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Enhanced plasticity in Ag-excessive Ag2Se-based thermoelectric materials ag过量ag2se基热电材料的塑性增强
IF 9.4 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-28 DOI: 10.1016/j.jmat.2026.101179
Yitao Yao, Zhiqiang Gao, Pengfei Qiu, Jiali Zhou, Jiawei Zhang, Yasong Wu, Jiong Yang, Xun Shi
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引用次数: 0
Enhanced ion conductivity and stability against Li metal in Dy3+-doped Li2ZrCl6 electrolytes for high-performance all-solid-state batteries 高性能全固态电池用掺杂Dy3+的Li2ZrCl6电解质增强了离子对锂金属的电导率和稳定性
IF 9.4 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-28 DOI: 10.1016/j.jmat.2026.101178
Ying Liang, Chuangjie Guo, Ying Qi, Hetian Chen, Haocheng Yuan, Dengfeng Yu, Peipei Ding, Yue Li, Hong Liu, Yaoyu Ren, Xue Zhang, Ce-Wen Nan
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引用次数: 0
Proton-driven ferromagnetic switching of CoO in flexible magneto-ionic cells 柔性磁离子电池中CoO的质子驱动铁磁开关
IF 9.4 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-24 DOI: 10.1016/j.jmat.2026.101176
Konrad Eiler, Huan Tan, Aitor Arredondo-López, Pau Solsona, Eva Pellicer, Jordi Sort
Electric-field control of ferromagnetism is demonstrated in a mechanically flexible solid-state system through a proton-induced redox reaction at room temperature. Protons transported through a perfluorosulfonic acid (PFSA) proton exchange membrane (PEM) trigger the reduction of CoO by reacting with lattice oxygen, which enables reversible switching between paramagnetic and ferromagnetic states starting at voltages below 10 V. The proton supply is sustained by ambient humidity and water splitting at a Pt thin film counter electrode. Due to its flexibility, the device architecture—a sandwich of CoO and Pt thin films integrated with the polymeric PEM—retains full magneto-ionic functionality under mechanical bending. Three CoO films, synthesized via reactive sputtering under varying conditions, are compared: amorphous, crystalline, and mixed-phase CoO/Co. While the amorphous film exhibits weak response, both the crystalline and mixed-phase films show pronounced electric-field-dependent magnetic switching, highlighting the critical role of microstructure in magneto-ionic performance.
在室温下,通过质子诱导的氧化还原反应,在机械柔性固体体系中证明了电场对铁磁性的控制。通过全氟磺酸(PFSA)质子交换膜(PEM)传输的质子通过与晶格氧反应触发CoO的还原,从而在低于10 V的电压下实现顺磁性和铁磁性状态之间的可逆切换。质子供应是由环境湿度和水在铂薄膜反电极上的分裂来维持的。由于其灵活性,器件结构(CoO和Pt薄膜与聚合物pem集成的三明治)在机械弯曲下保持完整的磁离子功能。比较了在不同条件下通过反应溅射合成的三种CoO膜:非晶、结晶和混合相CoO/Co。而非晶膜表现出微弱的响应,晶体和混合相薄膜都表现出明显的电场依赖的磁开关,突出了微观结构在磁离子性能中的关键作用。
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引用次数: 0
Low read/write voltage and high endurance of the ferroelectric memory with Hf0.5Zr0.5O2 film 采用Hf0.5Zr0.5O2薄膜的铁电存储器具有低读写电压和高耐用性
IF 9.4 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-21 DOI: 10.1016/j.jmat.2026.101175
Hongdi Wu, Guodong Zhang, Junfeng Zheng, Xubing Lu, Jun-Ming Liu, Guoliang Yuan
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引用次数: 0
PTCDA/CuS cathode enabling stable sulfide-based all-solid-state batteries PTCDA/ cu阴极实现稳定的硫化物基全固态电池
IF 9.6 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-01 Epub Date: 2025-05-29 DOI: 10.1016/j.jmat.2025.101091
Zhixing Wan , Shuo Wang , Yahao Mu , Ruihua Zhou , Hang Liu , Tingwu Jin , Di Wu , Jianlong Xia , Ce-Wen Nan
Organic cathode materials have garnered significant attention for their potential application in lithium-ion batteries due to their lightweight nature, tunable structures, high energy density, and environmental friendliness. However, the dissolution of organic cathodes in liquid electrolytes often leads to poor cycling stability, which limits their practical application. In this study, a composite cathode was prepared by ball milling the PTCDA/CuS (perylene-3,4,9,10-tetracarboxylic dianhydride, PTCDA) with a sulfide-based electrolyte and carbon nanotubes. By optimizing the component ratios, the assembled all-solid-state batteries (ASSBs) show a high discharge capacity of 210 mA⸱h/g after 200 cycles without any capacity degradation at a current density of 33.0 mA/g. Through comprehensive characterization techniques including X-ray diffraction (XRD), Raman spectroscopy, Fourier-transform infrared spectroscopy (FTIR), and X-ray photoelectron spectroscopy (XPS), the coordination of Cu2+ and the formation of sulfur-linked polymers during the charge-discharge processes are elucidated, and the reversibility of the electrochemical reactions has been confirmed. This work highlights the excellent compatibility between organic cathodes and sulfide-based electrolytes, providing a new way for the development of high-performance ASSBs with high energy density and extended lifespan.
