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Role of hygroscopic nanofillers and plasticizer in enhancing ionic transport and structural stability of plasticized chitosan-based nanocomposite polymer electrolyte membranes for fuel cells 吸湿性纳米填料和增塑剂在增强增塑型壳聚糖基纳米复合聚合物燃料电池电解质膜离子传输和结构稳定性中的作用
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-09 DOI: 10.1016/j.matchemphys.2026.132212
Qamber Ali , Taweesak Boonsod , Rojana Pornprasertsuk , Wanwisa Limphirat , Wirach Taweepreda , Kanoktip Boonkerd
The growing demand for high-performance, environmentally friendly, and cost-effective polymer electrolyte membranes (PEMs) has driven increasing interest in natural polymer-based materials. Chitosan (CS), a renewable and biodegradable biopolymer, offers a promising alternative to conventional synthetic PEMs but suffers from limited proton conductivity and stability. This work systematically investigated the incorporation of hygroscopic nanofiller (calcium oxide nanofiller, CaO–NF) and plasticizer (ethylene carbonate, EC) into a CS matrix and their effects on PEMs’ performance. Fourier-transform infrared (FTIR) analysis confirmed the formation of hydrogen-bonding interactions among the CS matrix, CaO–NF, and EC. Scanning electron microscopy coupled with energy dispersive spectroscopy (SEM-EDS) revealed a homogeneous dispersion of CaO–NF throughout the CS matrix. X-ray diffraction (XRD) analysis showed that the incorporation of CaO–NF and EC promoted the formation of amorphous region in the CS matrix, facilitating ion transport and resulting in a high ion-exchange capacity (IEC) of 3.5 meq.g−1 and a proton conductivity of 166 mS cm−1 for the CS/CaO1/EC1 membrane. Arrhenius analysis revealed a reduction in activation energy upon the incorporation of an optimized amount of nanofiller and plasticizer, confirming enhanced ion transport efficiency within the membrane matrix. The maximum chemical stability was achieved with the incorporation of 1 wt% CaO–NF, extending membrane durability to 86 h compared with 70 h for the pristine CS membrane; however, the stability decreased when EC was added to the CS/CaO1 membrane. Based on comparisons with commercial PEMs reported in the literature, the CS/CaO1/EC1 membrane exhibited competitive proton conductivity together with excellent thermal stability, chemical stability, and mechanical properties, highlighting its potential for high-performance fuel cell applications.
随着对高性能、环保、高性价比聚合物电解质膜的需求不断增长,人们对天然聚合物基材料的兴趣日益浓厚。壳聚糖(CS)是一种可再生、可生物降解的生物聚合物,是传统合成PEMs的一种很有前途的替代品,但其质子导电性和稳定性有限。本文系统地研究了吸湿性纳米填充剂(氧化钙纳米填充剂,CaO-NF)和增塑剂(碳酸乙烯,EC)在CS基体中的掺入及其对PEMs性能的影响。傅里叶红外(FTIR)分析证实了CS基体、CaO-NF和EC之间形成了氢键相互作用。扫描电子显微镜和能量色散光谱(SEM-EDS)显示,CaO-NF在CS基体中均匀分散。x射线衍射(XRD)分析表明,CaO-NF和EC的掺入促进了CS基体中无定形区域的形成,促进了离子的传递,离子交换容量(IEC)达到3.5 meq。CS/CaO1/EC1膜的质子电导率为166 mS cm−1。阿伦尼乌斯分析显示,在加入优化量的纳米填料和增塑剂后,活化能降低,证实了膜基质内离子传输效率的提高。当添加1 wt%的CaO-NF时,达到了最大的化学稳定性,将膜的耐久性从原始CS膜的70 h延长到86 h;CS/CaO1膜中加入EC后,稳定性下降。通过与文献中报道的商用pem的比较,CS/CaO1/EC1膜具有极好的质子导电性以及优异的热稳定性、化学稳定性和机械性能,突出了其在高性能燃料电池应用中的潜力。
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引用次数: 0
Psoralen-loaded polycaprolactone microspheres: A pH-responsive drug carrier for the treatment of rheumatoid arthritis 补骨脂素负载聚己内酯微球:用于治疗类风湿性关节炎的ph反应性药物载体
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-08 DOI: 10.1016/j.matchemphys.2026.132185
Lixian Zhu , Zhijie Gao , Tengyue Zhang , Hechao Zhao , Dexian Zeng , Yanhua Wang
Developing novel drug carriers for delivery of psoralen (PSO) is crucial to inhibit the pathogenesis of rheumatoid arthritis (RA). This work aims to develop PSO-loaded polycaprolactone (PCL) microspheres through a single emulsion solvent evaporation route, improving the bioavailability and controllable release of PSO. The resulting PCL@PSO microspheres are characterized by multiple physicochemical techniques. Results show the loading of PSO onto PCL, via surface adsorption, increases the size and specific surface area. Accordingly, the encapsulation efficiency and loading capacity of PCL@PSO microspheres are (87.77 ± 0.07)% and (12.28 ± 0.01)%, respectively. Strikingly, such microspheres exhibit pH-responsive drug kinetics, predominantly releasing PSO in alkaline environments in contrast with neutral or acidic conditions. This release pattern, mostly caused by diffusion, is conducive to inhibit inflammatory response whilst promote osteanagenesis in bone microenvironment. Cell experiments confirm PCL@PSO microspheres are cytocompatible with BMSCs cell but strongly toxic to RBL-2H3 cell. Mechanistically, mitochondrial apoptotic pathway, as evidenced by the up-regulation of pro-apoptosis proteins such as Caspase3, Cyto-c and Bax, is activated by PCL@PSO via increased ROS and reduced mitochondria membrane potentials. Further, the up-regulation of APC and LATS1, and the down-regulation of OIP5 are contributed to the apoptosis of RBL-2H3 cell. Moreover, PCL@PSO could down-regulate the expression of histamine receptor HRH1 in RBL-2H3 cell, thereby inhibiting inflammation expansion. However, the study is limited by the absence of in vivo animal validation, and the underlying mechanisms remain to be fully elucidated. In particular, the upstream regulatory pathways governing ROS generation have yet to be comprehensively investigated. Conclusively, it is feasible to use PCL@PSO microspheres as candidate micro-carriers to deliver PSO, terminally inhibiting inflammatory response whilst promoting osteanagenesis, especially for individuals suffered from rheumatoid arthritis.
