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High-frequency EMI shielding performance of nickel-substituted cobalt nano-ferrites encapsulated by polyaniline 聚苯胺封装镍取代钴纳米铁氧体的高频电磁屏蔽性能
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-11-13 DOI: 10.1016/j.synthmet.2025.118023
Ashwini Rayar , Prasanna G.D. , Shreedhara K.M. , Pamu Dobbidi , P.S.D. Rekha Phani , Naveen C.S.
The combination of polyaniline (PANI) with nickel-substituted cobalt ferrite creates a core-shell nanocomposite material that harnesses the beneficial properties of both materials. In this work, we synthesized nickel-substituted cobalt ferrite NixCo1-xFe2O4 (x = 0, 0.1, 0.2, 0.3, 0.4, 0.5) nanocomposites using the solution combustion method and PANI composites by in situ polymerization techniques. The crystalline phase of the nanocomposites was characterized using X-ray diffraction (XRD), which revealed an average crystallite size of 30.02–39.70 nm. Fourier Transform Infrared (FTIR) spectroscopy confirmed the functional groups in the nanocomposites. The field-emission scanning electron micrograph (FESEM) showed the interaction between the cobalt-nickel particles and the PANI nanocomposites. The elemental composition was confirmed using Energy Dispersive Spectroscopy (EDS). The nanocomposites exhibit excellent magnetic properties, as confirmed by the results obtained using the physical property measurement system (PPMS 14 T). It was found that the magnetization increases with increasing Cobalt substitution. The highest shielding effectiveness value of 12.82 dB was obtained for the PANI/Ni0.4Co0.6Fe2O4 sample at 13.19 GHz. These core-shell nanocomposites possess potential applications in electromagnetic shielding.
聚苯胺(PANI)与镍取代钴铁氧体的结合创造了一种核壳纳米复合材料,它利用了这两种材料的有益特性。本文采用溶液燃烧法合成了镍取代钴铁氧体NixCo1-xFe2O4 (x = 0,0.1,0.2,0.3,0.4,0.5)纳米复合材料,采用原位聚合技术合成了聚苯胺复合材料。利用x射线衍射(XRD)对复合材料的晶相进行了表征,发现其平均晶粒尺寸为30.02 ~ 39.70 nm。傅里叶变换红外光谱(FTIR)证实了纳米复合材料中的官能团。场发射扫描电镜(FESEM)显示了钴镍颗粒与聚苯胺纳米复合材料之间的相互作用。元素组成用能谱仪(EDS)确定。利用物理性能测量系统(PPMS 14 T)获得的结果证实,纳米复合材料具有优异的磁性能。磁化强度随钴取代量的增加而增加。在13.19 GHz下,PANI/Ni0.4Co0.6Fe2O4样品的屏蔽效能值最高,为12.82 dB。这些核壳纳米复合材料在电磁屏蔽方面具有潜在的应用前景。
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引用次数: 0
Enhanced performance of Si/C anode prepared by a relatively green and simple strategy 采用相对绿色和简单的策略制备了性能提高的Si/C阳极
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-11-18 DOI: 10.1016/j.synthmet.2025.118028
Huiying Xie , Zhengyan Jiang , Jiaqin Huang , Yiming Yu , Jizhang Chen , Qinghua Tian
Despite significant improvement in performance, green and simple preparation of Si/C anodes remains a challenge. Nevertheless, both high performance and green and simple preparation are equally important for the development of Si/C anodes. Herein, to balance the needs of Si/C anodes for the improved performance and the green and simple preparation methods, B-Si NPs@C composites composed of cost-effective irregular Si particles coated with polyethylene glycol (PEG)-derived carbon have been prepared by using only PEG reagent as the carbon source and dispersant and just involving ball-milling and carbonization processes. This preparation strategy shows relatively green and simple characteristics. More importantly, thus PEG-derived carbon coating effectively mitigates the problems of large volumetric expansions and poor conductivity faced by Si anodes. Consequently, B-Si NPs@C-2 with the optimized carbon coating shows superior lithium storage performance, with 1055.1 mAh g−1 after 300 cycles at 400 mA g−1 and 733.3 mAh g−1 after 1100 cycles at 1000 mA g−1. Taking into account the advantages of the relatively green and simple preparation process and the superb performance of B-Si NPs@C-2, this study might pave the way towards a green and more sustainable development of the advanced Si/C anodes for lithium-ion batteries.
