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Design and characterization of 3D printed gradient scaffolds with spatial distribution of pore sizes

Ceramics International 2025年第9期51卷 12185-12196页

作者： Ye, Fan Yang, He Hong, Chuhang Wu, Xiaopei Dai, Honglian State Key Laboratory of Advanced Technology for Materials Synthesis and Processing Wuhan University of Technology Wuhan430070 China National Energy Key Laboratory for New Hydrogen-ammonia Energy Technologies Foshan Xianhu Laboratory Foshan528200 China

In bone repair, scaffold structural design is essential for optimizing mechanical performance and osteogenic potential. Gradient structural scaffolds are engineered to balance mechanical qualities and permeability which can improve the material transport capacity of scaffolds. This study designed and fabricated gradient structural scaffolds with spatially distributed pore sizes, and investigated their mechanical and fluid dynamics properties, coupled with in vitro osteogenic experiments to understand the impact of pore sizes distribution. The results indicated that, compared to traditional uniform pore scaffolds, gradient scaffolds exhibited a significant increase in mechanical strength, fluid permeability, and in vitro osteogenic activity. To sum up, the gradient scaffolds demonstrated better comprehensive performance and potential for use in the structural design of bone repair scaffolds, offering an important reference value for the three-dimensional structural design of scaffolds. © 2025 Elsevier Ltd and Techna Group S.r.l.

关键词： Bone

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Ballistic response mechanism and resistance-driven evaluation method of UHMWPE composite

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Defence technology(防务技术) 2025年第2期44卷 1-16页

作者： Yemao He Johnny Qing Zhou Yanan Jiao Hongshuai Lei Zeang Zhao Daining Fang Beijing Key Laboratory of Lightweight Multi-functional Composite Materials and Structures Beijing Institute of TechnologyBeijing 100081China Beijing Protech New Material Science Co. Ltd.Beijing 102200China School of Textile Science and Engineering Tiangong UniversityTianjin 300387China Key Laboratory of Advanced Textile Composite Materials Ministry of EducationInstitute of Textile Composite MaterialsTiangong UniversityTianjin 300387China

The use of ultra-high molecular weight polyethylene(UHMWPE)composite in the design of lightweight protective equipment,has gained a lot of ***,there is an urgent need to understand the ballistic response mechanism and theoretical prediction model of *** paper explores the ballistic response mechanism of UHMWPE composite through experimental and simulation ***,a resistance-driven modeling method was proposed to establish a theoretical model for predicting the bulletproof *** ballistic response mechanism of UHMWPE composite encompassed three fundamental modes:local response,structural response,and coupled *** occurrence ratio of these fundamental response modes during impact was dependent on the projectile velocity and laminate *** bulletproof performance of laminate under different response modes was assessed based on the penetration depth of the projectile,the bulging height on the rear face of the laminate,the thickness of remaining sub-laminate,and residual velocity of the *** absolute deviations of bulletproof performance indicator between theoretical value and experimental value were well within 11.13%,demonstrating that the established evaluation model possessed high degree of prediction accuracy.

关键词： UHMWPE composite Ballistic response mechanism Theoretical model Performance evaluation

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Synthesis of highly dispersible TiO2 nanoparticles and their application in quantum dot light emitting diodes

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Dalton Transactions 2025年第20期54卷 8174-8182页

作者： Hu, Botao Liu, Mengxin Shi, Xinan Pan, Daocheng State Key Laboratory of Featured Metal Materials and Life-cycle Safety for Composite Structures Guangxi Key Laboratory of Processing for Non-ferrous Metals and Featured Materials MOE Key Laboratory of New Processing Technology for Nonferrous Metals and Materials School of Resources Environment and Materials Guangxi University Nanning530004 China

Metal oxide nanoparticles are commonly used as electron transport layers (ETLs) in quantum dot light emitting diodes (QLEDs) because of their wide band gap, high electron mobility, and appropriate conduction and valence band positions. Currently, nanoparticulate ZnO is the most successful electron transportation material in high-performance QLEDs. However, the positive aging effect is widely observed for ZnO-based QLEDs, as the instability of amphiprotic ZnO nanoparticles under acidic, basic, and moist conditions limits their applications. In this study, highly dispersible and alcohol-soluble TiO2 nanoparticles are synthesized by using a non-hydrolytic sol-gel method, followed by a dimethyl sulfoxide post-treatment. The use of colloidal TiO2 nanoparticles as an ETL yields optimal QLEDs, with a maximum external quantum efficiency of 12.03%, a highest luminance value of 103 420 cd m−2, and a current efficiency of 18.06 cd A−1. These results reveal that TiO2 nanoparticles hold great potential as ETLs in future QLEDs. © 2025 The Royal Society of Chemistry.

