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Improving the supercapacitive quality of CuO by Sr doping for energy storage application 用锶掺杂提高储能用氧化铜的超电容性能
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-08 DOI: 10.1007/s11581-025-06658-7
M. Aarab, M. Oubakalla, M. El Bouji, Y. Nejmi, I. Boudene, M. Beraich, A. Zarrouk, M. El Hezzat

This study used the ultrasonic spray technique to examine how Sr doping (0–5%) influences the structural, morphological, and electrochemical properties of CuO deposited on fluorine tin oxide (FTO) substrate. A particular property was highlighted: the XRD-Raman spectrum confirmed the successful production of Cupric oxide (CuO) at 0%Sr, followed by a significant shift in the XRD peaks at 3%Sr as a result of the majority insertion of Sr in the CuO lattice structure. Nevertheless, when the %Sr was increased to 5%, a simultaneous formation of the Sr-CuO nanophase was favored over the incorporation of strontium into the CuO. EDX and SEM-morphology studies show successively the presence of the three deposited elements Cu, Sr, and O, as well as a significant reduction in the size of CuO nano-structures as the %-Sr doping level increases, respectively. From an optical point of view, this structural-morphological modification due to doping affected the absorption property and, as a result, the bandgap Eg decreases slightly from 1.52 to 1.48 and then 1.44 eV, respectively, for 1%-Sr and 3%-Sr, but increases to 1.46 eV for the pass 3 → 5%-Sr. In addition, the CV (cyclic voltammetry) and the GCD (galvanostatic discharge) tests showed that this structural change led to a significant change in the energy storage capacity of Sr-doped CuO-thin films electrodes. The maximum capacity value has increased from 120 mF/cm2 (0%) to 165 mF/cm2 (3%) and then to 139 mF/cm2 for 5%-Sr, which shows that the Sr doping of CuO can improve its pseudocapacitive properties.

本研究采用超声喷涂技术研究了Sr掺杂(0-5%)对氟氧化锡(FTO)衬底上CuO的结构、形态和电化学性能的影响。一个特殊的性质被强调:XRD- raman光谱证实了在Sr为0%时氧化铜(CuO)的成功生产,随后在Sr为3%时,由于大部分Sr插入到CuO晶格结构中,XRD峰发生了显著的变化。然而,当%Sr增加到5%时,Sr-CuO纳米相的同时形成比锶掺入CuO更有利。EDX和sem形貌研究表明,Cu、Sr和O三种元素相继沉积,并且随着%-Sr掺杂水平的增加,CuO纳米结构的尺寸分别显著减小。从光学角度看,掺杂导致的结构形态改变影响了吸收性能,因此,1%-Sr和3%-Sr的带隙Eg分别从1.52减小到1.48和1.44 eV,而3→5%-Sr的带隙Eg增加到1.46 eV。此外,CV(循环伏安法)和GCD(恒流放电)测试表明,这种结构变化导致掺锶cuo薄膜电极的储能能力发生了显著变化。最大容量值从120 mF/cm2(0%)增加到165 mF/cm2(3%),再增加到139 mF/cm2 (5% Sr),表明CuO掺杂Sr可以改善其赝电容性能。
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引用次数: 0
Attention-based bidirectional LSTM model construction and application for lithium-ion battery state-of-health prediction 基于注意力的锂离子电池健康状态预测双向LSTM模型构建及应用
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-08 DOI: 10.1007/s11581-025-06678-3
Zhoujian An, Jin Ma, Xiaoze Du, Yong Ding, Dong Zhang, Jian Fu

Precisely forecasting the State of Health (SOH) of lithium-ion batteries is essential to enhance vehicle safety and refine battery management systems. This study seeks to address the shortcomings of conventional approaches in feature representation, temporal dependency modeling, and forecasting precision by introducing an attention-enhanced bidirectional long short-term memory (Bi LSTM) model for battery SOH estimation. First, the method selects five key features highly correlated with aging from the battery’s charge–discharge cycles as model inputs and validates their effectiveness using Pearson correlation coefficients to ensure the reliability and representativeness of the input data. During model construction, Bi LSTM is employed to fully exploit the temporal dependencies between features, and the attention mechanism dynamically adjusts feature weights, enabling the model to concentrate on more predictive information. Finally, evaluation and validation using NASA’s publicly accessible lithium-ion battery dataset demonstrate the method’s superior effectiveness in SOH prediction for both individual and similar batteries. Compared to a standard LSTM model, it achieves an average decrease of approximately 1.27% in root mean square error (RMSE) and around 1.26% in mean absolute error (MAE). This improvement enhances the model’s ability to generalize while effectively capturing the battery capacity degradation trend and reducing prediction errors.