开发新型药物载体递送补骨脂素(PSO)对抑制类风湿关节炎(RA)的发病机制至关重要。本课题旨在通过单乳液溶剂蒸发途径制备负载PSO的聚己内酯(PCL)微球,提高PSO的生物利用度和可控释放度。所得PCL@PSO微球通过多种物理化学技术进行表征。结果表明,PSO通过表面吸附作用加载到PCL上,增大了PCL的尺寸和比表面积。由此可知,PCL@PSO微球的包封效率为(87.77±0.07)%,负载能力为(12.28±0.01)%。引人注目的是,这种微球表现出ph响应药物动力学,与中性或酸性条件相比,在碱性环境中主要释放PSO。这种主要由扩散引起的释放模式有利于抑制炎症反应,同时促进骨微环境中的成骨。细胞实验证实PCL@PSO微球与骨髓间充质干细胞具有细胞相容性,但对RBL-2H3细胞具有强毒性。从机制上讲,线粒体凋亡途径通过增加ROS和降低线粒体膜电位,PCL@PSO激活,如Caspase3、Cyto-c和Bax等促凋亡蛋白上调。APC和LATS1上调,OIP5下调参与RBL-2H3细胞的凋亡。此外,PCL@PSO可以下调RBL-2H3细胞中组胺受体HRH1的表达,从而抑制炎症扩张。然而,由于缺乏体内动物验证,该研究受到限制,其潜在机制仍有待充分阐明。特别是,调控活性氧生成的上游调控途径尚未得到全面研究。综上所述,使用PCL@PSO微球作为PSO的候选微载体是可行的,可以最终抑制炎症反应,同时促进成骨,特别是对于类风湿关节炎患者。
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引用次数: 0
Upcycling waste paper into carbon dot; AgI composites for efficient pesticide degradation 将废纸升级为碳点;高效降解农药的AgI复合材料
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-08 DOI: 10.1016/j.matchemphys.2026.132205
Bosely Anne Bose , Abhijit Saha , Ange Nzihou , Nandakumar Kalarikkal
Organic pesticides are persistent pollutants that accumulate in the environment, posing serious risks to ecosystems and human health, particularly through contamination of water resources. Photocatalytic degradation offers a sustainable and efficient approach for eliminating these pesticides, providing a green solution for environmental remediation. In this study, we report a sustainable, eco-friendly approach to synthesizing carbon dots (CDs) from waste paper and incorporating them into silver iodide (AgI) to form highly efficient visible-light photocatalyst composites. The CDs, derived from waste paper, offer advantages of low cost, low toxicity, and excellent water solubility. The integration of CDs into AgI significantly enhances charge transfer and suppresses electron–hole recombination. The resulting AgI–CD composites exhibited superior photocatalytic activity (97% in 150 min) for the degradation of the pesticide Thiram, with the composite containing 10 wt% CD achieving the highest performance. This study not only provides a green recycling route for waste paper but also demonstrates the potential of AgI–CD composites for effective environmental remediation.
有机农药是在环境中积累的持久性污染物,特别是通过污染水资源,对生态系统和人类健康构成严重风险。光催化降解为消除这些农药提供了可持续、高效的途径,为环境修复提供了绿色解决方案。在这项研究中,我们报告了一种可持续、环保的方法,从废纸中合成碳点(cd),并将其与碘化银(AgI)结合,形成高效的可见光光催化剂复合材料。从废纸中提取的cd具有成本低、毒性低、水溶性好等优点。将CDs集成到AgI中显著增强了电荷转移,抑制了电子-空穴复合。所得的AgI-CD复合材料在降解杀虫剂Thiram方面表现出优异的光催化活性(在150 min内达到97%),其中含有10 wt% CD的复合材料达到最高性能。本研究不仅为废纸的绿色回收提供了一条途径,也展示了AgI-CD复合材料在环境修复中的潜力。
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引用次数: 0
Green synthesis and characterization of platinum nanoparticles loaded with paclitaxel and coated with chitosan: a promising approach for breast cancer treatment 负载紫杉醇并包覆壳聚糖的铂纳米颗粒的绿色合成和表征:一种治疗乳腺癌的有前途的方法
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-07 DOI: 10.1016/j.matchemphys.2026.132192
Mouhaned Y. Al-darwesh , Maroua Manai , Nesrine Boughzala , Hammouda Chebbi
Paclitaxel resistance remains a major therapeutic challenge in breast cancer, and is particularly pronounced in inflammatory breast cancer (IBC), where intrinsic aggressiveness contributes to limited response and rapid disease progression. In this study, we designed an eco-friendly synthesis method to develop a novel nanosystem based on platinum nanoparticles (Pt NPs) loaded with paclitaxel (PTX) as an efficient drug delivery platform for the treatment of breast cancer. The Pt NPs were synthesized using a green method employing Foeniculum vulgare (F. vulgare) seed extract. These nanoparticles were then loaded with PTX and coated with chitosan (Ch) to enhance drug delivery efficiency. The physicochemical properties of the nanoparticles were characterized using X-ray Diffraction (XRD), Transmission Electron Microscopy (TEM), Thermogravimetric Analysis (TGA), Field Emission Scanning Electron Microscopy (FESEM), Fourier Transform Infrared Spectroscopy (FTIR), Ultraviolet-Visible (UV-Vis) absorption spectroscopy, and zeta potential measurements. X-ray Diffraction (XRD) analysis confirmed the high purity and distinct crystalline nature of the resulting nanoparticles (Pt NPs and Pt-PTX-Ch). FESEM analyses revealed that the nanoparticles had a spherical morphology with a tendency to aggregate, with an average size ranging between 17 and 20 nm. Spectroscopic analysis showed absorption peaks at 270 nm for Pt NPs and 279 nm for Pt-PTX-Ch. Surface measurements recorded zeta potential values of −24 mV for Pt NPs and +36 mV for Pt-PTX-Ch. The nanoparticles demonstrated good biocompatibility with red blood cells (RBCs) in hemolytic activity assays, exhibiting no hemolytic effects at concentrations ranging from 7.5 to 120 μg/mL. Drug release studies indicated a sustained and pH-responsive release pattern. Apoptosis assays aligned with MTT results, confirming the effectiveness of the nanoparticles in precisely targeting cancer cells. Our in vitro study showed that the PT and PT + Ch treatments reduced proliferation, colony formation and migration in breast cancer with a better response in inflammatory breast cancer (IBC) (SUM149 and KPL4) vs. non-IBC (nIBC) cells (MDA-MB-231). This study highlights that Pt-PTX-Ch nanoparticles represent a promising system for the delivery of PTX, enhancing its efficacy against breast cancer models with higher response in IBC cells.
