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Wireless Self-Powered Triboelectric-Based Sensor for Real-Time Quantitative Monitoring of Gas-Liquid Mixed Flow. 用于气液混合流实时定量监测的无线自供电摩擦电传感器。
IF 12.1 2区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1002/smll.202511922
Yang Dong, Nannan Wang, Zhichen Cao, Yu Ke, Jiahui Cheng, Suping Chang, Zhong Lin Wang, YongAn Huang, Wenlong Lu

Wireless flow sensing technologies have attracted significant interest for enabling safe operation and performance optimization in gas-liquid two-phase flow systems. Nevertheless, the real-time quantitative monitoring of liquid flow rates without phase separation remains a considerable challenge. In this work, we present a wireless, self-powered, and real-time quantitative liquid flow measurement system utilizing a gas-liquid electricity generator (GLEG) based on the triboelectric effect. The GLEG features a dual-electrode configuration consisting of an external ring electrode and an internal porous electrode, which efficiently harvests mechanical energy from high-speed continuous gas-liquid mixed flow and converts it into usable electrical power. By integrating a sensor circuit board with a power regulation module, a microcontroller unit, and wireless transmission components, we demonstrate a fully self-sustained sensing system capable of real-time quantitative monitoring in gas-liquid mixed flow environments. Under continuous flow conditions with an air pressure of 0.6 MPa and flow speed of 30 m/s, the system achieves real-time measurement of liquid flow rates in the range of 0-90 mL/min with an accuracy of 95%. This triboelectric nanogenerator-based wireless sensing platform offers a promising approach for in situ parameter analysis and measurement in multiphase flow systems.

无线流量传感技术在实现气液两相流系统的安全运行和性能优化方面引起了人们的极大兴趣。然而,无相分离的液体流量实时定量监测仍然是一个相当大的挑战。在这项工作中,我们提出了一种无线、自供电、实时定量液体流量测量系统,该系统利用基于摩擦电效应的气液发电机(GLEG)。GLEG采用由外环电极和内多孔电极组成的双电极结构,有效地从高速连续气液混合流动中收集机械能,并将其转化为可用的电能。通过将传感器电路板与功率调节模块、微控制器单元和无线传输组件集成在一起,我们展示了一个完全自维持的传感系统,能够在气液混合流环境中进行实时定量监测。在气压为0.6 MPa、流速为30 m/s的连续流动条件下,系统可实现0 ~ 90 mL/min范围内液体流量的实时测量,准确度为95%。这种基于摩擦电纳米发电机的无线传感平台为多相流系统的原位参数分析和测量提供了一种有前途的方法。
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引用次数: 0
Self-Assembled Carrier-Free Nanomedicines Potentiate Chemo-Photothermal Immunotherapy by Overcoming Prostaglandin E2-Mediated Immunosuppression 自组装无载体纳米药物通过克服前列腺素e2介导的免疫抑制来增强化学光热免疫治疗
IF 13.3 2区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1002/smll.202512540
Xiaoliang Deng, Lina Wu, Boxin Chen, Xiaohui Tang, Shiying Xu, Yinxing Huang, Fan Pan, Jun Lu, Xianquan Feng
Inflammation plays a pivotal role in fostering an immunosuppressive tumor microenvironment, which diminishes tumor immunogenic cell death (ICD) and subsequently promotes tumor recurrence and metastasis. The COX-2/PGE2 signaling axis has been identified as a crucial regulator in the establishment of immunosuppressive conditions. Herein, this work developed an excipient-free nanomedicine (IPC NPs) via non-covalent self-assembly, integrating indocyanine green and paclitaxel (dual ICD inducers) with celecoxib (COX-2/PGE2 inhibitor) for combined chemo-photothermal therapy with anti-inflammatory effects. The IPC NPs displayed monodisperse characteristics with optimal near-infrared responsiveness, significantly enhancing tumor tissue permeation while demonstrating synergistic chemo-photothermal cytotoxicity against triple-negative breast cancer (TNBC). Notably, IPC NPs-encapsulated celecoxib effectively remodeled the tumor inflammatory microenvironment by attenuating therapy-induced inflammatory responses, thereby potentiating ICD. This triple therapy regimen promoted dendritic cell maturation, enhanced cytotoxic T lymphocyte infiltration into tumor tissues, and upregulated effector memory T cell populations in TNBC. These immunomodulatory effects substantially ameliorated the immunosuppressive tumor microenvironment, leading to significant inhibition of primary tumor growth and metastasis. Collectively, this work presents a novel carrier-free nanotherapeutic strategy that synergistically combines chemo-photothermal-inflammatory suppression therapy, offering a promising approach for TNBC.