准确预测锂离子电池的健康状态(SOH)对于提高车辆安全性和完善电池管理系统至关重要。本研究旨在通过引入一种用于电池SOH估计的注意力增强双向长短期记忆(Bi LSTM)模型,解决传统方法在特征表示、时间依赖性建模和预测精度方面的不足。首先,该方法从电池充放电周期中选择与老化高度相关的5个关键特征作为模型输入,并使用Pearson相关系数验证其有效性,以确保输入数据的可靠性和代表性。在模型构建过程中,利用Bi LSTM充分利用特征之间的时间依赖性,并通过注意机制动态调整特征权重,使模型能够集中更多的预测信息。最后,使用NASA可公开访问的锂离子电池数据集进行评估和验证,证明该方法在单个和类似电池的SOH预测方面具有卓越的有效性。与标准LSTM模型相比,该模型的均方根误差(RMSE)平均降低约1.27%,平均绝对误差(MAE)平均降低约1.26%。这种改进增强了模型的泛化能力,同时有效地捕捉电池容量退化趋势,减少了预测误差。
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引用次数: 0
Role of major rare earth (Y3+, La3+, and Gd3+) ions on enhancing supercapacitor performance of CaCO3 nanocomposites 稀土(Y3+、La3+和Gd3+)离子对CaCO3纳米复合材料超级电容器性能的影响
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-05 DOI: 10.1007/s11581-025-06667-6
E. Thenpandiyan, V. Ramasamy, G. Suresh, T. Sathishpriya

The electrochemical behavior of rare earth ions (RE3+) doped CaCO3/PEG nanocomposites (RE3+ = 0.08 mol Y, La, and Gd) synthesized via a biomimetic method using dolomite rock as a carbonate source was thoroughly analyzed through XRD, FTIR, UV–Vis-DRS, Band gap, PL, FE-SEM, and HR-TEM analyses. All the prepared products were in rhombohedral structure, and the obtained crystallite size was in the range of 25–23 nm. The average microstrain and dislocation density of the products were also calculated, and the values are 1.33, 1.35, and 1.73 × 10−3 and 12.69, 13.21, and 22.21 × 1014 for Y, La, and Gd-doped CaCO3/PEG nanocomposites. The FTIR results revealed the presence of characteristic peaks (477, 479, and 465 cm−1), which confirmed that the products were Y, La, and Gd-doped CaCO3/PEG nanocomposites. From the UV–Vis-DRS, band gap, and PL analyses, 0.08 mol RE3+ ions doped CaCO3/PEG nanocomposites demonstrate blue shift absorption and emission values with increasing band gap values (4.50, 4.58, and 4.70 eV). The formation of spherical-shaped morphology was affirmed by FE-SEM and HR-TEM analyses, and the calculated particle size was in the range of 32–26 nm. The pseudocapacitive behavior of 0.08 mol Y, La, and Gd-doped CaCO3/PEG nanocomposite electrodes was confirmed via CV, GCD, and EIS. They showed specific capacitances of 261, 270, and 288 F/g, respectively, at 5 mV/s using a CV curve, with 97% cyclic stability over 1000 cycles. Energy and power density were calculated, and the values are 51.6, 52.6, and 53.4 Wh kg−1 and 1416.28, 1229.21, and 1221.347 W kg−1 for Y3+, La3+, and Gd3+ anchored CaCO3/PEG nanocomposites, at 1 A/g respectively.