紫杉醇耐药仍然是乳腺癌的主要治疗挑战,在炎症性乳腺癌(IBC)中尤其明显,其内在的侵袭性导致有限的反应和快速的疾病进展。在这项研究中,我们设计了一种环保的合成方法,以铂纳米粒子(Pt NPs)负载紫杉醇(PTX)为基础,开发了一种新的纳米系统,作为治疗乳腺癌的有效药物递送平台。以普通小茴香(F. vulgare)种子提取物为原料,采用绿色法合成了Pt NPs。然后将这些纳米颗粒装入PTX并包覆壳聚糖(Ch)以提高药物递送效率。采用x射线衍射(XRD)、透射电子显微镜(TEM)、热重分析(TGA)、场发射扫描电子显微镜(FESEM)、傅里叶变换红外光谱(FTIR)、紫外可见(UV-Vis)吸收光谱和zeta电位测量对纳米颗粒的物理化学性质进行了表征。x射线衍射(XRD)分析证实了所得纳米粒子(Pt NPs和Pt- ptx - ch)的高纯度和独特的晶体性质。FESEM分析表明,纳米颗粒呈球形,具有聚集倾向,平均尺寸在17 ~ 20 nm之间。光谱分析显示,Pt NPs和Pt- ptx - ch的吸收峰分别位于270 nm和279 nm处。表面测量记录的zeta电位值为Pt NPs的−24 mV和Pt- ptx - ch的+36 mV。在溶血活性测定中,纳米颗粒与红细胞具有良好的生物相容性,在7.5 ~ 120 μg/mL浓度范围内无溶血作用。药物释放研究表明,持续和ph响应释放模式。细胞凋亡实验与MTT结果一致,证实了纳米颗粒精确靶向癌细胞的有效性。我们的体外研究表明,PT和PT + Ch治疗可降低乳腺癌的增殖、集落形成和迁移,对炎性乳腺癌(IBC) (SUM149和KPL4)的反应优于非IBC (nIBC)细胞(MDA-MB-231)。这项研究强调,Pt-PTX-Ch纳米颗粒是一种很有前途的PTX递送系统,可以增强其对乳腺癌模型的疗效,并在IBC细胞中产生更高的反应。
{"title":"Green synthesis and characterization of platinum nanoparticles loaded with paclitaxel and coated with chitosan: a promising approach for breast cancer treatment","authors":"Mouhaned Y. Al-darwesh ,&nbsp;Maroua Manai ,&nbsp;Nesrine Boughzala ,&nbsp;Hammouda Chebbi","doi":"10.1016/j.matchemphys.2026.132192","DOIUrl":"10.1016/j.matchemphys.2026.132192","url":null,"abstract":"<div><div>Paclitaxel resistance remains a major therapeutic challenge in breast cancer, and is particularly pronounced in inflammatory breast cancer (IBC), where intrinsic aggressiveness contributes to limited response and rapid disease progression. In this study, we designed an eco-friendly synthesis method to develop a novel nanosystem based on platinum nanoparticles (Pt NPs) loaded with paclitaxel (PTX) as an efficient drug delivery platform for the treatment of breast cancer. The Pt NPs were synthesized using a green method employing <em>Foeniculum vulgare</em> (<em>F. vulgare</em>) seed extract. These nanoparticles were then loaded with PTX and coated with chitosan (Ch) to enhance drug delivery efficiency. The physicochemical properties of the nanoparticles were characterized using X-ray Diffraction (XRD), Transmission Electron Microscopy (TEM), Thermogravimetric Analysis (TGA), Field Emission Scanning Electron Microscopy (FESEM), Fourier Transform Infrared Spectroscopy (FTIR), Ultraviolet-Visible (UV-Vis) absorption spectroscopy, and zeta potential measurements. X-ray Diffraction (XRD) analysis confirmed the high purity and distinct crystalline nature of the resulting nanoparticles (Pt NPs and Pt-PTX-Ch). FESEM analyses revealed that the nanoparticles had a spherical morphology with a tendency to aggregate, with an average size ranging between 17 and 20 nm. Spectroscopic analysis showed absorption peaks at 270 nm for Pt NPs and 279 nm for Pt-PTX-Ch. Surface measurements recorded zeta potential values of −24 mV for Pt NPs and +36 mV for Pt-PTX-Ch. The nanoparticles demonstrated good biocompatibility with red blood cells (RBCs) in hemolytic activity assays, exhibiting no hemolytic effects at concentrations ranging from 7.5 to 120 μg/mL. Drug release studies indicated a sustained and pH-responsive release pattern. Apoptosis assays aligned with MTT results, confirming the effectiveness of the nanoparticles in precisely targeting cancer cells. Our <em>in vitro</em> study showed that the PT and PT + Ch treatments reduced proliferation, colony formation and migration in breast cancer with a better response in inflammatory breast cancer (IBC) (SUM149 and KPL4) <em>vs.</em> non-IBC (nIBC) cells (MDA-MB-231). This study highlights that Pt-PTX-Ch nanoparticles represent a promising system for the delivery of PTX, enhancing its efficacy against breast cancer models with higher response in IBC cells.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132192"},"PeriodicalIF":4.7,"publicationDate":"2026-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146191626","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Enhanced electrochemical properties of Mn and Cu co-doped nickel cobaltite/rGO nanocomposites for superior supercapacitor electrode materials 锰、铜共掺杂钴酸镍/氧化石墨烯纳米复合材料的电化学性能
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-07 DOI: 10.1016/j.matchemphys.2026.132184
Faria Usman , Samra Zeb , Mahwish Afzia , Xianmin Zhang , Rafaqat Ali Khan
In this study, pristine NiCo2O4 and its Mn/Cu co-doped derivatives i.e., Ni1-xMnxCo2-yCuyO4 nanoparticles, were synthesized by co-precipitation method, followed by their composite formation with rGO. The materials were characterized by XRD, FTIR, XPS and SEM to confirm the structure, morphology, surface chemical features and composition. XPS analysis confirmed the oxygen vacancies and electrically active metal sites, which enhanced electrode–electrolyte interactions as well as surface redox activity. Electrochemical studies indicated that composites with a nominal composition of Ni0.5Mn0.5Co1.0Cu1.0O4/rGO, achieved maximum specific capacitance, measuring 1738 F g-1 at a scan rate of 5 mVs−1 with improved energy density of 196 Wh/Kg. GCD studies confirmed improved rate capability and remarkable cyclic stability, with its rGO composite retaining 95% of its specific capacitance after 5000 cycles at 5 A g-1. The maximum specific capacitance we observed in this case was 558 F g-1 at 1 A g-1, having the capability of maintaining the property over various cycles. Additionally, the EIS behavior confirmed that Mn–Cu co-doped composite material with rGO has less series resistance (Rs). Nyquist plots supported the EIS analysis, confirming that all synthesized materials showed best capacitive behavior. Moreover, Mn–Cu co-doped composite had the lowest equivalent series resistance of 180 mΩ in comparison to that of pristine NiCo2O4. Through Randles circuits, we carefully interpreted how different interfaces are formed at electrode surface to undergo redox reaction beneficial for electrochemical activities.