炎症在培养免疫抑制肿瘤微环境中起关键作用,从而减少肿瘤免疫原性细胞死亡(ICD),并随后促进肿瘤复发和转移。COX-2/PGE2信号轴已被确定为建立免疫抑制条件的关键调节因子。本研究通过非共价自组装开发了一种无赋形剂纳米药物(IPC NPs),将吲哚青绿和紫杉醇(双ICD诱导剂)与塞来昔布(COX-2/PGE2抑制剂)结合,用于具有抗炎作用的化学光热联合治疗。IPC NPs表现出单分散特性,具有最佳的近红外响应性,显著增强肿瘤组织渗透,同时显示出对三阴性乳腺癌(TNBC)的协同化学-光热细胞毒性。值得注意的是,IPC nps包封的塞来昔布通过减弱治疗诱导的炎症反应,有效地重塑了肿瘤炎症微环境,从而增强了ICD。这种三联治疗方案促进了树突状细胞的成熟,增强了细胞毒性T淋巴细胞向肿瘤组织的浸润,并上调了TNBC中的效应记忆T细胞群。这些免疫调节作用大大改善了免疫抑制的肿瘤微环境,从而显著抑制原发肿瘤的生长和转移。总的来说,这项工作提出了一种新的无载体纳米治疗策略,该策略协同结合了化学-光热-炎症抑制治疗,为TNBC提供了一种有希望的方法。
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引用次数: 0
Selenium oxide nanostructure-based electrodes for rapid and simultaneous electrochemical determination of oxalic and ascorbic acids in food matrices 用于食品基质中草酸和抗坏血酸快速同时电化学测定的氧化硒纳米结构电极
IF 6.7 3区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1039/d5nr04332h
Rania M. Needa, Hosny Ibrahim, Ahmed F. A. Youssef, Rabeay Y. A. Hassan
The development of nanostructured electrochemical platforms for rapid and selective sensing of coexisting biomolecules remains a key challenge in food analysis. Herein, selenium oxide nanostructures (SeO2NSs) were synthesized and integrated into carbon-based electrodes to enable the simultaneous electrochemical detection of ascorbic acid (AA) and oxalic acid (OA) in complex food matrices. Comprehensive morphological, structural, and electrochemical characterization studies confirmed the uniform distribution, high surface area, and excellent redox activity of the SeO2NSs. Under optimized chronoamperometric conditions, the SeO2NS-modified electrode exhibited wide linear response ranges of 5.0–550 µM for OA and 5.0–455 µM for AA, with low detection limits of 0.50 µM and 0.43 µM, respectively. The sensor demonstrated remarkable selectivity and stability against common interfering species, ensuring accurate quantification in real samples. Thus, the developed platform was successfully applied to the simultaneous determination of AA and OA in fresh fruits and vegetables (guava, spinach, and mango) and in beverages derived from coffee beans and tea leaves. This work highlights the potential of selenium oxide nanostructures as efficient electroactive materials for high-performance, cost-effective, and reliable electrochemical sensing in food-quality monitoring and safety assessment.