有机正极材料具有重量轻、结构可调、能量密度高、环境友好等优点,在锂离子电池中具有广泛的应用前景。然而,有机阴极在液体电解质中的溶解往往导致循环稳定性差,这限制了它们的实际应用。本研究将PTCDA/CuS(苝-3,4,9,10-四羧酸二酐,PTCDA)与硫化物基电解质和碳纳米管进行球磨制备复合阴极。在33.0 mA/g电流密度下,经过200次循环后,组装的全固态电池(assb)的放电容量达到210 mA⸱h/g,且电池容量没有下降。通过x射线衍射(XRD)、拉曼光谱(Raman)、傅里叶变换红外光谱(FTIR)、x射线光电子能谱(XPS)等综合表征技术,阐明了充放电过程中Cu2+的配位和硫链聚合物的形成,并证实了电化学反应的可逆性。这项工作突出了有机阴极与硫化物基电解质之间的良好相容性,为开发高能量密度和延长寿命的高性能assb提供了新的途径。
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引用次数: 0
Polarization stability in lead-free Na0.5Bi0.5TiO3 ceramics: Grain size and temperature effects 无铅Na0.5Bi0.5TiO3陶瓷的极化稳定性:晶粒尺寸和温度影响
IF 9.6 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-01 Epub Date: 2025-06-23 DOI: 10.1016/j.jmat.2025.101102
Marija Dunce , Vladimir V. Shvartsman , Mahmoud Hotari , Doru C. Lupascu , Eriks Birks , Andrei Kholkin
The stability of the polarization state in Na0.5Bi0.5TiO3 (NBT) ceramics has been a long-standing problem for its use in piezoelectric applications at elevated temperatures. It has been generally believed that the polarization state, depolarization temperature, and depolarization process are all linked to the grain size in these materials. In this work, we perform a thorough Piezoresponse Force Microscopy (PFM) study of the NBT ceramic samples with substantially different grain sizes sintered as a function of temperature. As-grown, macroscopically poled, and locally poled samples were investigated focusing on the polarization behavior at depolarization temperature. Switching Spectroscopy PFM (SS-PFM) measurements were conducted as a function of grain size and temperature. No direct correlation is observed between the grain size and the switching parameters in any sample. However, temperature-dependent measurements reveal significant differences that are explained by different concentrations of oxygen vacancies. We rationalized the observed behavior, e.g. apparent stabilization of the locally probed polarization above the depolarization temperature, by accumulation and depletion of oxygen vacancies in the vicinity of the internal boundary of the poled region. Significant asymmetry of the PFM hysteresis loops at elevated temperatures confirms this assumption.