尽管性能有了显著的提高,但绿色和简单的Si/C阳极制备仍然是一个挑战。然而,高性能、绿色和简单的制备对于Si/C阳极的发展同样重要。为了平衡Si/C阳极对性能提高的需求和绿色简单的制备方法,本文仅以聚乙二醇(PEG)衍生碳为碳源和分散剂,采用PEG试剂作为碳源和分散剂,制备了经济高效的不规则Si颗粒包覆聚乙二醇(PEG)衍生碳的B-Si NPs@C复合材料。该制备策略具有相对绿色、简单的特点。更重要的是,聚乙二醇衍生的碳涂层有效地缓解了硅阳极面临的体积膨胀大和导电性差的问题。因此,具有优化碳涂层的B-Si NPs@C-2表现出优异的锂存储性能,在400 mA g−1下,300次循环后的锂存储性能为1055.1 mAh g−1,在1000 mA g−1下,1100次循环后的锂存储性能为733.3 mAh g−1。考虑到B-Si NPs@C-2相对绿色简单的制备工艺和优异的性能,本研究可能为锂离子电池先进Si/C阳极的绿色和可持续发展铺平道路。
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引用次数: 0
Enhanced electrochemical performance of innovative BaAl2O4/PANI nanocomposite for next generation supercapacitor applications 用于下一代超级电容器的新型BaAl2O4/PANI纳米复合材料的电化学性能增强
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-11-29 DOI: 10.1016/j.synthmet.2025.118053
Muhammad Jamil , Albandari.W. Alrowaily , B.M. Alotaibi , Haifa A. Alyousef , Eman Alzahrani , Hussain Sawwan , Rizwan Ul Hassan
Supercapacitors are currently receiving a valuable attention due to their convenient deployment, modular design, extended life time, low cost, and eco-friendliness. Transition metal oxides with conducting polymers, serve as electrode materials for supercapacitors having far more surface area and the others supercapacitive properties. In this work, novel BaAl2O4/PANI nanocomposite fabricated by using simple yet reliable hydrothermal process. X-ray diffraction, Brunauer-Emmett-Teller, scanning electron microscopy, and Fourier Transform infrared spectroscopy are used to confirm crystallinity, high surface area, morphology, and functional group, respectively of fabricated electrodes. The prepared nanocomposite exhibited a significant surface area (51.2 m²/g) as determined by BET analysis. SEM revealed that BaAl2O4 was densely distributed on PANI, which possessed a smoother and more compact surface. When electrochemical analysis was determined in 3 M KOH, BaAl2O4/PANI shows the Csp 1247 F g−1, Ed 25.01 Wh kg−1 and Pd of 190 W kg−1. Additionally, synthesized material presented exceptional consistency following 10000th stability cycle. The BaAl2O4/PANI nanocomposite's Rs and Rct values, as determined by EIS analysis, are 0.98 Ω and 0.08 respectively. These results shown that BaAl2O4/PANI nanocomposite is a prospective option for next-generation supercapacitors because of its outstanding and noteworthy properties, as well as its high stability and affordability.
超级电容器由于其方便的部署、模块化设计、延长使用寿命、低成本和生态友好性,目前正受到人们的重视。具有导电聚合物的过渡金属氧化物作为超级电容器的电极材料,具有更大的表面积和其他超级电容性能。本文采用简单可靠的水热法制备了新型的BaAl2O4/PANI纳米复合材料。利用x射线衍射、布鲁诺尔-埃米特-泰勒、扫描电子显微镜和傅里叶变换红外光谱分别对制备的电极的结晶度、高表面积、形貌和官能团进行了证实。BET分析表明,制备的纳米复合材料具有显著的比表面积(51.2 m²/g)。SEM结果表明,pai表面BaAl2O4分布较密,表面光滑致密。在3 M KOH中进行电化学分析时,BaAl2O4/PANI显示Csp 1247 F g−1,Ed 25.01 Wh kg−1,Pd为190 W kg−1。此外,合成材料在第10000次稳定循环后表现出优异的一致性。经EIS分析,BaAl2O4/PANI纳米复合材料的Rs和Rct值分别为0.98 Ω和0.08。这些结果表明,BaAl2O4/PANI纳米复合材料具有优异的性能、高稳定性和可负担性,是下一代超级电容器的理想选择。
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引用次数: 0
Organic solar cells based on PM6:Y7 and doped with boron-dipyrromethene (B1) PM6:Y7掺杂硼-二吡罗甲烷(B1)的有机太阳能电池
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-11-21 DOI: 10.1016/j.synthmet.2025.118030
J. Alberto Arroyo-Valdez , José-Luis Maldonado , Julio C. Carrillo-Sendejas , Andrés Plaza-Martínez , Anderson Alvarez-Quesada , Julio Israel Gallardo-Nieto , Margarita Romero-Ávila , Norberto Farfán , Héctor García-Ortega