开发纳米结构电化学平台,快速和选择性地检测共存的生物分子,仍然是食品分析中的一个关键挑战。本文合成了氧化硒纳米结构(SeO2NSs)并将其集成到碳基电极中,以实现复杂食品基质中抗坏血酸(AA)和草酸(OA)的同时电化学检测。全面的形态、结构和电化学表征研究证实了SeO2NSs的均匀分布、高表面积和优异的氧化还原活性。在优化的时间电流条件下,seo2ns修饰电极对OA的线性响应范围为5.0 ~ 550µM,对AA的线性响应范围为5.0 ~ 455µM,检出限分别为0.50µM和0.43µM。该传感器对常见干扰物质表现出显著的选择性和稳定性,确保了实际样品的准确定量。因此,所建立的平台成功地应用于新鲜果蔬(番石榴、菠菜、芒果)和咖啡豆、茶叶饮料中AA和OA的同时测定。这项工作强调了氧化硒纳米结构作为高效电活性材料的潜力,在食品质量监测和安全评估中具有高性能、低成本和可靠的电化学传感。
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引用次数: 0
Engineering Liquid Metal Nanoparticles for Wearable Devices 工程液态金属纳米颗粒可穿戴设备
IF 17.1 1区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1021/acsnano.5c18099
Yuxuan Chen, Zhiheng Zhang, Shan He, Guozhen Liu
Liquid metals (LMs) are emerging as highly promising materials for wearable devices owing to their exceptional properties, such as high electrical and thermal conductivity, biocompatibility, flexibility, and unique surface characteristics. Through surface engineering with ligands, polymers, and nanomaterials, LMs can be processed into stable bioinks with enhanced oxidation resistance, adhesion, and multifunctionality. These bioinks are further integrated into microneedle and patch-based wearables via fabrication strategies, including photolithography, micromolding, 3D printing, screen and inkjet printing, and direct writing. Such integration enables diverse biomedical applications, ranging from physiological signal monitoring and sweat or temperature sensing to wound healing, antibacterial therapy, and controlled drug delivery. Despite these advances, challenges remain in application maturity, long-term stability, biocompatibility, and scalable manufacturing. Accordingly, this review summarizes these challenges and outlines future directions for LM-based wearable biomedical devices.
液态金属(LMs)由于其优异的性能,如高导电性和导热性、生物相容性、柔韧性和独特的表面特性,正在成为可穿戴设备的极具前景的材料。通过配体、聚合物和纳米材料的表面工程,LMs可以被加工成稳定的生物墨水,具有增强的抗氧化性、附着力和多功能性。这些生物墨水通过光刻、微成型、3D打印、丝网和喷墨打印以及直接书写等制造策略,进一步集成到微针和贴片式可穿戴设备中。这样的集成使多种生物医学应用成为可能,从生理信号监测、汗液或温度传感到伤口愈合、抗菌治疗和控制药物输送。尽管取得了这些进步,但在应用成熟度、长期稳定性、生物相容性和可扩展制造方面仍然存在挑战。因此,本文总结了这些挑战,并概述了基于lm的可穿戴生物医学设备的未来发展方向。
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引用次数: 0
Proton Provision-Conversion-Spillover Cascade Programming on Dual Supported Pt Atoms for Robust Hydrogen Production 双支撑Pt原子上的质子供给-转换-溢出级联规划
IF 29.4 1区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1002/adma.202522479
Mansheng Liao, Yuan Zhang, Qianyi Lin, Kaiming Liang, Yayun Hong, Lei Zhang
Rational proton engineering offers a powerful strategy for enhancing the hydrogen evolution reaction (HER) performance of single-atom catalysts (SACs). Notably, achieving concerted proton management across multiple reaction steps presents a highly efficient approach, yet it remains more challenging to implement than single-step regulation. Here, we propose a domino-type proton provision-conversion-spillover programming for Pt SACs in acidic HER, enabled by ultrathin porous nitrogen-doped carbon (main 1–2 atomic layers, sub-1 nm) encapsulated TiN nanowires with tips as dual-support tip-platform (Pt-NC1@TiN NWs). Experimental and theoretical results demonstrate that this platform triggers tip-distance-spillover domino effects to drive a proton cascade throughout HER. Specifically, NC1@TiN nanotips induce tip-enhanced effect that promotes interfacial proton accessibility. Concurrently, the short-distance Pt/TiN vertical coupling optimizes electronic modulation of unsaturated Pt-N2 sites to enhance their intrinsic activity. Exposed TiN sites function as hydrogen spillover centers to facilitate H2 desorption. Consequently, Pt-NC1@TiN NWs achieve a superior Pt mass activity of 153.5 A/mgPt@-100 mV, surpassing Pt/C by two orders of magnitude. Notably, it reaches 2 A/cm2 at low cell voltage of 1.75 V and sustains stable operation at 1 A/cm2 for 1200 h in proton exchange membrane water electrolyzer (PEMWE). This work indicates the potential of harnessing multi-step domino processes for advanced catalyst design.