采用XRD、FTIR、UV-Vis-DRS、带隙、PL、FE-SEM和HR-TEM等分析手段,对以白云岩为碳酸盐源,采用仿生法制备稀土离子(RE3+)掺杂CaCO3/PEG纳米复合材料(RE3+ = 0.08 mol Y、La和Gd)的电化学行为进行了全面分析。所得产物均为菱形体结构,晶粒尺寸在25 ~ 23 nm之间。计算了产物的平均微应变和位错密度,Y、La和gd掺杂CaCO3/PEG纳米复合材料的平均微应变和位错密度分别为1.33、1.35和1.73 × 10−3,12.69、13.21和22.21 × 1014。FTIR结果显示,产物存在477、479和465 cm−1的特征峰,证实产物是Y、La和gd掺杂的CaCO3/PEG纳米复合材料。通过UV-Vis-DRS、带隙和PL分析,0.08 mol RE3+离子掺杂CaCO3/PEG纳米复合材料的吸收和发射蓝移值随带隙值(4.50、4.58和4.70 eV)的增加而增加。通过FE-SEM和HR-TEM分析,证实了其球形形貌的形成,计算得到的粒径在32 ~ 26 nm之间。通过CV、GCD和EIS验证了0.08 mol Y、La和gd掺杂CaCO3/PEG纳米复合电极的赝电容行为。在5 mV/s的电压下,它们的比电容分别为261、270和288 F/g,在1000次循环中具有97%的循环稳定性。计算得到Y3+、La3+和Gd3+锚定CaCO3/PEG纳米复合材料在1 A/g时的能量和功率密度分别为51.6、52.6和53.4 Wh kg - 1和1416.28、1229.21和1221.347 W kg - 1。
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引用次数: 0
Ni-doped flower-like BiOCl/MXene composite catalysts for enhanced CO₂ reduction performance ni掺杂花状BiOCl/MXene复合催化剂增强CO₂还原性能
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-05 DOI: 10.1007/s11581-025-06671-w
Xiancai Zeng, Junfang Zhu, Weihao Xia, Haoran Zhai, Hongfeng Gao, Pengcheng Wu, Keliang Wu

This study synthesizes Ni-doped BiOCl/MXene composite photocatalysts via a one-pot hydrothermal method for enhanced CO₂ reduction. The ternary heterostructure with highly dispersed Ni2⁺/Ni3⁺ species significantly improves charge separation efficiency, as evidenced by a 2.02-fold increase in carrier lifetime (4.72 ns) from time-resolved photoluminescence measurements. Photoelectrochemical tests demonstrate a photocurrent density of 65.3 μA/cm2, representing a 4.3-fold enhancement over pristine BiOCl, alongside minimal charge transfer resistance. In photocatalytic CO₂ reduction under simulated sunlight, Ni/BiOCl/MXene achieves 91% CO selectivity and a cumulative yield of 53.23 μmol/g over 5 h, corresponding to a production rate of 10.65 μmol/(g·h). This performance reflects a 5.1-fold total yield improvement and a 3.84-fold increase attributable to MXene’s conductive network. Control experiments confirm nickel’s dual role in refining reaction sites and promoting CO₂ adsorption, with CO2-TPD analysis revealing a distinct 350 °C desorption peak indicative of Ni2⁺-stabilized HCOO* intermediates. The catalyst maintains 92% initial activity after five cycles, demonstrating exceptional stability. This work establishes a synergistic mechanism where MXene facilitates interfacial electron transfer while nickel doping optimizes intermediate stabilization, providing new design principles for efficient solar fuel generation.

本研究采用一锅水热法合成了ni掺杂BiOCl/MXene复合光催化剂,以增强CO₂还原能力。具有高度分散Ni2 + /Ni3 +物质的三元异质结构显著提高了电荷分离效率,从时间分辨光致发光测量中可以看出,载流子寿命增加了2.02倍(4.72 ns)。光电化学测试表明,光电流密度为65.3 μA/cm2,比原始BiOCl提高了4.3倍,同时电荷转移电阻最小。在模拟阳光下,Ni/BiOCl/MXene的CO选择性达到91%,5 h的累积产率为53.23 μmol/g,产率为10.65 μmol/(g·h)。这一性能反映了由于MXene的导电网络,总良率提高了5.1倍,提高了3.84倍。对照实验证实了镍在精炼反应位点和促进CO₂吸附方面的双重作用,CO2-TPD分析显示,350°C的解吸峰表明Ni2 +是稳定的HCOO*中间体。经过5次循环后,催化剂仍保持92%的初始活性,表现出优异的稳定性。本工作建立了MXene促进界面电子转移而镍掺杂优化中间稳定性的协同机制,为高效太阳能燃料发电提供了新的设计原则。
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引用次数: 0
Novel synthesis of CoF2 nanoparticles for high-performance supercapacitor electrodes 高性能超级电容器电极用CoF2纳米颗粒的新合成
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-05 DOI: 10.1007/s11581-025-06676-5
Yanli Zhang, Xiaowen Zhang, Qiang Zhang, Li Wang, Xiangming He