In this work, organic solar cells (OSCs) based on PM6:Y7 active layer doped with a new boron-dipyrromethene (B1) at different concentrations are reported. OSCs were fabricated and tested under regular atmospheric conditions, employing the conventional structure: glass/ITO/PEDOT:PSS/PM6:Y7:B1/PFN/FM where Field’s metal (FM), a eutectic alloy of Bi, In, and Sn served as an alternative top electrode, deposited via drop coating at 85 ºC, eliminating the requirement of a high-vacuum chamber. The PM6:Y7 (1:1.2 wt%) blend was prepared at a concentration of 20 mg/mL in anhydrous chlorobenzene, the B1 best concentration was 1 wt% (with respect to the total mass). The average reached power conversion efficiency (PCE) for 1 % of B1 devices was 11.07 % (best PCE = 11.82 %) while for the reference devices it was 10.02 % (best PCE = 10.45 %), this means 10.47 % of PCE enhancement over the reference OSCs.
本文报道了在PM6:Y7活性层上掺杂不同浓度的新型硼-二吡罗甲烷(B1)的有机太阳能电池(OSCs)。OSCs采用常规结构:玻璃/ITO/PEDOT:PSS/PM6:Y7:B1/PFN/FM,其中Field 's metal (FM), Bi, In和Sn的共晶合金作为替代顶电极,在85℃下通过滴涂沉积,消除了对高真空室的要求。在无水氯苯浓度为20 mg/mL的条件下制备PM6:Y7(1:1.2 wt%)共混物,B1最佳浓度为1 wt%(相对于总质量)。1 %的B1器件的平均达到功率转换效率(PCE)为11.07 %(最佳PCE = 11.82 %),而参考器件的平均达到功率转换效率(PCE)为10.02 %(最佳PCE = 10.45 %),这意味着PCE比参考OSCs提高了10.47 %。
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引用次数: 0
High performance integrated multilayered triboelectric nanogenerator fabricated using ethylene vinyl acetate and MXene nanoparticle 用乙烯醋酸乙烯和MXene纳米粒子制备的高性能集成多层摩擦电纳米发电机
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-11-26 DOI: 10.1016/j.synthmet.2025.118047
Vida Heidari , Shervin Ahmadi , Seyed Hassan Jafari , Soroush Shams
This study presents a systematic investigation into the design, fabrication, and optimization of triboelectric nanogenerators (TENGs) for efficient mechanical-to-electrical energy conversion. Ethylene-vinyl acetate (EVA) was employed as the primary positive dielectric, with vinyl acetate (VA) contents of 18 %, 28 %, and 40 % to evaluate its influence on device performance. MXene, a two-dimensional conductive nanomaterial, was incorporated to enhance electrical output, while aluminum served as both the negative dielectric and electrode. Increasing VA content led to improved voltage output, with EVA40 % demonstrating the best performance and selected for further development. A 500 µm EVA40 % film generated the highest voltage. MXene addition significantly boosted output, with 0.4 wt% and 0.8 wt% concentrations yielding enhanced voltage and current levels. Microstructural analysis confirmed uniform MXene dispersion within the EVA matrix. Atomic force microscopy revealed increased surface roughness, contributing to improved triboelectric performance, while X-ray diffraction showed that MXene did not notably affect EVA crystallinity. Mechanical input parameters were also optimized: increasing applied force from 1 N to 4 N improved output, while further increase to 5 N caused a decline. At the optimal force of 4 N, a contact frequency of 3 Hz produced the maximum output, followed by a decrease at higher frequencies. These findings highlight the synergistic effect of high VA content and MXene integration in enhancing TENG performance, demonstrating their potential for sustainable energy harvesting applications.