Na0.5Bi0.5TiO3 (NBT)陶瓷在高温下的极化态稳定性一直是其在压电应用中的一个长期问题。人们普遍认为,这些材料的极化状态、退极化温度和退极化过程都与晶粒尺寸有关。在这项工作中,我们对具有不同晶粒尺寸的NBT陶瓷样品进行了全面的压电响应力显微镜(PFM)研究。研究了长生、宏观极化和局部极化样品在退极化温度下的极化行为。切换光谱(SS)-PFM测量作为晶粒尺寸和温度的函数进行。在任何样品中,没有观察到晶粒尺寸与开关参数之间的直接相关性。然而,温度相关的测量揭示了由不同氧空位浓度解释的显著差异。我们通过在极化区内部边界附近氧空位的积累和耗尽来合理化观察到的行为,例如局部探测极化在退极化温度以上的明显稳定。PFM磁滞回线在高温下的显著不对称性证实了这一假设。
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引用次数: 0
Nanofiller orientation-enhanced electrocaloric effect: A case study of P(VDF-TrFE-CFE)/Ba0.67Sr0.33TiO3 composites 纳米填料取向增强的热效应:以P(VDF-TrFE-CFE)/Ba0.67Sr0.33TiO3复合材料为例
IF 9.6 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-01 Epub Date: 2025-06-26 DOI: 10.1016/j.jmat.2025.101105
Cancan Shao , Xiaoming Shi , Ke Xu , Rongzhen Gao , Shiyu Tang , Zhaobo Liu , Houbing Huang
The exceptional breakdown field strength of polymers, combined with the large spontaneous polarization exhibited by inorganic ferroelectric materials, has led to continuous advancements in the records for the giant electrocaloric effect (ECE) in polymer composites enhanced by ferroelectric inorganic components. This study aims to investigate the ECE properties of P(VDF-TrFE-CFE)/Ba0.67Sr0.33TiO3 (BST67) composites by analyzing the aspect ratio, composition ratio, and orientation of BST67 nanoparticles in conjunction with the P(VDF-TrFE-CFE) matrix. The results of the PE loop calculations indicate that all three factors related to the BST67 nanoparticles enhance the ferroelectric polarization value of the composite material. This enhancement is attributed to the longer aspect ratio, higher composition ratio, and improved orientation, which enable the BST67 nanoparticles to achieve a greater electric field strength. The calculation of ΔT using the LGD method reveals that these three factors of BST67 can independently increase ΔT, and they exhibit a synergistic effect on the ECE performance of the ferroelectric polymer. Our conclusions provide valuable insights for future research on ECE in polymer/inorganic ferroelectric composites.
聚合物特殊的击穿场强,加上无机铁电材料表现出的大自发极化,导致铁电无机组分增强聚合物复合材料的巨电热效应(ECE)记录不断进步。本研究旨在通过分析BST67纳米颗粒与P(VDF-TrFE-CFE)基体的长宽比、组成比和取向,研究P(VDF-TrFE-CFE)/Ba0.67Sr0.33TiO3 (BST67)复合材料的ECE性能。P-E环计算结果表明,与BST67纳米颗粒相关的三个因素均增强了复合材料的铁电极化值。这种增强归功于更长的长宽比、更高的组成比和改进的取向,这使得BST67纳米颗粒能够获得更大的电场强度。利用LGD法计算ΔT可知,BST67的这三个因素可以独立增加ΔT,它们对铁电聚合物的ECE性能表现出协同效应。我们的结论为今后聚合物/无机铁电复合材料中ECE的研究提供了有价值的见解。
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引用次数: 0
Machine learning assisted τf value prediction of ABO3-type microwave dielectric ceramics 机器学习辅助abo3型微波介质陶瓷的τf值预测
IF 9.6 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-01 Epub Date: 2025-08-08 DOI: 10.1016/j.jmat.2025.101117
Mingyue Yang , Liangyu Mo , Jincheng Qin , Faqiang Zhang , Mingsheng Ma , Yongxiang Li , Zhifu Liu
The temperature coefficient of resonance frequency (τf or TCF) is the key parameter for evaluating temperature stability of microwave dielectric ceramics. In this work, a machine learning framework was proposed to predict the τf values of ABO3-type microwave dielectric ceramics. Leveraging a curated dataset of 104 single-phase ABO3-type compounds, we systematically evaluated models based on five machine learning algorithms using 31 structural descriptors as input features. The eXtreme Gradient Boosting (XGB) algorithm emerged as the optimal predictive model, demonstrating robust performance on the test set (R2 = 0.7799, RMSE = 15.7494 × 10−6 °C−1). Consistent results on the validation set further confirmed its generalization capability. Critical features contributing to the model's performance include molecular dielectric polarizability (pm), tolerance factor (tt), ionic volume (Vi) and relative molecular mass (m). Structure-property relationship studies revealed that the pm plays an important role in modulating the τf value by affecting the permittivity. Quantitative thresholds for these critical descriptors were also derived for identifying materials with near-zero τf. This work provides an effective data-driven approach for accelerating the discovery of microwave dielectric ceramics with good temperature stability.