合理的质子工程为提高单原子催化剂的析氢反应性能提供了有力的策略。值得注意的是,实现跨多个反应步骤的协调质子管理是一种高效的方法,但实施起来仍然比单步调节更具挑战性。在这里,我们提出了一个多米诺骨式质子供应-转换-溢出编程,用于酸性HER中的Pt SACs,通过超薄多孔氮掺杂碳(主要1-2原子层,sub- 1nm)封装TiN纳米线,尖端作为双支撑尖端平台(Pt-NC1@TiN NWs)实现。实验和理论结果表明,该平台触发尖端距离溢出多米诺骨牌效应,驱动质子级联贯穿HER。具体来说,NC1@TiN纳米尖端诱导了尖端增强效应,促进了界面质子的可及性。同时,短距离Pt/TiN垂直耦合优化了不饱和Pt- n2位点的电子调制,增强了其固有活性。暴露的TiN位点作为氢溢出中心,促进H2的解吸。因此,Pt-NC1@TiN NWs的Pt质量活度达到153.5 a /mgPt@-100 mV,比Pt/C高出两个数量级。值得注意的是,它在1.75 V的低电池电压下达到2 A/cm2,并在质子交换膜水电解槽(PEMWE)中以1 A/cm2稳定运行1200小时。这项工作表明利用多步骤多米诺过程进行先进催化剂设计的潜力。
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引用次数: 0
Bioinspired Engineered Virus-Mimetic Vesicles for Enhanced Cytosolic Delivery of STING Agonists Into Dendritic Cells 生物启发工程病毒模拟囊泡增强STING激动剂进入树突状细胞的胞浆输送
IF 29.4 1区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1002/adma.202520019
Shi-Zhen Geng, Yaru Shi, Jinjin Yang, Yiwen Gao, Zhehao Zhang, Hao Wu, Pan-Miao Liu, Jinjin Shi, Yiling Yang, Jian-Jun Yang
Effective delivery to dendritic cells (DCs) is crucial for the clinical translation of STING agonists, however, current cyclic dinucleotide (CDN) therapies are hindered by inefficient cytosolic delivery and off-target activation-induced T cell exhaustion. Here, a high-fidelity, dengue virus-mimetic platform (CDN@VLP) is engineered to leverage natural tropism for precise cytosolic release in immature DCs. Compared to conventional lipid nanoparticles, CDN@VLP enhances DC-specific uptake by 1.9-fold while reducing non-specific T cell internalization in tumors by 14.8-fold, achieving comparable antitumor efficacy at one-fortieth the dose of free CDN. Systematic screening identifies an optimal VLP subtype that improves targeted accumulation in type 1 conventional DCs (cDC1s)—a subset essential for STING pathway activation—by 2.3-fold and amplifies durable type I interferon responses, resulting in a 12.8-fold increase in IFN-β production. Transcriptomic analysis further reveals that CDN@VLP promotes cDC1 recruitment into tumors by enhancing the secretion of key chemokines (XCL1, CCL4, and CCL5), suggesting an additional mechanism of action. By mimicking viral tropism, the CDN@VLP platform establishes a paradigm for precision STING activation, overcoming the trade-off between potency and specificity in cDC1-targeted immunotherapy.