Owing to the relatively richer reserves of cobalt than that of ruthenium, multiple valence states of cobalt, and the highly ionic Co-F bond, CoF2 nanomaterial emerges as a promising candidate for the electrode material in alkaline aqueous supercapacitors. Currently, the synthesis process of CoF2 nanomaterial typically requires an ultra-low temperature (0 °C), or a high temperature (> 180 °C) and/or an inert atmosphere environment, which necessitates the use of much electric energy supply and/or costly equipment. It is of great significance to explore a cheaper preparation method for the CoF2 nanomaterial. This study presents a novel and low-cost two-step method to synthesize CoF2 nanoparticles as high-performance electrode materials for alkaline aqueous supercapacitors. The process involves liquid precipitation of CoF2·4H2O at room temperature, followed by Solvothermal treatment at 120 °C in air, eliminating the need for inert atmospheres, high temperatures, or costly equipment. The resulting CoF2 nanoparticles (20–100 nm) exhibit a hierarchical porous structure, providing a large specific surface area (17.85 m2/g) and enhanced electrolyte accessibility. Electrochemical tests reveal a high voltammetric Specific capacitance of 278.1 Fg−1 at 0.005 Vs−1 and discharge Specific capacitance of 440.3 Fg−1 at 0.5 Ag−1, attributed to combined pseudocapacitive and intercalation mechanisms. The material also demonstrates Stable cycling performance over 5000 cycles. This work offers a sustainable pathway for synthesizing advanced electrode materials for energy storage applications.

由于钴的储量比钌丰富,钴的多价态和高离子化的Co-F键,CoF2纳米材料成为碱性水超级电容器电极材料的一个有希望的候选材料。目前,CoF2纳米材料的合成过程通常需要超低温(0°C)或高温(> 180°C)和/或惰性气氛环境,这需要使用大量的电能供应和/或昂贵的设备。探索一种廉价的制备CoF2纳米材料的方法具有重要意义。本研究提出了一种新颖、低成本的两步法合成CoF2纳米颗粒作为碱性水超级电容器的高性能电极材料。该工艺包括在室温下液体沉淀CoF2·4H2O,然后在120°C的空气中进行溶剂热处理,不需要惰性气氛,高温或昂贵的设备。所得的CoF2纳米颗粒(20-100 nm)具有分层多孔结构,具有较大的比表面积(17.85 m2/g)和增强的电解质可及性。电化学测试表明,在0.005 v−1时,其伏安比电容为278.1 Fg−1,在0.5 Ag−1时,其放电比电容为440.3 Fg−1,这是赝电容和插层机制共同作用的结果。该材料还具有超过5000次循环的稳定循环性能。这项工作为合成用于储能应用的先进电极材料提供了一条可持续的途径。
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引用次数: 0
Recent advances in Cu2O-based composites photocatalysts for chromium(VI) reduction: a mini review cu20基复合光催化剂还原六价铬的研究进展
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-04 DOI: 10.1007/s11581-025-06664-9
Jayaprakash Avinash, Thangapandi Chellapandi, Jagan Mohan, Logesh Dhamotharan, Vinusam Vinayagam, S. P. Vijaya Chamundeeswari

Hexavalent chromium (Cr(VI)) is a highly toxic and carcinogenic contaminant that poses severe environmental and health hazards. Photocatalytic reduction using Cu2O-based composites has emerged as a promising approach for Cr(VI) detoxification due to Cu2O's visible light responsiveness, tunable band structure, and excellent redox properties. This mini-review provides an overview of recent advancements in Cu2O-based photocatalysts for Cr(VI) reduction, with a focus on environmental risks of chromium ions, a case study of Cr(VI) pollution, synthesis strategies of Cu2O-based photocatalysts, structural modifications, and photocatalytic mechanisms. Key factors influencing photocatalytic performance, including heterojunction formation, co-catalyst loading, charge separation efficiency, and reaction conditions, are critically examined. Additionally, the challenges associated with Cu2O-based photocatalysts, such as photo-corrosion and scalability limitations, are discussed along with potential strategies to overcome them. Finally, future research directions for enhancing Cu2O-based photocatalytic systems through material innovations and sustainable implementation are outlined. This review aims to provide valuable insights into the development of efficient and stable Cu2O-based photocatalysts for chromium remediation, contributing to cleaner and safer water resources.

