between 408.89 cm<sup>−1</sup> and 435.89 cm<sup>−1</sup>. The magnetic parameters are obtained using a vibrating sample magnetometer (VSM) that showed the variation of saturation magnetization (<span><math><mrow><msub><mi>M</mi><mi>s</mi></msub></mrow></math></span>) value from 47.748 emu/g to 40.596 emu/g, coercivity (<span><math><mrow><msub><mi>H</mi><mi>c</mi></msub></mrow></math></span>) value from 1080.83 Oe to 40.48 Oe and squarness ratio (SQR) from 0.401 to 0.059 with an increase in soft phase concentration in the nanocomposite. High frequency permittivity (<span><math><mrow><msup><mi>ε</mi><mo>′</mo></msup></mrow></math></span>) and permeability (<span><math><mrow><msup><mi>μ</mi><mo>′</mo></msup></mrow></math></span>) plots showed the stable behaviour, consistent with the presence of interfacial magnetic interactions between both the phases in nanocomposites. To investigate the microwave absorption characteristics, reflection loss is obtained for all the samples and the minimum reflection loss value is obtained for the composition with 40% CCZF concentration in the nanocomposite, which is −35.74 dB at 14.85 GHz at a thickness of 3 mm. Thus, the optimal composition of SrFe₁₂O₁₉ and CCZF may be considered as a potential candidate for microwave absorption applications.</div></div>","PeriodicalId":13609,"journal":{"name":"Inorganic Chemistry Communications","volume":"186 ","pages":"Article 116291"},"PeriodicalIF":5.4,"publicationDate":"2026-02-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146170314","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Nitric oxide gas sensor based on electrospun tin oxide nanofibers surface-decorated by gold nanoparticles
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-02 DOI: 10.1016/j.inoche.2026.116286
Jiang Haotian, Zhang Jie, Li Wei
The decoration of noble-metal remains an effective and general strategy to rejuvenate “old” sensing materials for targeted gases. Herein, gold was loaded onto electrospun SnO2 nanofibers by a simple impregnation route and the resulting hybrids were employed to detect nitric oxide (NO). XRD, TEM, XPS and elemental mapping corroborated that metallic Au clusters were successfully anchored on the fiber surface. Owing to the spill-over effect, these clusters supply additional active sites and chemisorbed oxygen. Gas-sensing measurements revealed that, even at a relatively low operating temperature, the Au-decorated SnO2 nanofibers delivered a striking response of 37.3 toward 200 ppb NO, whereas negligible cross-responses were observed to typical interferents in exhaled breath. Moreover, the sensor exhibited excellent repeatability and long-term stability. These results demonstrate the remarkable potential of Au surface functionalization for boosting the NO-sensing performance of SnO2 nanofibers.
贵金属的装饰仍然是一种有效和通用的策略,以使“旧”的传感材料对目标气体恢复活力。本研究通过简单的浸渍方式将金负载到静电纺丝SnO2纳米纤维上,所得杂化产物被用于检测一氧化氮(NO)。XRD、TEM、XPS和元素映射证实金属金团簇成功锚定在纤维表面。由于溢出效应,这些簇提供了额外的活性位点和化学吸收的氧气。气敏测量显示,即使在相对较低的工作温度下,au修饰的SnO2纳米纤维对200 ppb NO的响应也达到37.3,而对呼出气体中典型干扰的交叉响应可以忽略不计。此外,该传感器具有良好的重复性和长期稳定性。这些结果表明,Au表面功能化对于提高SnO2纳米纤维的no传感性能具有显著的潜力。
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引用次数: 0
A parametric study for optimal electrochemical synthesis of ZIF-8 and MIL-53(Al) for CO2 capture: a comparative analysis
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-02 DOI: 10.1016/j.inoche.2026.116226
Jafar Shadmehr, Ali Asghar. Ghoreyshi, Mohsen Ghorbani
A comprehensive parametric investigation to pinpoint the key factors affecting the electrochemical synthesis of MOFs is lacking in the literature. Two particular MOFs, ZIF-8 and MIL-53 (Al), were synthetized through a distinctive electrochemical method. Unlike the ZIF-8, the electrochemical method for synthesizing MIL-53(Al) encounters a significant obstacle. In this case, the issue was tackled using a self-synthesized ionic liquid (1-Dodecyl-3-methylimidazolium chloride) as the electrolyte, resulting in the creation of a MIL-53(Al) structure similar to the one obtained through solvothermal synthesis. A comprehensive parametric analysis was performed, taking into account the influence of different factors such as solvent composition, reaction time, cell voltage, electrode surface area/cell volume ratio, and cell temperature on both cell efficiency and CO2 adsorption capability. Different techniques were used for characterizing both samples to determine their physicochemical properties including X-ray diffraction, BET analysis, FTIR, TGA, and SEM. The parametric analysis demonstrated that the key synthesis parameters influencing CO2 adsorption capacity were cell voltage, cell temperature, and the electrode surface area/cell volume ratio. The findings also showed that the highest CO2 absorption of 6.07 mmol/g was obtained from the ZIF-8 produced under the optimized conditions, while the maximum quantity of CO2 captured by the optimized MIL-53(Al) sample was 3.89 mmol/g in the identical electrochemical cell. Besides, ZIF-8 demonstrated significant advantages compared to MIL-53 (Al) in CO2 absorption owing to its highly microporous architecture and crystallinity. The results of the present research gives an insight into optimizing electrochemical synthesis conditions of MOFs as a reliable and facile technique.