本研究对摩擦纳米发电机的设计、制造和优化进行了系统的研究,以实现高效的机械能到电能的转换。以乙烯-醋酸乙烯酯(EVA)为主要正介质,乙酸乙烯酯(VA)含量分别为18 %、28 %和40 %,评价其对器件性能的影响。MXene是一种二维导电纳米材料,用于增强电输出,而铝同时作为负介电介质和电极。增加VA含量可以改善电压输出,EVA40 %表现出最佳性能,并被选为进一步开发的材料。500 µm EVA40 %薄膜产生最高电压。MXene的加入显著提高了产量,0.4 wt%和0.8 wt%的浓度提高了电压和电流水平。显微结构分析证实了EVA基体中均匀的MXene分散。原子力显微镜显示表面粗糙度增加,有助于改善摩擦电性能,而x射线衍射显示MXene对EVA结晶度没有显著影响。对机械输入参数也进行了优化:施加的力从1 N增加到4 N可以提高输出,再增加到5 N会导致输出下降。在最佳力为4 N时,接触频率为3 Hz时产生最大输出,随后在更高频率时减小。这些发现强调了高VA含量和MXene集成在提高TENG性能方面的协同效应,展示了它们在可持续能源收集应用方面的潜力。
{"title":"High performance integrated multilayered triboelectric nanogenerator fabricated using ethylene vinyl acetate and MXene nanoparticle","authors":"Vida Heidari ,&nbsp;Shervin Ahmadi ,&nbsp;Seyed Hassan Jafari ,&nbsp;Soroush Shams","doi":"10.1016/j.synthmet.2025.118047","DOIUrl":"10.1016/j.synthmet.2025.118047","url":null,"abstract":"<div><div>This study presents a systematic investigation into the design, fabrication, and optimization of triboelectric nanogenerators (TENGs) for efficient mechanical-to-electrical energy conversion. Ethylene-vinyl acetate (EVA) was employed as the primary positive dielectric, with vinyl acetate (VA) contents of 18 %, 28 %, and 40 % to evaluate its influence on device performance. MXene, a two-dimensional conductive nanomaterial, was incorporated to enhance electrical output, while aluminum served as both the negative dielectric and electrode. Increasing VA content led to improved voltage output, with EVA40 % demonstrating the best performance and selected for further development. A 500 µm EVA40 % film generated the highest voltage. MXene addition significantly boosted output, with 0.4 wt% and 0.8 wt% concentrations yielding enhanced voltage and current levels. Microstructural analysis confirmed uniform MXene dispersion within the EVA matrix. Atomic force microscopy revealed increased surface roughness, contributing to improved triboelectric performance, while X-ray diffraction showed that MXene did not notably affect EVA crystallinity. Mechanical input parameters were also optimized: increasing applied force from 1 N to 4 N improved output, while further increase to 5 N caused a decline. At the optimal force of 4 N, a contact frequency of 3 Hz produced the maximum output, followed by a decrease at higher frequencies. These findings highlight the synergistic effect of high VA content and MXene integration in enhancing TENG performance, demonstrating their potential for sustainable energy harvesting applications.</div></div>","PeriodicalId":22245,"journal":{"name":"Synthetic Metals","volume":"317 ","pages":"Article 118047"},"PeriodicalIF":4.6,"publicationDate":"2026-02-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145621775","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
Fluorination effects on the electronic structure, optical properties, and first hyperpolarizability of CDT-BT donor-acceptor dimers: A DFT/TD-DFT and QTAIM study 氟化对CDT-BT供体-受体二聚体电子结构、光学性质和第一超极化率的影响:DFT/TD-DFT和QTAIM研究
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2026-01-21 DOI: 10.1016/j.synthmet.2026.118088
Mouslim Messali , Imen Cherif , Bakhet A. Alqurashy , Sahbi Ayachi
A series of CDT-BT donor-acceptor dimers with different degrees of fluorine substitution were investigated to clarify the influence of fluorination on their electronic structure, optical properties, and nonlinear optical (NLO) response. Density functional theory (DFT) and time-dependent DFT (TD-DFT) calculations were employed to analyze frontier molecular orbitals, absorption behavior, electric dipole moments, polarizability, and first- and second-order hyperpolarizabilities, complemented by quantum theory of atoms in molecules (QTAIM) analysis. The isotropic polarizability remains nearly constant across the series (α₀ ≈ 207–210 ×10−24 esu), while the polarizability anisotropy increases slightly upon fluorination (Δα = 226.1–233.2 ×10−24 esu), indicating enhanced electronic asymmetry. The electric dipole moment increases from 3.09 D for the non-fluorinated dimer to 7.78 and 7.36 D for the mono- and di-fluorinated derivatives, respectively, reflecting strengthened intramolecular charge transfer along the molecular axis. The first-order hyperpolarizability shows a pronounced increase from 393 × 10−30 esu to 843 × 10−30 esu upon fluorination and is dominated by the longitudinal component. In contrast, the second-order hyperpolarizability exhibits moderate variation (γ₀ ≈ 2.18–2.28 ×104 ×10−36 esu), governed primarily by overall electronic delocalization. These results demonstrate how fluorination modulates second- and third-order NLO responses through distinct physical mechanisms, providing quantitative insight into structure-property relationships in CDT-BT donor-acceptor dimers.