六价铬(Cr(VI))是一种高毒性和致癌性污染物,对环境和健康造成严重危害。由于Cu2O的可见光响应性、可调谐的能带结构和优异的氧化还原性能,利用Cu2O基复合材料进行光催化还原已成为一种很有前途的Cr(VI)解毒方法。本文综述了近年来cu20基光催化剂用于还原Cr(VI)的研究进展,重点介绍了铬离子的环境风险、Cr(VI)污染的案例研究、cu20基光催化剂的合成策略、结构修饰和光催化机理。影响光催化性能的关键因素包括异质结形成、共催化剂负载、电荷分离效率和反应条件。此外,还讨论了与cu20基光催化剂相关的挑战,如光腐蚀和可扩展性限制,以及克服这些问题的潜在策略。最后,展望了未来通过材料创新和可持续实施来增强cu20基光催化体系的研究方向。本文旨在为开发高效、稳定的cu20基光催化剂修复铬提供有价值的见解,为水资源的清洁和安全做出贡献。
{"title":"Recent advances in Cu2O-based composites photocatalysts for chromium(VI) reduction: a mini review","authors":"Jayaprakash Avinash,&nbsp;Thangapandi Chellapandi,&nbsp;Jagan Mohan,&nbsp;Logesh Dhamotharan,&nbsp;Vinusam Vinayagam,&nbsp;S. P. Vijaya Chamundeeswari","doi":"10.1007/s11581-025-06664-9","DOIUrl":"10.1007/s11581-025-06664-9","url":null,"abstract":"<div><p>Hexavalent chromium (Cr(VI)) is a highly toxic and carcinogenic contaminant that poses severe environmental and health hazards. Photocatalytic reduction using Cu<sub>2</sub>O-based composites has emerged as a promising approach for Cr(VI) detoxification due to Cu<sub>2</sub>O's visible light responsiveness, tunable band structure, and excellent redox properties. This mini-review provides an overview of recent advancements in Cu<sub>2</sub>O-based photocatalysts for Cr(VI) reduction, with a focus on environmental risks of chromium ions, a case study of Cr(VI) pollution, synthesis strategies of Cu<sub>2</sub>O-based photocatalysts, structural modifications, and photocatalytic mechanisms. Key factors influencing photocatalytic performance, including heterojunction formation, co-catalyst loading, charge separation efficiency, and reaction conditions, are critically examined. Additionally, the challenges associated with Cu<sub>2</sub>O-based photocatalysts, such as photo-corrosion and scalability limitations, are discussed along with potential strategies to overcome them. Finally, future research directions for enhancing Cu<sub>2</sub>O-based photocatalytic systems through material innovations and sustainable implementation are outlined. This review aims to provide valuable insights into the development of efficient and stable Cu<sub>2</sub>O-based photocatalysts for chromium remediation, contributing to cleaner and safer water resources.</p></div>","PeriodicalId":599,"journal":{"name":"Ionics","volume":"31 11","pages":"11481 - 11496"},"PeriodicalIF":2.6,"publicationDate":"2025-09-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145561122","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"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
DFT-guided design of PdAg catalysts for ORR: Pd₂Ag₂ as an optimal composition dft指导下的PdAg催化剂ORR: Pd₂Ag₂的最佳组成设计
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-03 DOI: 10.1007/s11581-025-06581-x
Tianao Cheng, Zhian Luo, Zhihua Gu

Designing efficient and cost-effective catalysts for the oxygen reduction reaction (ORR) is critical for advancing fuel cell technologies. In this work, we employ density functional theory (DFT) to systematically investigate the catalytic properties of PdAg alloys with varying atomic compositions. Among the configurations studied, the Pd₂Ag₂ surface exhibits the most favorable free energy profile for the four-electron ORR pathway, with a notably low overpotential. Electronic structure analysis reveals a d-band center shift and enhanced adsorption balance as key contributors to its superior catalytic activity.To provide a foundation for the experimental realization of PdAg alloys, we fabricated pure silver electrodes via high-temperature sintering at 500 °C, 600 °C, and 700 °C. Morphological characterization using optical microscopy and scanning electron microscopy (SEM) demonstrates that sintering temperature significantly influences the grain structure and surface crystallinity of the Ag electrodes, offering a tunable platform for future Pd integration.This combined theoretical–experimental approach offers both a clear computational design principle and a practical fabrication pathway for the development of high-performance PdAg catalysts for ORR applications.