有效递送到树突状细胞(dc)对于STING激动剂的临床翻译至关重要,然而,目前的环二核苷酸(CDN)治疗受到低效的细胞质递送和脱靶激活诱导的T细胞衰竭的阻碍。在这里,一个高保真度的登革热病毒模拟平台(CDN@VLP)被设计为利用自然趋向性在未成熟的树突状细胞中精确释放细胞质。与传统的脂质纳米颗粒相比,CDN@VLP将dc特异性摄取提高了1.9倍,同时将肿瘤中的非特异性T细胞内化降低了14.8倍,在游离CDN剂量的十分之一下达到相当的抗肿瘤效果。系统筛选确定了一种最佳的VLP亚型,该亚型可将1型常规dc (cDC1s) (STING通路激活所必需的子集)的靶向积累提高2.3倍,并放大持久的I型干扰素反应,从而使IFN-β的产生增加12.8倍。转录组学分析进一步揭示CDN@VLP通过增强关键趋化因子(XCL1、CCL4和CCL5)的分泌来促进cDC1向肿瘤募集,提示了另一种作用机制。通过模仿病毒的趋向性,CDN@VLP平台建立了精确STING激活的范例,克服了cdc1靶向免疫治疗中效力和特异性之间的权衡。
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引用次数: 0
Engineered Strain in 2D Materials by Direct Growth on Deterministically Patterned Grayscale Topographies. 在确定图纹灰度拓扑上直接生长二维材料的工程应变。
IF 14.1 1区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1002/advs.202522850
Berke Erbas, Arindam Bala, Hernan Furci, Anushree Dutta, Naresh Kumar, Renato Zenobi, Giovanni Boero, Andras Kis, Juergen Brugger

Strain is a proven technique for modifying the bandgap and enhancing carrier mobility in 2D materials. Most current strain engineering techniques rely on the post-growth transfer of these atomically thin materials from growth substrates to target surfaces, limiting their integration into nanoelectronics. Here, we present a new approach where strain in 2D materials is already introduced directly during their growth on grayscale-patterned topographies instead of flat surfaces. Both strain levels and orientations are deterministically engineered by controlling grayscale surface contour lengths through thermal expansion mismatches in nanostructured stacks, where the conformally grown and firmly attached 2D material is forced to match the underlying morphology change during cooling. With this method, we experimentally demonstrate precise control of localized tensile strain from 0 to 0.5% in grown MoS2 monolayer along both uni- and multiaxial directions, while higher strain levels are shown to be theoretically possible. This strain-engineered growth of 2D material films directly on the target substrates is a generic and adaptable approach to various combinations of grayscale-thin-film/substrates and eliminates all the transfer-related limitations of previous approaches, thus paving the way for integrating strained 2D materials into next-generation nanoelectronics.