谐振频率温度系数τ (TCF)是评价微波介质陶瓷温度稳定性的关键参数。本文提出了一种预测abo3型微波介质陶瓷τf值的机器学习框架。利用104个单相abo3型化合物的精心整理的数据集,我们系统地评估了基于五种机器学习算法的模型,使用31个结构描述符作为输入特征。极端梯度增强(eXtreme Gradient Boosting, XGB)算法成为最优预测模型,在测试集上表现出鲁棒性(R2 = 0.7799, RMSE = 15.7494×10-6°C-1)。验证集上的一致结果进一步证实了其泛化能力。影响模型性能的关键特征包括分子介电极化率(pm)、容差系数(tt)、离子体积(Vi)和相对分子质量(m)。结构-性质关系研究表明,质点通过影响介电常数对τf值的调节起着重要作用。这些临界描述符的定量阈值也被导出,用于识别τf接近于零的材料。这项工作为加速发现具有良好温度稳定性的微波介质陶瓷提供了有效的数据驱动方法。
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引用次数: 0
Biomimetic multi-layered protective materials with prestress and a periodic laminated structure 具有预应力和周期性层合结构的仿生多层防护材料
IF 9.6 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-01 Epub Date: 2025-06-04 DOI: 10.1016/j.jmat.2025.101095
Xin Liu , Fan Zhang , Ji Zou , Weimin Wang , Wei Ji , Zhengyi Fu
The nacreous layer of shells has become an excellent biomimetic template of materials due to its unique structure. Inspired by the highly complex multilayered structure of shells, biomimetic layered composite protective materials with outstanding strength, toughness, and impact resistance have been developed. As the hard phase in biomimetic pearlescent layered protective materials, ceramics suffer from inherent low toughness. Applying prestress proved to be an efficient method to enhance their toughness and impact resistance. In this study, prestressed biomimetic periodic laminated (TiB2TiB)/Ti protective materials were fabricated with spark plasma sintering (SPS) technology under the conditions of 1450 °C and 30 MPa in an argon atmosphere. Moreover, both experimental and numerical simulation analyses were conducted to investigate their protective performance. Compared to non-prestressed protective materials, the prestressed constrained materials exhibited the significantly improved protective performance with reduced penetration depth, substantially lower residual velocity, and kinetic energy after impact. This study provided valuable insights into the structural design and performance optimization of other protective materials.
珠光壳层以其独特的结构成为一种优良的仿生模板材料。受贝壳高度复杂的多层结构的启发,开发出具有优异强度、韧性和抗冲击性能的仿生层状复合防护材料。陶瓷作为仿生珠光层状防护材料中的硬相,具有固有的低韧性。预应力是提高其韧性和抗冲击性能的有效方法。在1450℃、30 MPa的氩气环境下,采用放电等离子烧结(SPS)技术制备了预应力仿生周期性层压(TiB2-TiB)/Ti保护材料。并对其防护性能进行了实验和数值模拟分析。与非预应力保护材料相比,预应力约束材料的保护性能显著提高,侵彻深度减小,冲击后残余速度和动能显著降低。该研究为其他防护材料的结构设计和性能优化提供了有价值的见解。
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引用次数: 0
Rattling effect mechanism on the temperature stability of low-sintered Ca1–x(Li1/2Eu1/2)xWO4 microwave dielectric ceramics for dielectric resonant antenna applications 低烧结Ca1-x (Li1/2Eu1/2)xWO4微波介质陶瓷用于介质谐振天线的温度稳定性的嘎嘎效应机理
IF 9.6 1区 材料科学 Q1 CHEMISTRY, PHYSICAL Pub Date : 2026-01-01 Epub Date: 2025-06-04 DOI: 10.1016/j.jmat.2025.101094
Qingfeng Li , Jie Li , Ying Tang , Huaicheng Xiang , Di Zhou , Kaixin Song , Liang Fang
The low dielectric constant (εr < 15) is the key to improving the signal transmission speed of microwave communication devices. However, the resonant frequency temperature coefficient (τf) of most low-εr microwave dielectric ceramics is usually negative. Aiming to modify the large negative τf of scheelite CaWO4 and explore the underlying mechanism between the structure and microwave dielectric properties, a series of Ca1–x(Li1/2Eu1/2)xWO4 (x = 0.1−1.0) (CLEWOx) ceramics were prepared at low sintering temperatures (750−875 °C). The εr increased from 10.46 to 18.55, and the Q× f decreased from 39,032 GHz–7425 GHz, mainly due to the enhanced rattling effect of Li+. The τf rapidly increased from negative (−19.91 × 10−6 °C−1) to abnormally positive (+162.15 × 10−6 °C−1), influenced by the reduced temperature coefficient of ion polarizability (ταm) caused by the rattling Li + cation. The CLEWO0.15 sample has good comprehensive performance (εr = 12.28, Q×f = 28,027 GHz, and τf = −0.5 × 10−6 °C−1) and compatibility with the Ag electrode, showing the potential of LTCC applications. Additionally, a dielectric resonator antenna based on CLEWO0.15 ceramic was designed with a bandwidth of 254 MHz at 4.504−4.758 GHz and a gain of 4.87 dBi at 4.62 GHz, indicating that CLEWO0.15 may be a potential candidate for dielectric resonator antennas.