为氧还原反应(ORR)设计高效、经济的催化剂是推进燃料电池技术的关键。在这项工作中,我们采用密度泛函理论(DFT)系统地研究了不同原子组成的PdAg合金的催化性能。在研究的构型中,Pd₂Ag₂表面表现出最有利的四电子ORR路径自由能分布,其过电位明显较低。电子结构分析表明,d波段中心移位和增强的吸附平衡是其优越催化活性的关键因素。为了给PdAg合金的实验实现提供基础,我们通过500℃、600℃和700℃的高温烧结制备了纯银电极。利用光学显微镜和扫描电镜(SEM)进行的形态表征表明,烧结温度显著影响Ag电极的晶粒结构和表面结晶度,为未来的Pd集成提供了可调平台。这种理论与实验相结合的方法为开发用于ORR的高性能PdAg催化剂提供了明确的计算设计原理和实用的制造途径。
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引用次数: 0
Washing effect on high voltage single crystal of LiNi0.59Co0.3Ti0.1Al0.01O2 (NCTA) cathode materials by water 水对lini0.59 co0.3 ti0.1 al0.010 o2 (NCTA)阴极材料高压单晶的水洗效果
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-03 DOI: 10.1007/s11581-025-06655-w
Lailatul Isti’adzah, Muhd Firdaus Kasim, Kelimah Elong, Farish Irfal Saaid, Maziidah Hamidi, Nurul Dhabitah Basri, Anna Lia, Azira Azahidi, Ahmad Azmin Mohamad

A washing treatment process for cathode materials is crucial for eliminating residual lithium on the surface, which can effectively enhance lithium-ion battery cell performance. In this work, LiNi0.59Co0.3Ti0.1Al0.01O2 (NCTA) cathode materials were synthesized using the co-precipitation method, and the effects of different washing durations with water were investigated. XRD results revealed that the synthesized sample was a single phase with a hexagonal layered structure of the R-3 m space group. Rietveld refinements revealed that the washed sample exhibited lower cation mixing compared to the unwashed sample, which showed that the unwashed samples had particle agglomeration and the existence of Li residue on the surface of the cathode materials. Interestingly, after the washing treatment, the NCTA appeared as single crystal particles with clean, smooth surfaces. Charge/discharge studies demonstrated that the washed sample showed a significant increase in initial discharge capacity compared to the unwashed sample. The optimal washing duration was found to be 15 min (W15), resulting in the best initial discharge specific capacity of 161.86 mAh/g at 0.1 C with a capacity retention of 81.9% after 100 cycles at room temperature. The W15 sample also shows a great rate capability compared to the unwashed sample, as evident by having a higher discharge capacity at each C-rate. This excellent performance can be attributed to the good structural integrity, single crystal morphology, and lower resistance of the W15 sample compared to the unwashed sample. This work demonstrates that the water washing treatment is efficient in removing Li residue on the surface and improving the electrochemical performances.

Graphical Abstract

正极材料的洗涤处理工艺是消除表面残留锂离子的关键,可以有效提高锂离子电池的性能。本文采用共沉淀法合成了lini0.59 co0.3 ti0.1 al0.010 o2 (NCTA)正极材料,并考察了不同水洗时间对材料性能的影响。XRD结果表明,合成的样品为单相,具有r - 3m空间基团的六方层状结构。Rietveld细化表明,与未洗涤样品相比,洗涤样品的阳离子混合率较低,这表明未洗涤样品存在颗粒团聚和阴极材料表面存在Li残留物。有趣的是,经过洗涤处理后,NCTA呈现为具有干净,光滑表面的单晶颗粒。充电/放电研究表明,与未洗涤样品相比,洗涤样品的初始放电容量显着增加。最佳洗涤时间为15 min (W15),在0.1℃下的最佳初始放电比容量为161.86 mAh/g,在室温下循环100次后的容量保持率为81.9%。与未洗涤的样品相比,W15样品也显示出很大的速率能力,在每个c速率下都具有更高的放电容量。这种优异的性能可以归因于W15样品的良好的结构完整性,单晶形态,以及与未洗涤样品相比更低的电阻。研究表明,水洗处理能有效去除表面的锂渣,提高电化学性能。图形抽象
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引用次数: 0
Exploring the photocatalytic degradation of Direct Black 122 dye using Ni-doped magnesium ferrichromite nanoparticles synthesized by sol–gel method 探讨溶胶-凝胶法制备掺杂镍铁镁纳米颗粒光催化降解直接黑122染料的研究
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-02 DOI: 10.1007/s11581-025-06673-8
Parmeshwar T. Lokhande, Dattatray K. Narale, Sandip M. Deshmukh, Bhimrao R. Torane, Vijay T. Vader