本研究采用共沉淀法合成了原始NiCo2O4及其Mn/Cu共掺杂衍生物Ni1-xMnxCo2-yCuyO4纳米颗粒,并与还原氧化石墨烯(rGO)复合形成。采用XRD、FTIR、XPS和SEM对材料进行了表征,确定了材料的结构、形貌、表面化学特征和组成。XPS分析证实了氧空位和电活性金属位点,这增强了电极-电解质相互作用和表面氧化还原活性。电化学研究表明,复合材料的标称成分为Ni0.5Mn0.5Co1.0Cu1.0O4/rGO,在扫描速率为5 mv−1,能量密度提高到196 Wh/Kg时,比电容达到1738 F -1,达到最大。GCD研究证实了其提高的倍率性能和显著的循环稳定性,在5a g-1下循环5000次后,其还原氧化石墨烯复合材料保持了95%的比电容。在这种情况下,我们观察到的最大比电容为558 F -1,在1 A g-1时,具有在各种循环中保持性能的能力。此外,EIS行为证实了Mn-Cu共掺杂rGO的复合材料具有较小的串联电阻(Rs)。奈奎斯特图支持EIS分析,证实所有合成材料都表现出最佳的电容行为。Mn-Cu共掺杂复合材料的等效串联电阻最低,为180 mΩ。通过Randles电路,我们仔细地解释了电极表面如何形成不同的界面以进行有利于电化学活动的氧化还原反应。
{"title":"Enhanced electrochemical properties of Mn and Cu co-doped nickel cobaltite/rGO nanocomposites for superior supercapacitor electrode materials","authors":"Faria Usman ,&nbsp;Samra Zeb ,&nbsp;Mahwish Afzia ,&nbsp;Xianmin Zhang ,&nbsp;Rafaqat Ali Khan","doi":"10.1016/j.matchemphys.2026.132184","DOIUrl":"10.1016/j.matchemphys.2026.132184","url":null,"abstract":"<div><div>In this study, pristine NiCo<sub>2</sub>O<sub>4</sub> and its Mn/Cu co-doped derivatives i.e., Ni<sub>1-x</sub>Mn<sub>x</sub>Co<sub>2-y</sub>Cu<sub>y</sub>O<sub>4</sub> nanoparticles, were synthesized by co-precipitation method, followed by their composite formation with rGO. The materials were characterized by XRD, FTIR, XPS and SEM to confirm the structure, morphology, surface chemical features and composition. XPS analysis confirmed the oxygen vacancies and electrically active metal sites, which enhanced electrode–electrolyte interactions as well as surface redox activity. Electrochemical studies indicated that composites with a nominal composition of Ni<sub>0.5</sub>Mn<sub>0.5</sub>Co<sub>1.0</sub>Cu<sub>1.0</sub>O<sub>4</sub>/rGO, achieved maximum specific capacitance, measuring 1738 F g<sup>-1</sup> at a scan rate of 5 mVs<sup>−1</sup> with improved energy density of 196 Wh/Kg. GCD studies confirmed improved rate capability and remarkable cyclic stability, with its rGO composite retaining 95% of its specific capacitance after 5000 cycles at 5 A g<sup>-1</sup>. The maximum specific capacitance we observed in this case was 558 F g<sup>-1</sup> at 1 A g<sup>-1</sup>, having the capability of maintaining the property over various cycles. Additionally, the EIS behavior confirmed that Mn–Cu co-doped composite material with rGO has less series resistance (<em>R</em><sub>s</sub>). Nyquist plots supported the EIS analysis, confirming that all synthesized materials showed best capacitive behavior. Moreover, Mn–Cu co-doped composite had the lowest equivalent series resistance of 180 mΩ in comparison to that of pristine NiCo<sub>2</sub>O<sub>4</sub>. Through Randles circuits, we carefully interpreted how different interfaces are formed at electrode surface to undergo redox reaction beneficial for electrochemical activities.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132184"},"PeriodicalIF":4.7,"publicationDate":"2026-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146190784","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Efficient photo-assisted desulfurization of real gas oil using CaFe2O4@SnO2 heterostructure catalyst under visible light irradiation 利用CaFe2O4@SnO2异质结构催化剂在可见光照射下的光辅助脱硫研究
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-07 DOI: 10.1016/j.matchemphys.2026.132189
Asmaa A. Abdelrahman , Wael A. Aboutaleb , Doaa I. Osman , Asmaa I. Zahran
This study introduces an innovative technique for removing sulfur compounds from gas oil with a high sulfur concentration by irradiating it with visible light applying a multiple active site CaFe2O4@SnO2 material as a novel photo-desulfurization catalyst. For comparison, pure SnO2, CaFe2O4 and CaFe2O4@SnO2 were fabricated by modified sol-gel method. The physicochemical characteristics of the synthesized samples were examined by XRD, XPS, BET, SEM, FTIR, UV-vis-DRS and PL technique in order to optimize photodesulfurization. PL and Tauc curves proved the lowest band gab value assigned to CaFe2O4@SnO2. and SEM results revealed the formation of CaFe2O4@SnO2 nano-composite.
The CaFe2O4@SnO2 exhibited excellent desulfurization performance; achieving sulfur removal efficiency of 96.5% under the optimized conditions (3 g/L photocatalyst dosage, H2O2/oil of 4:1 for 30 min and DMF solvent to oil volume ratio of 4:1) and our results indicate remarkable selectivity and recyclability in desulfurization, presenting an alternative viewpoint in the search for effective desulfurization technology. The reaction mechanism was also provided.