研究了一系列不同氟取代度的CDT-BT供体-受体二聚体,以阐明氟化对其电子结构、光学性质和非线性光学响应的影响。采用密度泛函理论(DFT)和时变DFT (TD-DFT)计算分析前沿分子轨道、吸收行为、电偶极矩、极化率、一阶和二阶超极化率,并辅之以分子中原子量子理论(QTAIM)分析。各向同性极化率在整个系列中几乎保持不变(α 0≈207-210 ×10−24 esu),而极化率各向异性在氟化后略有增加(Δα = 226.1-233.2 ×10−24 esu),表明电子不对称性增强。电偶极矩从无氟二聚体的3.09 D增加到单氟二聚体的7.78 D和二氟二聚体的7.36 D,反映了分子内沿分子轴的电荷转移增强。氟化后,一阶超极化率从393 × 10−30 esu显著增加到843 × 10−30 esu,并以纵向分量为主。相比之下,二阶超极化率表现出适度的变化(γ 0≈2.18-2.28 ×104 ×10−36 esu),主要由整体电子离域控制。这些结果证明了氟化如何通过不同的物理机制调节二阶和三阶NLO反应,为CDT-BT供体-受体二聚体的结构-性质关系提供了定量的见解。
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引用次数: 0
Synthesis and evaluation of PEDOT:PSS-based inks for inkjet-printed carbon microstructures for C-MEMS applications 用于C-MEMS喷墨打印碳微结构的PEDOT: pss基油墨的合成与评价
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-12-02 DOI: 10.1016/j.synthmet.2025.118056
Adriana Hernández-Contreras , Jesús Díaz-Sánchez , Oscar Pilloni
Inkjet printing has emerged as a promising alternative for microfabrication, offering mask-free, rapid, and material-efficient patterning. While inkjet-compatible formulations are widely used for the fabrication of electronic devices, their potential as carbon precursors for Carbon Microelectromechanical Systems (C-MEMS) remains largely unexplored. Additionally, access to commercial inks can be limited in certain regions, posing challenges for researchers seeking to implement this technology. To overcome these limitations, this study investigates the formulation of five PEDOT:PSS-derived carbon precursor inks. These formulations were synthesized and evaluated based on viscosity, surface tension, and wettability to determine their printability. Among them, two inks met the necessary rheological criteria and were successfully printed into rectangular patterns, which were subsequently pyrolyzed at 900 °C. Morphological analysis using SEM and optical profilometry revealed that one of the printed features exhibited a shrinkage of 63.97 % following pyrolysis, decreasing from 26.83 ± 7.53 nm to 9.66 ± 1.36 nm. Electrical characterization further demonstrated an 80 % reduction in resistivity, from 46.61 ± 16.98 Ω·cm to 8.76 ± 0.59 Ω·cm. Raman spectroscopy confirmed the formation of glass-like carbon structures in both pyrolyzed inks. Collectively, these results highlight the potential of the formulated PEDOT:PSS-based inks as a viable and accessible alternatives to commercially available options for inkjet-printed C-MEMS applications.