低介电常数(εr <;15)是提高微波通信设备信号传输速度的关键。然而,大多数低εr微波介质陶瓷的谐振频率温度系数τf通常为负。为了修正白钨矿CaWO4的大负τf,探讨其结构与微波介电性能之间的潜在机制,在低温(750 ~ 875℃)下制备了一系列Ca1-x (Li1/2Eu1/2)xWO4 (x = 0.1 ~ 1.0) (CLEWOx)陶瓷。εr从10.46增加到18.55,qx f从39,032 GHz降低到7425 GHz,这主要是由于Li+的咔嗒效应增强所致。由于Li+阳离子的咔咔性降低了离子极化温度系数ταm,使得τf由负(-19.91×10−6°C−1)迅速增大到异常正(+162.15×10−6°C−1)。CLEWO0.15样品具有良好的综合性能(εr = 12.28, Q×f = 28,027 GHz, τf = -0.5×10−6°C−1)和与Ag电极的相容性,具有LTCC应用潜力。此外,设计了基于CLEWO0.15陶瓷的介质谐振器天线,在4.504 ~ 4.758 GHz频段带宽为254 MHz,在4.62 GHz频段增益为4.87 dBi,表明CLEWO0.15可能是介质谐振器天线的潜在候选者。
{"title":"Rattling effect mechanism on the temperature stability of low-sintered Ca1–x(Li1/2Eu1/2)xWO4 microwave dielectric ceramics for dielectric resonant antenna applications","authors":"Qingfeng Li ,&nbsp;Jie Li ,&nbsp;Ying Tang ,&nbsp;Huaicheng Xiang ,&nbsp;Di Zhou ,&nbsp;Kaixin Song ,&nbsp;Liang Fang","doi":"10.1016/j.jmat.2025.101094","DOIUrl":"10.1016/j.jmat.2025.101094","url":null,"abstract":"<div><div>The low dielectric constant (<em>ε</em><sub>r</sub> &lt; 15) is the key to improving the signal transmission speed of microwave communication devices. However, the resonant frequency temperature coefficient (<em>τ</em><sub>f</sub>) of most low-<em>ε</em><sub>r</sub> microwave dielectric ceramics is usually negative. Aiming to modify the large negative <em>τ</em><sub>f</sub> of scheelite CaWO<sub>4</sub> and explore the underlying mechanism between the structure and microwave dielectric properties, a series of Ca<sub>1–<em>x</em></sub>(Li<sub>1/2</sub>Eu<sub>1/2</sub>)<sub><em>x</em></sub>WO<sub>4</sub> (<em>x</em> = 0.1−1.0) (CLEWO<sub><em>x</em></sub>) ceramics were prepared at low sintering temperatures (750−875 °C). The <em>ε</em><sub>r</sub> increased from 10.46 to 18.55, and the <em>Q</em>× <em>f</em> decreased from 39,032 GHz–7425 GHz, mainly due to the enhanced rattling effect of Li<sup>+</sup>. The <em>τ</em><sub>f</sub> rapidly increased from negative (−19.91 × 10<sup>−6</sup> °C<sup>−1</sup>) to abnormally positive (+162.15 × 10<sup>−6</sup> °C<sup>−1</sup>), influenced by the reduced temperature coefficient of ion polarizability (<em>τ</em><sub>αm</sub>) caused by the rattling Li <sup>+</sup> cation. The CLEWO<sub>0.15</sub> sample has good comprehensive performance (<em>ε</em><sub>r</sub> = 12.28, <em>Q×f</em> = 28,027 GHz, and <em>τ</em><sub>f</sub> = −0.5 × 10<sup>−6</sup> °C<sup>−1</sup>) and compatibility with the Ag electrode, showing the potential of LTCC applications. Additionally, a dielectric resonator antenna based on CLEWO<sub>0.15</sub> ceramic was designed with a bandwidth of 254 MHz at 4.504−4.758 GHz and a gain of 4.87 dBi at 4.62 GHz, indicating that CLEWO<sub>0.15</sub> may be a potential candidate for dielectric resonator antennas.</div></div>","PeriodicalId":16173,"journal":{"name":"Journal of Materiomics","volume":"12 1","pages":"Article 101094"},"PeriodicalIF":9.6,"publicationDate":"2026-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144218690","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"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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Journal of Materiomics
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