本研究介绍了一种利用多活性位点CaFe2O4@SnO2材料作为新型光脱硫催化剂,在可见光照射下脱除高硫浓度汽油中含硫化合物的创新技术。为了比较,采用改进的溶胶-凝胶法制备了纯SnO2、CaFe2O4和CaFe2O4@SnO2。采用XRD、XPS、BET、SEM、FTIR、UV-vis-DRS、PL等技术对合成样品的理化性质进行了表征,以优化光脱硫工艺。PL和tac曲线证明了CaFe2O4@SnO2的最低带隙值。SEM结果表明,纳米复合材料CaFe2O4@SnO2的形成。CaFe2O4@SnO2具有优异的脱硫性能;在光催化剂用量为3 g/L、H2O2/油比为4:1、DMF溶剂与油体积比为4:1的优化条件下,脱硫效率为96.5%,表明了脱硫的选择性和可回收性,为寻找有效的脱硫技术提供了另一种观点。并给出了反应机理。
{"title":"Efficient photo-assisted desulfurization of real gas oil using CaFe2O4@SnO2 heterostructure catalyst under visible light irradiation","authors":"Asmaa A. Abdelrahman ,&nbsp;Wael A. Aboutaleb ,&nbsp;Doaa I. Osman ,&nbsp;Asmaa I. Zahran","doi":"10.1016/j.matchemphys.2026.132189","DOIUrl":"10.1016/j.matchemphys.2026.132189","url":null,"abstract":"<div><div>This study introduces an innovative technique for removing sulfur compounds from gas oil with a high sulfur concentration by irradiating it with visible light applying a multiple active site CaFe<sub>2</sub>O<sub>4</sub>@SnO<sub>2</sub> material as a novel photo-desulfurization catalyst. For comparison, pure SnO<sub>2</sub>, CaFe<sub>2</sub>O<sub>4</sub> and CaFe<sub>2</sub>O<sub>4</sub>@SnO<sub>2</sub> were fabricated by modified sol-gel method. The physicochemical characteristics of the synthesized samples were examined by XRD, XPS, BET, SEM, FTIR, UV-vis-DRS and PL technique in order to optimize photodesulfurization. PL and Tauc curves proved the lowest band gab value assigned to CaFe<sub>2</sub>O<sub>4</sub>@SnO<sub>2</sub>. and SEM results revealed the formation of CaFe<sub>2</sub>O<sub>4</sub>@SnO<sub>2</sub> nano-composite.</div><div>The CaFe<sub>2</sub>O<sub>4</sub>@SnO<sub>2</sub> exhibited excellent desulfurization performance; achieving sulfur removal efficiency of 96.5% under the optimized conditions (3 g/L photocatalyst dosage, H<sub>2</sub>O<sub>2</sub>/oil of 4:1 for 30 min and DMF solvent to oil volume ratio of 4:1) and our results indicate remarkable selectivity and recyclability in desulfurization, presenting an alternative viewpoint in the search for effective desulfurization technology. The reaction mechanism was also provided.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132189"},"PeriodicalIF":4.7,"publicationDate":"2026-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146191595","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Benzothiazole-conjugated perylene diimide/functionalized reduced graphene oxide composite electrode for flexible supercapacitors 柔性超级电容器用苯并噻唑共轭苝酰亚胺/功能化还原氧化石墨烯复合电极
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-07 DOI: 10.1016/j.matchemphys.2026.132170
Sudhir D. Jagadale , Sidhanath V. Bhosale , Sheshanath V. Bhosale
The development of flexible devices based on organic small molecules (OSMs) will be a crucial advantage in modern portable and wearable electronic appliances. In this work, we investigate the energy storage capacity of benzothiazole functionalized perylene diimides such as 2,9-bis(6-methoxybenzo[d]thiazol-2-yl)anthra[2,1,9-def:6,5,10-d'e'f'] diisoquin oline-1,3,8,10(2H,9H)-tetraone (PDI-BTH1) and 2,9-bis(6-hydroxybenzo[d]thiazol-2-yl)anthra[2,1,9-def:6,5,10-d'e'f'] diisoquinoline-1,3,8,10(2H,9H)-tetraone (PDI-BTH2)-reduced graphene oxide (rGO) composite-based electrode materials. The PDI-BTH1/rGO and PDI-BTH2/rGO- based three-electrode supercapacitor (SC) device delivered excellent specific capacitance (Csp) of about 350 and 295.92 F g−1 at 1 A g−1 current density. The presence of the methoxy (–OCH3) group in the organic molecular skeleton influences the Csp of the electrode in the SC device. Moreover, in two-electrode PDI-BTH1/rGO//PDI-BTH1/rGO symmetric supercapacitor devices at 0.5 A g−1 offers remarkable Csp of 321.08 F g−1 and outstanding energy density (ED) of 57.79 Wh kg−1 at 1079.37 W kg−1 power density (PD) with impressive cycling stability of 106.74% after 10000 gravimetric charging and discharging (GCD) cycles. Furthermore, the flexible device has been developed by depositing the PDI-BTH1/rGO electrode layer on graphite foil (GF). By assembling the PDI-BTH1/rGO//PDI-BTH1/rGO on a graphite foil (GF) surface in two-electrode flexible symmetric supercapacitor (FSSC) devices, the electrochemical performance was measured. The electrochemical studies showed that the FSSC device with its two structures with bending angles of 0° and 180° exhibits an excellent Csp of 66.40 mF cm−2 and 57.90 mF cm−2, respectively, at 0.5 mA cm−2. After 5000 GCD cycles, both the FSSC devices with 0° and 180° bending angles exhibited excellent cycling stability with 94.98% and 84.55% Csp retention. The flexible flat SSC device displayed ED of 11.95 μWh cm−2 at 1.66 mW cm−2 PD. Therefore, these FSSC devices represent significant potential for electronics.