喷墨印刷已经成为一种很有前途的微加工替代方案,提供无掩模、快速和材料高效的图案。虽然喷墨兼容配方广泛用于电子器件的制造,但它们作为碳微机电系统(C-MEMS)碳前体的潜力仍未得到充分开发。此外,在某些地区,商业油墨的使用可能受到限制,这给寻求实施这项技术的研究人员带来了挑战。为了克服这些限制,本研究研究了五种PEDOT: pss衍生碳前驱体油墨的配方。根据粘度、表面张力和润湿性对这些配方进行合成和评估,以确定其印刷适性。其中,两种油墨满足了必要的流变标准,并成功地印刷成矩形图案,随后在900°C下进行热解。通过扫描电镜和光学形貌分析发现,其中一个打印特征在热解后收缩了63.97 %,从26.83 ± 7.53 nm下降到9.66 ± 1.36 nm。电学表征进一步表明,电阻率降低了80 %,从46.61 ± 16.98 Ω·cm降至8.76 ± 0.59 Ω·cm。拉曼光谱证实了两种热解油墨中玻璃样碳结构的形成。总的来说,这些结果突出了配方PEDOT: pss油墨的潜力,作为喷墨打印C-MEMS应用的可行和可访问的替代品。
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引用次数: 0
Symmetry breaking induced by indirect charge transfer governs photophysics of TIPS-pentacene 间接电荷转移引起的对称破缺支配着tips -五苯的光物理
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2026-01-10 DOI: 10.1016/j.synthmet.2026.118078
Jieun Lee , Jaewook Kim , Juno Kim , Woojae Kim
Understanding how molecular structure and the surrounding environment shape the electronic states of organic chromophores is crucial for controlling their photophysical responses. In this study, we examine the solvent-polarity-dependent excited-state behavior of TIPS-pentacene (TIPS-Pc), a formally centrosymmetric acene derivative widely employed in organic optoelectronics. Although the absorption spectra of TIPS-Pc show little dependence on solvent polarity, the emission spectra exhibit clear positive solvatochromism, broadened line shapes, and changes in vibronic intensity ratios, indicating subtle yet distinct modifications in the nature of the S1 state. To account for these effects, we invoke the concept of symmetry breaking, typically associated with quadrupolar donor-acceptor-donor systems, and apply it to TIPS-Pc. Femtosecond transient absorption measurements reveal that in apolar solvents, the excited-state absorption in the near-infrared region is dominated by the Laporte-allowed S1 → S2 transition. In polar solvents, however, solvent-induced fluctuations perturb the molecular centrosymmetry, enabling both the S1 → S2 and the otherwise Laporte-forbidden S1 → S3 transitions. Quantum-chemical analysis indicates that although the TIPS substituents do not directly contribute to the π–π* excitation, the experimental results apparently suggest that their inductive effects indirectly enhance charge-transfer character and could promote exciton desymmetrization.
了解分子结构和周围环境如何塑造有机发色团的电子状态对于控制其光物理响应至关重要。在这项研究中,我们研究了广泛应用于有机光电子学的一种形式中心对称的苯乙烯衍生物TIPS-pentacene (TIPS-Pc)的溶剂极性依赖的激化态行为。尽管TIPS-Pc的吸收光谱对溶剂极性的依赖性很小,但发射光谱表现出明显的正溶剂变色、线形变宽以及振动强度比的变化,表明S1态的性质发生了微妙而明显的改变。为了解释这些影响,我们引用了对称破缺的概念,通常与四极性供体-受体-供体系统相关,并将其应用于TIPS-Pc。飞秒瞬态吸收测量表明,在极性溶剂中,近红外区的激发态吸收主要由拉波特允许的S1→S2跃迁主导。然而,在极性溶剂中,溶剂诱导的波动扰乱了分子的中心对称性,使S1→S2和拉波特禁止的S1→S3转变成为可能。量子化学分析表明,虽然TIPS取代基不直接参与π -π *激发,但实验结果明显表明,它们的诱导效应间接增强了电荷转移特性,促进了激子的非对称化。
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引用次数: 0
Preparation and investigation of magnetic and thermal properties of Ni0.5Cu0.5-xYbxFe2O4 (X = 0.0, 0.1 & 0.2) nano ferrite for magneto-thermal applications 用于磁热应用的Ni0.5Cu0.5-xYbxFe2O4 (X = 0.0,0.1 & 0.2)纳米铁氧体的制备及磁性和热性能研究
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2026-01-13 DOI: 10.1016/j.synthmet.2026.118079
Hanamanta Badiger , B.G. Hegde , Jogada Shivakumar , Shidaling Matteppanavar , Santosh Y. Khatavi
This study reports the successful synthesis of Ni0.5Cu0.5-xYbxFe2O4 (x = 0.0, 0.1 and 0.2) (NCYFO) nanoparticles using a low-temperature sol-gel auto-combustion route. The study highlights its comprehensive investigation of the structural, magnetic, thermal, and electrical properties. X-ray diffraction confirmed a single-phase cubic spinel structure. The approach of Rietveld refinement analysis showed the diffracted peaks are well fitted with Bragg’s position. As the doping level increased, lattice constant are increased and crystallite values are decreased from 20 nm to 12 nm. The presence of five Raman modes further validated the cubic spinel structure. Room temperature M-H loops suggesting a weak ferrimagnetic behavior at higher doping level. Dielectric analysis demonstrated Maxwell–Wagner interfacial polarization consistent with Koop’s theory, while complex impedance spectroscopy indicated a non-Debye type of relaxation. Cole-Cole plot exhibits a straight line and followed by a skewed semicircle. The thermal analysis showed minimal weight loss (2.96 %), confirming the high thermal stability imparted by Yb doping. These combined results, particularly the enhanced thermal stability and magnetic behavior suggesting that, NCYFO nano particles are potential for thermal and magnetic applications.