Water dye contamination has been increasing recently, which has serious toxicological repercussions for human health and the ecosystem. In this study, we synthesized a series of spinel ferrite nanomaterials with the composition Mg1-xNixFeCrO4 (0.0 ≤ x ≤ 1.0) using a cost-effective sol–gel method. The structural, morphological, compositional, thermal, and optical properties of the synthesized samples were systematically investigated using XRD, FTIR, SEM, EDX, TGA, and UV-DRS. XRD results confirmed the formation of single-phase spinel structures, with crystallite size influenced by the Ni substitution level. FTIR analysis verified the characteristic vibrational modes of spinel ferrites. SEM images revealed uniform morphology with particle agglomeration, while EDX confirmed the elemental composition and homogeneity. TGA demonstrated good thermal stability of the materials. UV-DRS analysis revealed that increasing Ni content systematically tuned the band gap energy, thereby influencing the photocatalytic activity. Among the series, the MgFeCrO₄ (x = 0.0) sample exhibited the highest photocatalytic efficiency, achieving 96% degradation of Direct Black 122 dye within just 15 min under UV–visible light irradiation. The improved performance is ascribed to its suitable band gap, efficient charge carrier separation, and surface characteristics. These findings demonstrate the strong potential of MgFeCrO₄ as an efficient photocatalyst for wastewater treatment.

近年来,水染料污染日益严重,对人类健康和生态系统产生了严重的毒理学影响。本研究采用溶胶-凝胶法合成了一系列尖晶石铁氧体纳米材料,其组成为Mg1-xNixFeCrO4(0.0≤x≤1.0)。采用XRD、FTIR、SEM、EDX、TGA、UV-DRS等手段对合成样品的结构、形貌、组成、热、光学性能进行了系统的研究。XRD结果证实形成了单相尖晶石结构,晶粒尺寸受Ni取代水平的影响。FTIR分析验证了尖晶石铁氧体的特征振动模式。SEM图像显示了均匀的形貌和颗粒团聚,而EDX证实了元素组成和均匀性。热重测试表明材料具有良好的热稳定性。UV-DRS分析表明,Ni含量的增加系统地调节了带隙能量,从而影响了光催化活性。其中,MgFeCrO₄(x = 0.0)样品表现出最高的光催化效率,在紫外-可见光照射下,仅15分钟即可降解直接黑色122染料96%。性能的提高主要归功于其合适的带隙、高效的载流子分离和表面特性。这些发现证明了硫酸镁作为一种高效的光催化剂用于废水处理的强大潜力。
{"title":"Exploring the photocatalytic degradation of Direct Black 122 dye using Ni-doped magnesium ferrichromite nanoparticles synthesized by sol–gel method","authors":"Parmeshwar T. Lokhande,&nbsp;Dattatray K. Narale,&nbsp;Sandip M. Deshmukh,&nbsp;Bhimrao R. Torane,&nbsp;Vijay T. Vader","doi":"10.1007/s11581-025-06673-8","DOIUrl":"10.1007/s11581-025-06673-8","url":null,"abstract":"<div><p>Water dye contamination has been increasing recently, which has serious toxicological repercussions for human health and the ecosystem. In this study, we synthesized a series of spinel ferrite nanomaterials with the composition Mg<sub>1-<i>x</i></sub>Ni<sub><i>x</i></sub>FeCrO<sub>4</sub> (0.0 ≤ <i>x</i> ≤ 1.0) using a cost-effective sol–gel method. The structural, morphological, compositional, thermal, and optical properties of the synthesized samples were systematically investigated using XRD, FTIR, SEM, EDX, TGA, and UV-DRS. XRD results confirmed the formation of single-phase spinel structures, with crystallite size influenced by the Ni substitution level. FTIR analysis verified the characteristic vibrational modes of spinel ferrites. SEM images revealed uniform morphology with particle agglomeration, while EDX confirmed the elemental composition and homogeneity. TGA demonstrated good thermal stability of the materials. UV-DRS analysis revealed that increasing Ni content systematically tuned the band gap energy, thereby influencing the photocatalytic activity. Among the series, the MgFeCrO₄ (<i>x</i> = 0.0) sample exhibited the highest photocatalytic efficiency, achieving 96% degradation of Direct Black 122 dye within just 15 min under UV–visible light irradiation. The improved performance is ascribed to its suitable band gap, efficient charge carrier separation, and surface characteristics. These findings demonstrate the strong potential of MgFeCrO₄ as an efficient photocatalyst for wastewater treatment.\u0000</p></div>","PeriodicalId":599,"journal":{"name":"Ionics","volume":"31 11","pages":"11947 - 11959"},"PeriodicalIF":2.6,"publicationDate":"2025-09-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145561336","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"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
Palladium-integrated MnO2/delaminated boron nanocomposite as an efficient electrocatalyst toward ethanol electrooxidation in an alkaline medium 钯集成MnO2/分层硼纳米复合材料在碱性介质中作为乙醇电氧化的高效电催化剂
IF 2.6 4区 化学 Q3 CHEMISTRY, PHYSICAL Pub Date : 2025-09-02 DOI: 10.1007/s11581-025-06659-6
Mustapha Balarabe Idris, Bhekie B. Mamba, Fuku Xolile