基于有机小分子(osm)的柔性器件的发展将是现代便携式和可穿戴电子设备的关键优势。在这项工作中,我们研究了苯并噻唑功能化的苝酰二亚胺的储能能力,如2,9-二(6-甲氧基苯并[d]噻唑-2-基)蒽[2,1,9-def:6,5,10-d' f']二异喹啉-1,3,8,10(2H,9H)-四酮(PDI-BTH1)和2,9-二(6-羟基苯并[d]噻唑-2-基)蒽[2,1,9-def:6,5,10-d' f']二异喹啉-1,3,8,10(2H,9H)-四酮(PDI-BTH2)-还原氧化石墨烯(rGO)复合电极材料。基于PDI-BTH1/rGO和PDI-BTH2/rGO的三电极超级电容器(SC)器件在1 A g−1电流密度下具有优异的比电容(Csp),分别为350和295.92 F g−1。有机分子骨架中甲氧基(-OCH3)的存在影响SC装置中电极的Csp。此外,在双电极条件下,PDI-BTH1/rGO//PDI-BTH1/rGO对称超级电容器器件在0.5 A g−1下的Csp值为321.08 F g−1,在1079.37 W kg−1功率密度(PD)下的能量密度(ED)为57.79 Wh kg−1,在10000次重力充放电(GCD)循环后的循环稳定性为106.74%。此外,通过在石墨箔(GF)上沉积PDI-BTH1/rGO电极层,开发了柔性器件。通过将PDI-BTH1/rGO//PDI-BTH1/rGO组装在双电极柔性对称超级电容器(FSSC)器件的石墨箔(GF)表面,测量了其电化学性能。电化学研究表明,弯曲角度为0°和180°的两种结构的FSSC器件在0.5 mA cm - 2下的Csp值分别为66.40 mF cm - 2和57.90 mF cm - 2。经过5000次GCD循环后,弯曲角度为0°和180°的FSSC器件均表现出良好的循环稳定性,Csp保留率分别为94.98%和84.55%。在1.66 mW cm - 2 PD下,柔性平面SSC器件显示出11.95 μWh cm - 2的ED。因此,这些FSSC器件代表了电子学的巨大潜力。
{"title":"Benzothiazole-conjugated perylene diimide/functionalized reduced graphene oxide composite electrode for flexible supercapacitors","authors":"Sudhir D. Jagadale ,&nbsp;Sidhanath V. Bhosale ,&nbsp;Sheshanath V. Bhosale","doi":"10.1016/j.matchemphys.2026.132170","DOIUrl":"10.1016/j.matchemphys.2026.132170","url":null,"abstract":"<div><div>The development of flexible devices based on organic small molecules (OSMs) will be a crucial advantage in modern portable and wearable electronic appliances. In this work, we investigate the energy storage capacity of benzothiazole functionalized perylene diimides such as 2,9-bis(6-methoxybenzo[<em>d</em>]thiazol-2-yl)anthra[2,1,9-def:6,5,10-d'e'f'] diisoquin oline-1,3,8,10(2H,9H)-tetraone (PDI-BTH1) and 2,9-bis(6-hydroxybenzo[<em>d</em>]thiazol-2-yl)anthra[2,1,9-def:6,5,10-d'e'f'] diisoquinoline-1,3,8,10(2H,9H)-tetraone (PDI-BTH2)-reduced graphene oxide (rGO) composite-based electrode materials. The PDI-BTH1/rGO and PDI-BTH2/rGO- based three-electrode supercapacitor (SC) device delivered excellent specific capacitance (<em>C</em><sub>sp</sub>) of about 350 and 295.92 F g<sup>−1</sup> at 1 A g<sup>−1</sup> current density. The presence of the methoxy (–OCH<sub>3</sub>) group in the organic molecular skeleton influences the <em>C</em><sub>sp</sub> of the electrode in the SC device. Moreover, in two-electrode PDI-BTH1/rGO//PDI-BTH1/rGO symmetric supercapacitor devices at 0.5 A g<sup>−1</sup> offers remarkable <em>C</em><sub>sp</sub> of 321.08 F g<sup>−1</sup> and outstanding energy density (ED) of 57.79 Wh kg<sup>−1</sup> at 1079.37 W kg<sup>−1</sup> power density (PD) with impressive cycling stability of 106.74% after 10000 gravimetric charging and discharging (GCD) cycles. Furthermore, the flexible device has been developed by depositing the PDI-BTH1/rGO electrode layer on graphite foil (GF). By assembling the PDI-BTH1/rGO//PDI-BTH1/rGO on a graphite foil (GF) surface in two-electrode flexible symmetric supercapacitor (FSSC) devices, the electrochemical performance was measured. The electrochemical studies showed that the FSSC device with its two structures with bending angles of 0° and 180° exhibits an excellent <em>C</em><sub>sp</sub> of 66.40 mF cm<sup>−2</sup> and 57.90 mF cm<sup>−2</sup>, respectively, at 0.5 mA cm<sup>−2</sup>. After 5000 GCD cycles, both the FSSC devices with 0° and 180° bending angles exhibited excellent cycling stability with 94.98% and 84.55% <em>C</em><sub>sp</sub> retention. The flexible flat SSC device displayed ED of 11.95 μWh cm<sup>−2</sup> at 1.66 mW cm<sup>−2</sup> PD. Therefore, these FSSC devices represent significant potential for electronics.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132170"},"PeriodicalIF":4.7,"publicationDate":"2026-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146191596","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Plasma resistance and etching behavior of APS Y2O3 coatings modified via NH4F immersion process NH4F浸渍改性APS Y2O3涂层的耐等离子体性能和腐蚀性能
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-06 DOI: 10.1016/j.matchemphys.2026.132200
Jiwon Choi , Daegeun Kim , Hyewon Seok , Kangduk Kim
In this study, a Y2O3 coating layer deposited using the atmospheric plasma spray (APS) method was modified into a YxOyFz layer by controlling various variables with an NH4F salt solution, and the plasma resistance was evaluated to confirm the possibility of its application as a seasoning process for semiconductor etching. As a result of NH4F salt immersion, a new crystalline layer was formed on the Y2O3 coating layer when the salt concentration exceeded 30 wt%. In addition, the formation of a YxOyFz layer by increasing the immersion and heat-treatment temperatures through the reaction between NH4F and Y2O3 was confirmed via scanning electron microscopy (SEM), X-ray diffraction (XRD), and X-ray photoelectron spectroscopy analyses. Plasma resistance evaluation using CF4/Ar/O2 plasma revealed that the etching depth was generally reduced in the specimens in which the YxOyFz layer was formed via immersion compared with the original APS Y2O3 coating layer. SEM, surface roughness, and XRD analyses of the coating after plasma etching confirmed that the plasma resistance improved in the surface-modified specimens, which was attributed to the reduced surface roughness and formation of the yttrium oxyfluoride (YOF) layer. In addition, a gradual decrease in the rate of increase in etching depth was observed with increasing plasma exposure time, along with increased YOF phase formation at a salt concentration of 40 wt%.