应变是一种成熟的技术,用于改变带隙和提高二维材料中的载流子迁移率。目前大多数应变工程技术依赖于这些原子薄材料从生长基板到目标表面的生长后转移,限制了它们与纳米电子学的集成。在这里,我们提出了一种新的方法,在二维材料中,应变已经在灰度图形的地形上而不是平面上直接引入。在纳米结构堆中,通过热膨胀失配来控制灰度表面轮廓长度,从而确定应变水平和方向。在纳米结构堆中,共形生长和牢固附着的二维材料在冷却过程中被迫匹配底层形态变化。用这种方法,我们实验证明了在单轴和多轴方向上,生长的二硫化钼单层的局部拉伸应变从0到0.5%的精确控制,而更高的应变水平在理论上是可能的。这种直接在目标衬底上应变工程生长的2D材料薄膜是一种通用的、适应性强的方法,适用于各种灰度薄膜/衬底的组合,消除了以前方法的所有转移相关限制,从而为将应变2D材料集成到下一代纳米电子学中铺平了道路。
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引用次数: 0
Mechanism of Solid Solution-Driven Texture Induced by Ag Doping in YBCO Superconductor. Ag在YBCO超导体中诱发固溶驱动织构的机理。
IF 14.1 1区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1002/advs.202522923
Fenyan Zhao, Baoqiang Zhang, Xiyang Su, Yantang Zhao, Xingyi Zhang

Since the discovery of YBa2Cu3O7-δ (YBCO or Y123), enhancing its superconducting and mechanical properties has been a major focus. Ag doping is a promising strategy for bulk materials, but its mechanism remains debated, particularly regarding whether Ag segregates at grain boundaries or enters the lattice. The origin of the enhancement remains unclear, as conventional powder-doping methods hinder gradient formation and obscure key effects at specific doping levels. Here, we propose a dual-material co-extrusion and freeze-drying strategy to construct a macroscopic Ag-YBCO interface, where directional pores in YBCO enable Ag diffusion and compositional gradient formation at high temperatures. Experiments reveal a [001]-oriented YBa2Cu3-xAgxO7-δ solid solution with coherent interfaces with Y123, which transmit crystallographic orientation at the atomic scale and promote orientated Y123 growth. First-principles calculations reveal that Ag substitution-induced lattice relaxation plays a key role in driving texture formation. As a result, the composite exhibits a significantly enhanced critical current density (Jc) while maintaining a stable critical temperature (Tc), accompanied by a transition in the fracture behavior from intergranular to transgranular fracture. This work reveals the mechanism of solid solution-driven texture induced by Ag doping in YBCO, providing new insights into dopant-mediated texture evolution in REBCO (Re = rare earth) superconductors.

自发现YBa2Cu3O7-δ (YBCO或Y123)以来,提高其超导性能和力学性能一直是研究的重点。银掺杂是块状材料的一种很有前途的策略,但其机制仍然存在争议,特别是关于银是否在晶界或进入晶格。增强的来源仍然不清楚,因为传统的粉末掺杂方法阻碍了梯度的形成,并且模糊了特定掺杂水平下的关键效应。本文提出了双材料共挤压和冷冻干燥的策略来构建Ag-YBCO宏观界面,其中YBCO中的定向孔使Ag在高温下扩散和成分梯度形成。实验发现YBa2Cu3-xAgxO7-δ固溶体与Y123具有[001]取向,在原子尺度上传递晶体取向,促进Y123取向生长。第一性原理计算表明,银取代引起的晶格弛豫在驱动织构形成中起关键作用。结果表明,复合材料在保持稳定临界温度(Tc)的同时,临界电流密度(Jc)显著增强,断裂行为由晶间断裂向穿晶断裂转变。本研究揭示了Ag掺杂在YBCO中诱导固溶驱动织构的机理,为REBCO (Re =稀土)超导体中掺杂介导的织构演化提供了新的见解。
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引用次数: 0
First-principles study on effective hydrogen adsorption and gas sensing on WSe2 surface by Pt modification and GaN heterojunction construction Pt修饰和GaN异质结构建对WSe2表面有效氢吸附和气敏的第一性原理研究
IF 6.7 2区 材料科学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-02-10 DOI: 10.1016/j.apsusc.2026.166288
Li Ye, Yongchao Liang, Wenqiang Li, Qian Chen, Jian Xiong
Achieving effective adsorption and sensing of H2 has become one of the most challenging and difficult tasks for maintaining a sustainable environment. The first-principles density functional theory was used for exploring the adsorption and sensing properties of H2, CO, HCN, CH4, and NH3 gas molecules on the Pt-WSe2 and GaN/WSe2 structures. By conducting calculations, the most stable adsorption configuration was identified. To begin with, the adsorption properties indicated that all gas molecules were physically adsorbed onto the WSe2 substrate. Furthermore, the Pt atoms were stably anchored at the S(H) site on the surface of WSe2, resulted in an increase of 0.33 eV in the adsorption energy for H2. The density of states further confirms that this modification alters the electronic properties of WSe2, thereby enhancing its adsorption performance. Finally, the GW surface in the WSe2/GaN heterostructure significantly enhanced the adsorption energy of H2 to −2.048 eV and improved the adsorption performance for CO, HCN, CH4, and NH3 molecules. Recovery times at room temperature were calculated for multiple configurations, predicting ultra-high selectivity and favorable recovery times for Pt-WSe2 toward all four gases except CH4. The adsorption mechanism is controlled by the changes in conductivity caused by charge transfer. These theoretical studies provide the theoretical basis for the practical application of monolayer WSe2 in hydrogen sensing and gas adsorption.