The design of a high-performance electrocatalyst for ethanol oxidation is a key requirement for fabricating direct ethanol fuel cells with high efficiency and durability. Herein, palladium is integrated with MnO2/delaminated boron (B) to form MnO2-B-Pd nanocomposite. The ethanol electrooxidation studies of MnO2-B-Pd nanocomposite and Pd–C were investigated by recording cyclic voltammograms (CVs) in 2 M NaOH + 2 M ethanol, which revealed that MnO2-B-Pd nanocomposite demonstrated higher mass activity of 592.75 mA mg−1 Pd as compared to Pd–C. Furthermore, the onset potential for the forward scan for MnO2-B-Pd nanocomposite is more negative (− 0.233 V), as compared to that of Pd–C (− 0.191 V), which suggests a lower electrocatalytic activation barrier and thus improved reaction kinetics of ethanol. The kinetics studies revealed that MnO2-B-Pd has a faster charge transfer reaction (electron transfer rate constant (ko) = 3.68 × 10−4), and the overall electron transfer is controlled by diffusion of the reactant at the electrode/electrolyte interfaces.

设计一种高性能的乙醇氧化电催化剂是制造高效耐用的直接乙醇燃料电池的关键要求。本文将钯与MnO2/分层硼(B)结合,形成MnO2-B- pd纳米复合材料。通过在2 M NaOH + 2 M乙醇中记录循环伏安图(cv),对MnO2-B-Pd纳米复合材料和Pd - c进行了乙醇电氧化研究,结果表明MnO2-B-Pd纳米复合材料的质量活性为592.75 mA mg−1 Pd,比Pd - c具有更高的质量活性。此外,与Pd-C (- 0.191 V)相比,MnO2-B-Pd纳米复合材料的正向扫描电位更负(- 0.233 V),这表明MnO2-B-Pd纳米复合材料具有更低的电催化激活势垒,从而改善了乙醇的反应动力学。动力学研究表明,MnO2-B-Pd具有更快的电荷转移反应(电子转移速率常数(ko) = 3.68 × 10−4),总体电子转移受反应物在电极/电解质界面的扩散控制。
{"title":"Palladium-integrated MnO2/delaminated boron nanocomposite as an efficient electrocatalyst toward ethanol electrooxidation in an alkaline medium","authors":"Mustapha Balarabe Idris,&nbsp;Bhekie B. Mamba,&nbsp;Fuku Xolile","doi":"10.1007/s11581-025-06659-6","DOIUrl":"10.1007/s11581-025-06659-6","url":null,"abstract":"<div><p>The design of a high-performance electrocatalyst for ethanol oxidation is a key requirement for fabricating direct ethanol fuel cells with high efficiency and durability. Herein, palladium is integrated with MnO<sub>2</sub>/delaminated boron (B) to form MnO<sub>2</sub>-B-Pd nanocomposite. The ethanol electrooxidation studies of MnO<sub>2</sub>-B-Pd nanocomposite and Pd–C were investigated by recording cyclic voltammograms (<i>CV</i>s) in 2 M NaOH + 2 M ethanol, which revealed that MnO<sub>2</sub>-B-Pd nanocomposite demonstrated higher mass activity of 592.75 mA mg<sup>−1</sup> Pd as compared to Pd–C. Furthermore, the onset potential for the forward scan for MnO<sub>2</sub>-B-Pd nanocomposite is more negative (− 0.233 V), as compared to that of Pd–C (− 0.191 V), which suggests a lower electrocatalytic activation barrier and thus improved reaction kinetics of ethanol. The kinetics studies revealed that MnO<sub>2</sub>-B-Pd has a faster charge transfer reaction (electron transfer rate constant (<i>k</i><sup>o</sup>) = 3.68 × 10<sup>−4</sup>), and the overall electron transfer is controlled by diffusion of the reactant at the electrode/electrolyte interfaces.\u0000</p></div>","PeriodicalId":599,"journal":{"name":"Ionics","volume":"31 11","pages":"11961 - 11975"},"PeriodicalIF":2.6,"publicationDate":"2025-09-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s11581-025-06659-6.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145561335","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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Ionics
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