在本研究中,采用大气等离子体喷涂(APS)方法沉积的Y2O3涂层,在NH4F盐溶液中通过控制各种变量将其修饰为YxOyFz涂层,并对其等离子体电阻进行了评估,以确定其作为半导体蚀刻调味工艺的可能性。NH4F盐浸泡后,当盐浓度超过30 wt%时,Y2O3涂层上形成新的结晶层。此外,通过扫描电镜(SEM)、x射线衍射(XRD)和x射线光电子能谱分析,证实了NH4F和Y2O3在提高浸泡温度和热处理温度的情况下,通过反应形成YxOyFz层。利用CF4/Ar/O2等离子体进行的等离子体电阻评估表明,与原始APS Y2O3涂层相比,浸泡形成YxOyFz涂层的样品的蚀刻深度普遍降低。等离子体刻蚀后涂层的SEM、表面粗糙度和XRD分析证实,表面改性样品的等离子体电阻有所提高,这是由于表面粗糙度降低和氧化氟化钇(YOF)层的形成。此外,在盐浓度为40%时,随着等离子体曝光时间的增加,蚀刻深度的增长率逐渐下降,同时YOF相的形成也增加。
{"title":"Plasma resistance and etching behavior of APS Y2O3 coatings modified via NH4F immersion process","authors":"Jiwon Choi ,&nbsp;Daegeun Kim ,&nbsp;Hyewon Seok ,&nbsp;Kangduk Kim","doi":"10.1016/j.matchemphys.2026.132200","DOIUrl":"10.1016/j.matchemphys.2026.132200","url":null,"abstract":"<div><div>In this study, a Y<sub>2</sub>O<sub>3</sub> coating layer deposited using the atmospheric plasma spray (APS) method was modified into a Y<sub>x</sub>O<sub>y</sub>F<sub>z</sub> layer by controlling various variables with an NH<sub>4</sub>F salt solution, and the plasma resistance was evaluated to confirm the possibility of its application as a seasoning process for semiconductor etching. As a result of NH<sub>4</sub>F salt immersion, a new crystalline layer was formed on the Y<sub>2</sub>O<sub>3</sub> coating layer when the salt concentration exceeded 30 wt%. In addition, the formation of a Y<sub>x</sub>O<sub>y</sub>F<sub>z</sub> layer by increasing the immersion and heat-treatment temperatures through the reaction between NH<sub>4</sub>F and Y<sub>2</sub>O<sub>3</sub> was confirmed via scanning electron microscopy (SEM), X-ray diffraction (XRD), and X-ray photoelectron spectroscopy analyses. Plasma resistance evaluation using CF<sub>4</sub>/Ar/O<sub>2</sub> plasma revealed that the etching depth was generally reduced in the specimens in which the Y<sub>x</sub>O<sub>y</sub>F<sub>z</sub> layer was formed via immersion compared with the original APS Y<sub>2</sub>O<sub>3</sub> coating layer. SEM, surface roughness, and XRD analyses of the coating after plasma etching confirmed that the plasma resistance improved in the surface-modified specimens, which was attributed to the reduced surface roughness and formation of the yttrium oxyfluoride (YOF) layer. In addition, a gradual decrease in the rate of increase in etching depth was observed with increasing plasma exposure time, along with increased YOF phase formation at a salt concentration of 40 wt%.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132200"},"PeriodicalIF":4.7,"publicationDate":"2026-02-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146192213","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Magnetism of Fe- and/or Co-enriched layer/TiO2/Ti composites Fe-和/或co -富集层/TiO2/Ti复合材料的磁性
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-06 DOI: 10.1016/j.matchemphys.2026.132201
M.V. Adigamova, I.V. Lukiyanchuk, V.P. Morozova, I.A. Tkachenko, K.A. Saiankina, I.V. Malyshev
Ti-supported surface structures with magnetic properties were prepared at constant current density of 0.15 A/cm2 for 10 min using plasma electrolytic oxidation (PEO) in slurry electrolytes with solid particles of Fe(OH)3 and Co(OH)2 formed in situ in different ratios at their constant total concentration. The general electrolyte formula (mol/L) can be written as 0.066 Na3PO4 + 0.034 Na2B4O7 + 0.006 Na2WO4 + 0.08 (Fe(III) + Co(II)). The coatings were characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM), energy-dispersive X-ray spectroscopy (EDX), electron probe microanalysis (EPMA) and magnetometry based on superconducting quantum interference device (SQUID). With an increase in the proportion of Co(OH)2 particles in the electrolyte, the coatings were formed at higher voltages, which caused an increase in their thickness (from 25 to 82 μm) and porosity (from 27 to 35%). As to EPMA/EDX data, the coatings contained up to 6.5/15.8 at% Fe and 6.5/12.5 at% Co, depending on the electrolyte formula. Open pores with particles and closed pores contained up to 25.3 at% Fe and up to 26.1 at% Co. At room temperature, with increasing Co proportion in the coatings, the values of coercive force and saturation magnetization increased from 72 to 292 Oe and from 0.05 to 0.048 emu/g, respectively. At 3 K, the coercive force value in mixed coatings was lower (94–160 Oe) than that in individual coatings containing only one magnetic element (230 Oe). No synergistic effect was observed in mixed Fe-, Co-containing coatings either at room temperature or at helium temperature.
采用等离子体电解氧化(PEO)技术,在恒电流密度为0.15 A/cm2的条件下,原位生成不同比例的Fe(OH)3和Co(OH)2固体颗粒,制备了具有磁性的钛载体表面结构。电解质的一般公式(mol/L)为0.066 Na3PO4 + 0.034 Na2B4O7 + 0.006 Na2WO4 + 0.08 (Fe(III) + Co(II))。采用x射线衍射(XRD)、扫描电镜(SEM)、能量色散x射线能谱(EDX)、电子探针微分析(EPMA)和基于超导量子干涉器件(SQUID)的磁强计对涂层进行了表征。随着电解液中Co(OH)2颗粒比例的增加,涂层在更高的电压下形成,涂层的厚度从25 μm增加到82 μm,孔隙率从27%增加到35%。根据EPMA/EDX数据,根据电解质配方的不同,涂层在% Fe和% Co下的含量分别高达6.5/15.8和6.5/12.5。在室温下,随着Co含量的增加,涂层的矫顽力和饱和磁化强度分别从72 ~ 292 Oe和0.05 ~ 0.048 emu/g增加。在3k时,混合涂层的矫顽力值(94 ~ 160 Oe)低于仅含一种磁性元素的单独涂层(230 Oe)。在室温和氦温度下,混合含铁、含钴涂层均未观察到协同效应。
{"title":"Magnetism of Fe- and/or Co-enriched layer/TiO2/Ti composites","authors":"M.V. Adigamova,&nbsp;I.V. Lukiyanchuk,&nbsp;V.P. Morozova,&nbsp;I.A. Tkachenko,&nbsp;K.A. Saiankina,&nbsp;I.V. Malyshev","doi":"10.1016/j.matchemphys.2026.132201","DOIUrl":"10.1016/j.matchemphys.2026.132201","url":null,"abstract":"<div><div>Ti-supported surface structures with magnetic properties were prepared at constant current density of 0.15 A/cm<sup>2</sup> for 10 min using plasma electrolytic oxidation (PEO) in slurry electrolytes with solid particles of Fe(OH)<sub>3</sub> and Co(OH)<sub>2</sub> formed <em>in situ</em> in different ratios at their constant total concentration. The general electrolyte formula (mol/L) can be written as 0.066 Na<sub>3</sub>PO<sub>4</sub> + 0.034 Na<sub>2</sub>B<sub>4</sub>O<sub>7</sub> + 0.006 Na<sub>2</sub>WO<sub>4</sub> + 0.08 (Fe(III) + Co(II)). The coatings were characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM), energy-dispersive X-ray spectroscopy (EDX), electron probe microanalysis (EPMA) and magnetometry based on superconducting quantum interference device (SQUID). With an increase in the proportion of Co(OH)<sub>2</sub> particles in the electrolyte, the coatings were formed at higher voltages, which caused an increase in their thickness (from 25 to 82 μm) and porosity (from 27 to 35%). As to EPMA/EDX data, the coatings contained up to 6.5/15.8 at% Fe and 6.5/12.5 at% Co, depending on the electrolyte formula. Open pores with particles and closed pores contained up to 25.3 at% Fe and up to 26.1 at% Co. At room temperature, with increasing Co proportion in the coatings, the values of coercive force and saturation magnetization increased from 72 to 292 Oe and from 0.05 to 0.048 emu/g, respectively. At 3 K, the coercive force value in mixed coatings was lower (94–160 Oe) than that in individual coatings containing only one magnetic element (230 Oe). No synergistic effect was observed in mixed Fe-, Co-containing coatings either at room temperature or at helium temperature.