本研究报道了采用低温溶胶-凝胶自燃烧方法成功合成Ni0.5Cu0.5-xYbxFe2O4 (x = 0.0,0.1和0.2)(NCYFO)纳米颗粒。该研究强调了其对结构、磁性、热学和电学性质的全面研究。x射线衍射证实为单相立方尖晶石结构。Rietveld细化分析表明,衍射峰与Bragg位置拟合良好。随着掺杂水平的增加,晶格常数增加,晶值从20 nm降低到12 nm。五种拉曼模式的存在进一步验证了立方尖晶石结构。室温M-H环表明在较高掺杂水平下具有弱铁磁行为。介电分析显示麦克斯韦-瓦格纳界面极化符合Koop理论,而复阻抗谱显示非德拜型弛豫。Cole-Cole图呈现一条直线,然后是一个歪斜的半圆。热分析显示失重最小(2.96 %),证实了Yb掺杂带来的高热稳定性。这些综合结果,特别是增强的热稳定性和磁性行为表明,NCYFO纳米颗粒具有热磁性应用的潜力。
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引用次数: 0
Sustainable hydrophobic and strength film coatings for corrosion protection: Lignin biopolymer as an attractive film former on carbon steel- a way towards green chemistry 用于防腐的可持续疏水和强度膜涂层:木质素生物聚合物作为一种有吸引力的碳钢成膜剂-通往绿色化学的道路
IF 4.6 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-01 Epub Date: 2025-12-18 DOI: 10.1016/j.synthmet.2025.118061
Soukaina. Akachar , Youssef. Zarki , Hafssa. Majdoub , Leila. Azaryouh , Mounir. El Achaby , Ahmed. Ait Aghzzaf , Khalid. Draoui
Lignin, an abundant byproduct of biomass processing, holds great promise for sustainable material applications. As a novel stride, in this study, pure lignin was extracted from raw Alfa fibers through a single, eco-friendly alkali treatment and assessed as both a green corrosion inhibitor and a coating precursor for carbon steel (CS). Electrochemical techniques revealed that the synthesized Alkali lignin (S-AL) achieved 92.9 % inhibition efficiency, surpassing commercial Alkali lignin (C-AL) by forming an adsorbed thin organic barrier on the CS surface. Harnessing this property, S-AL was spray-deposited into a uniform film whose high hydrophobicity (92.11°), low water uptake (10 %), and strong adhesion translated into superior long-term corrosion resistance. Structural and surface analyses (XRD, FT-IR, TGA, SEM-EDS, Zeta potential, and particle size) confirmed the purity of S-AL and the integrity of the coating. This waste-to-coating approach delivers a high-performance, sustainable alternative for steel protection.
木质素是生物质加工的一种丰富的副产品,在可持续材料应用方面具有很大的前景。作为一项新的进展,本研究通过单一、环保的碱处理从原阿尔法纤维中提取纯木质素,并评估其作为绿色缓蚀剂和碳钢(CS)涂层前驱体的性能。电化学技术表明,合成的碱木质素(S-AL)通过在CS表面形成吸附的薄有机屏障,抑制效率达到92.9 %,超过了商品碱木质素(C-AL)。利用这一特性,S-AL被喷涂成均匀的膜,其高疏水性(92.11°),低吸水性(10 %)和强附着力转化为优异的长期耐腐蚀性。结构和表面分析(XRD, FT-IR, TGA, SEM-EDS, Zeta电位和粒度)证实了S-AL的纯度和涂层的完整性。这种废物转化为涂层的方法为钢铁保护提供了一种高性能、可持续的替代方案。
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Synthetic Metals
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