文献中缺乏全面的参数研究来确定影响mof电化学合成的关键因素。采用独特的电化学方法合成了ZIF-8和MIL-53 (Al)两种特殊的mof。与ZIF-8不同,电化学合成MIL-53(Al)的方法遇到了很大的障碍。在这种情况下,使用自合成的离子液体(1-十二烷基-3-甲基咪唑氯)作为电解质来解决这个问题,从而产生了MIL-53(Al)结构,类似于通过溶剂热合成获得的结构。考虑溶剂组成、反应时间、电池电压、电极表面积/电池体积比、电池温度等因素对电池效率和CO2吸附能力的影响,进行了全面的参数分析。使用不同的技术来表征两种样品,以确定其物理化学性质,包括x射线衍射,BET分析,FTIR, TGA和SEM。参数分析表明,影响CO2吸附能力的关键合成参数是电池电压、电池温度和电极表面积/电池体积比。在相同的电化学电池中,优化后的MIL-53(Al)样品的CO2吸收量最高,为6.07 mmol/g,而优化后的MIL-53(Al)样品的CO2吸收量最大,为3.89 mmol/g。此外,由于ZIF-8的高微孔结构和结晶度,与MIL-53 (Al)相比,ZIF-8在CO2吸收方面具有显著优势。本研究的结果为优化mof的电化学合成条件提供了一种可靠而简便的技术。
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引用次数: 0
Reduced graphene oxide (r-GO) anchored bismuth oxide (Bi2O3) nanocomposite material: Fabrication, characterization, photocatalytic degradation of rhodamine B (RB) dye and phytotoxicity study
IF 5.4 3区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2026-02-02 DOI: 10.1016/j.inoche.2026.116283
Rajesh Chandu Waghmare , Raju Shivaji Ingale , Pratibha Gopalrao Raundal , Purvesh Vijay Sonawane , Anjali Deepak More , Prashant Bhimrao Koli
The present research work deals with the fabrication of bismuth oxide (Bi2O3) nanomaterials by sol gel citrate method and fabrication of reduced graphene oxide (r-GO) by Hammers method using waste dry electric batteries. The nanocomposite of Bi2O3 and graphene oxide was prepared cost-effective heat and beat method (Ball Grinding method) followed by ultrasonication and calcination. The prepared materials Bi2O3, r-GO and r-GO Bi2O3 were Characterized by X-ray diffraction (XRD) technique to investigate the structural parameters. The average crystallite size was calculated from Debye Scherrer formula, the estimated size for Bi2O3, r-GO and r-GO Bi2O3 was 18.20 nm, 14.30 nm and 21.56 nm respectively. The scanning electron microscopy (SEM) was utilized for morphological parameters of the prepared materials like surface, texture, porosity and dimensions of nanomaterials. The energy dispersive spectroscopy (EDS) technique was utilized to investigate the elemental composition. The lattice parameters and polycrystallinity was confirmed from transmission electron microscopy (TEM) analysis. While the band gap of the fabricated materials was confirmed from ultraviolet diffuse reflectance spectroscopy (UV-DRS). Additionally, the materials were further characterized by photoluminescence (PL) spectroscopy for optical properties such as band gap investigations. The surface area of both the catalyst was investigated by Brunauer-Emmett-Teller (BET) adsorption isotherm. The fabricated materials Bi2O3 and r-GO Bi2O3 nanocomposite were investigated for the photocatalytic dye degradation study of Rhodamine B (RB) dye and phytotoxicity study. The various parameters of the dye degradation such as catalyst dose, effect of pH, effect of dye concentration, radical scavenging study, contact time and comparative study was investigated for RB dye. The r-GO- Bi2O3 nanocomposite has a superior rate of dye degradation, and it degrades the 98.23% of RB dye in 70  min.
本文研究了溶胶凝胶柠檬酸法制备氧化铋(Bi2O3)纳米材料和用废干电池制备还原性氧化石墨烯(r-GO)的方法。采用高温焙烧法(球磨法)制备了Bi2O3与氧化石墨烯的纳米复合材料。采用x射线衍射(XRD)技术对制备的Bi2O3、r-GO和r-GO Bi2O3进行表征,研究其结构参数。根据Debye - Scherrer公式计算,Bi2O3、r-GO和r-GO Bi2O3的平均晶粒尺寸分别为18.20 nm、14.30 nm和21.56 nm。利用扫描电子显微镜(SEM)对制备的纳米材料的表面、织构、孔隙率和尺寸等形貌参数进行了表征。利用能谱(EDS)技术对其元素组成进行了分析。通过透射电镜(TEM)分析证实了其晶格参数和多晶性。通过紫外漫反射光谱(UV-DRS)确定了材料的带隙。此外,通过光致发光(PL)光谱进一步表征了材料的光学性质,如带隙研究。采用bruauer - emmet - teller (BET)吸附等温线研究了两种催化剂的比表面积。研究了制备的Bi2O3和r-GO纳米复合材料对罗丹明B (RB)染料的光催化降解和植物毒性研究。考察了催化剂用量、pH值、染料浓度、自由基清除研究、接触时间和对比研究等对RB染料降解的影响。r-GO- Bi2O3纳米复合材料具有优异的染料降解率,在70 min内可降解98.23%的RB染料。
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Inorganic Chemistry Communications
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