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132201"},"PeriodicalIF":4.7,"publicationDate":"2026-02-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146191919","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Design and optimization of MXene–perovskite solar absorbers using multi-geometry metasurface resonators with AI-based modeling 基于人工智能建模的mxene -钙钛矿多几何超表面谐振器太阳能吸收器设计与优化
IF 4.7 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-06 DOI: 10.1016/j.matchemphys.2026.132188
Krunal Patel , Vishal Sorathiya , Amar Y. Jaffar , Ayman Alharbi , Fahd M. Aldosari , Abdullah G. Alharbi
This work presents a design for a novel solar absorber and solar cell featuring a multi-shape resonator configuration, in which different resonator geometries (square, hexagonal, and circular) are integrated atop an Au–HTL–Perovskite–MXene–ETL stack to enhance plasmonic coupling and broadband absorption. The design is examined across a wide wavelength span from 0.15 to 3 μm. The performance of the solar absorber is compared using various ETL and HTL materials, and its response under cell sizes, different layer thicknesses, and resonator shapes is assessed. The addition of two innovative materials, MXene and Perovskite, to the structure enables the development of an ultra-efficient solar absorber that achieves absorption above 80% with angular stability up to 60°. We further simulated the J–V characteristics and showed that the device achieves a short-circuit current density of 22 mA/cm2.We also analzsed refractive index, permittivity, permeability, and impedance to examine metamaterial effects, comparing absorption with the AM 1.5 solar spectrum. The proposed structure is analyzed using different ML models, including Gradient Boosting, kNN, Random Forest, Neural Network, and AdaBoost. For accurate prediction, the proposed model is evaluated using multiple error measurement parameters such as MSE, RMSE, MAE, MAPE, and R2 for precise absorption spectrum prediction. Among all tested ML models, the neural network yields the lowest R2 value of 0.88, while the other four models achieve an R2 of 0.98. These analyses validate a strong potential for applying the proposed absorber design and predictive modelling approach to advanced solar cell technologies and thermal energy applications.
本研究提出了一种具有多形状谐振器配置的新型太阳能吸收器和太阳能电池的设计,其中不同的谐振器几何形状(正方形,六边形和圆形)集成在au - html -钙钛矿- mxene - etl堆栈上,以增强等离子体耦合和宽带吸收。该设计在0.15至3 μm的宽波长范围内进行了测试。比较了不同ETL和HTL材料的太阳能吸收体的性能,并评估了其在电池尺寸、不同层厚度和谐振腔形状下的响应。在结构中添加了两种创新材料MXene和钙钛矿,使超高效太阳能吸收器的开发能够实现80%以上的吸收率,角稳定性高达60°。我们进一步模拟了J-V特性,表明该器件实现了22 mA/cm2的短路电流密度。我们还分析了折射率、介电常数、渗透率和阻抗来检验超材料效应,并将吸收与AM 1.5太阳光谱进行了比较。使用不同的ML模型,包括梯度增强、kNN、随机森林、神经网络和AdaBoost,对所提出的结构进行了分析。为了准确预测,使用MSE、RMSE、MAE、MAPE和R2等多个误差测量参数对所提出的模型进行评估,以精确预测吸收光谱。在所有被测试的ML模型中,神经网络的R2值最低,为0.88,而其他四种模型的R2值为0.98。这些分析验证了将所提出的吸收剂设计和预测建模方法应用于先进太阳能电池技术和热能应用的强大潜力。
{"title":"Design and optimization of MXene–perovskite solar absorbers using multi-geometry metasurface resonators with AI-based modeling","authors":"Krunal Patel ,&nbsp;Vishal Sorathiya ,&nbsp;Amar Y. Jaffar ,&nbsp;Ayman Alharbi ,&nbsp;Fahd M. Aldosari ,&nbsp;Abdullah G. Alharbi","doi":"10.1016/j.matchemphys.2026.132188","DOIUrl":"10.1016/j.matchemphys.2026.132188","url":null,"abstract":"<div><div>This work presents a design for a novel solar absorber and solar cell featuring a multi-shape resonator configuration, in which different resonator geometries (square, hexagonal, and circular) are integrated atop an Au–HTL–Perovskite–MXene–ETL stack to enhance plasmonic coupling and broadband absorption. The design is examined across a wide wavelength span from 0.15 to 3 μm. The performance of the solar absorber is compared using various ETL and HTL materials, and its response under cell sizes, different layer thicknesses, and resonator shapes is assessed. The addition of two innovative materials, MXene and Perovskite, to the structure enables the development of an ultra-efficient solar absorber that achieves absorption above 80% with angular stability up to 60°. We further simulated the J–V characteristics and showed that the device achieves a short-circuit current density of 22 mA/cm<sup>2</sup>.We also analzsed refractive index, permittivity, permeability, and impedance to examine metamaterial effects, comparing absorption with the AM 1.5 solar spectrum. The proposed structure is analyzed using different ML models, including Gradient Boosting, kNN, Random Forest, Neural Network, and AdaBoost. For accurate prediction, the proposed model is evaluated using multiple error measurement parameters such as MSE, RMSE, MAE, MAPE, and R<sup>2</sup> for precise absorption spectrum prediction. Among all tested ML models, the neural network yields the lowest R<sup>2</sup> value of 0.88, while the other four models achieve an R<sup>2</sup> of 0.98. These analyses validate a strong potential for applying the proposed absorber design and predictive modelling approach to advanced solar cell technologies and thermal energy applications.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"354 ","pages":"Article 132188"},"PeriodicalIF":4.7,"publicationDate":"2026-02-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146191913","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","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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