实现氢气的有效吸附和传感已成为维持可持续环境的最具挑战性和最困难的任务之一。利用第一性原理密度泛函理论研究了Pt-WSe2和GaN/WSe2结构对H2、CO、HCN、CH4和NH3气体分子的吸附和传感性能。通过计算,确定了最稳定的吸附构型。首先,吸附性质表明所有气体分子都被物理吸附到WSe2底物上。Pt原子稳定锚定在WSe2表面的S(H)位点,使WSe2对H2的吸附能提高了0.33 eV。态密度进一步证实了这种修饰改变了WSe2的电子性质,从而提高了其吸附性能。最后,WSe2/GaN异质结构中的GW表面显著提高了H2的吸附能至−2.048 eV,提高了对CO、HCN、CH4和NH3分子的吸附性能。计算了多种构型在室温下的回收时间,预测了Pt-WSe2对除CH4外的所有四种气体的超高选择性和有利的回收时间。吸附机理受电荷转移引起的电导率变化控制。这些理论研究为单层WSe2在氢气传感和气体吸附方面的实际应用提供了理论基础。
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引用次数: 0
Ligand-Free MgCO3 Nanoclusters Catalyze Nucleophilic Alcohol Addition Reactions 无配体MgCO3纳米团簇催化亲核醇加成反应
IF 9.5 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-02-10 DOI: 10.1021/acsami.5c21329
Lluís Martínez-Belenguer, Kateřina Zítová, Jose Pedro Cerón-Carrasco, Belén Lerma-Berlanga, Antonio Leyva-Pérez
Subnano and nanometric metal clusters are ultrasmall aggregates in which most atoms are exposed on the surface, directly interacting with reactants and enabling highly efficient catalysis. However, metal carbonate clusters have been barely prepared and used in catalysis. Here, we report the synthesis of ultrasmall, ligand-free MgCO3 clusters formed via CO2 capture with MgCl2, with an average composition of [MgCO3]5·3H2O. These clusters exhibit catalytic activity in various nucleophilic alcohol addition reactions, showing a 5-fold enhancement compared to bulk MgCO3 and CaCO3–triethylamine clusters. These results pave the way for synthesis of ultrasmall alkaline metal carbonate clusters beyond Ca, which can be employed as efficient catalysts in organic synthesis.
亚纳米和纳米金属簇是一种超小的聚集体,其中大多数原子暴露在表面,直接与反应物相互作用,实现高效催化。然而,金属碳酸盐簇很少被制备并用于催化。在这里,我们报道了用MgCl2捕获CO2形成的超小的,无配体的MgCO3簇的合成,其平均组成为[MgCO3]5·3H2O。这些团簇在各种亲核醇加成反应中表现出催化活性,与散装MgCO3和caco3 -三乙胺团簇相比,表现出5倍的增强。这些结果为超小碱性金属碳酸盐簇的合成铺平了道路,该簇可作为有机合成中的高效催化剂。
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引用次数: 0
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