关键词： Sol-gel process

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Molecular Dynamics Study on the Interactions of 1/2Edge Dislocations with Voids and Ni_(3)Al Precipitates in FCC Ni

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Acta Mechanica Solida Sinica 2025年第1期38卷 1-13页

作者： Wendong Cui Junfeng Nie Pandong Lin Lei He Institute of Nuclear and New Energy Technology Key Laboratory of Advanced Reactor Engineering and Safety of Ministry of EducationTsinghua UniversityBeijing100084China Ministry of Education Key Laboratory for Liquid-Solid Structural Evolution and Processing of MaterialsSchool of Materials Science and EngineeringShandong UniversityJinan250061China

Nickel-based alloys are the primary structural materials in steam generators of high-temperature gas *** understand the irradiation effect of nickel-based alloys,it is necessary to examine dislocation movement and its interaction with irradiation defects at the *** due to voids and Ni_(3)Al precipitates may significantly impact irradiation damage in nickel-based *** paper employs the molecular dynamics method to analyze the interaction between edge dislocations and irradiation defects(void and Ni_(3)Al precipitates)in face-centered cubic *** effects of temperature and defect size on the interaction are also *** results show that the interaction process of the edge dislocation and irradiation defects can be divided into four stages:dislocation free slip,dislocation attracted,dislocation pinned,and dislocation *** modes include the formation of stair-rod dislocations and the climbing of extended dislocation bundles for voids,as well as the generation of stair-rod dislocation and dislocation shear for ***,the interactions of edge dislocations with voids and Ni_(3)Al precipitates are strongly influenced by temperature and defect size.

关键词： Void Ni_(3)Al precipitate Nickel Edge dislocation Molecular dynamics

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Boosting Oxygen Evolution Reaction Performance on NiFe‑Based Catalysts Through d‑Orbital Hybridization

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Nano-Micro Letters 2025年第1期17卷 281-292页

作者： Xing Wang Wei Pi Sheng Hu Haifeng Bao Na Yao Wei Luo State Key Laboratory of New Textile Materials and Advanced Processing Technology Key Laboratory of New Textile Materials and Applications of Hubei ProvinceSchool of Materials Science and EngineeringWuhan Textile UniversityWuhan 430200People’s Republic of China College of Chemistry and Molecular Sciences Wuhan UniversityWuhan 430072People’s Republic of China

Anion-exchange membrane water electrolyzers(AEMWEs)for green hydrogen production have received intensive attention due to their feasibility of using earth-abundant NiFe-based *** introducing a third metal into NiFe-based catalysts to construct asymmetrical M-NiFe units,the d-orbital and electronic structures can be adjusted,which is an important strategy to achieve sufficient oxygen evolution reaction(OER)performance in ***,the ternary NiFeM(M:La,Mo)catalysts featured with distinct M-NiFe units and varying d-orbitals are reported in this *** and theoretical calculation results reveal that the doping of La leads to optimized hybridization between d orbital in NiFeM and 2p in oxygen,resulting in enhanced adsorption strength of oxygen intermediates,and reduced rate-determining step energy barrier,which is responsible for the enhanced OER *** critically,the obtained NiFeLa catalyst only requires 1.58 V to reach 1 A cm^(−2) in an anion exchange membrane electrolyzer and demonstrates excellent long-term stability of up to 600 h.

关键词： NiFe-based catalysts d-orbital coupling Oxygen evolution reaction Anion exchange membrane electrolyzer

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Fe doping 1T phase MoS_(2)with enhanced zinc-ion storage ability and durability for high-performance aqueous zinc-ion batteries

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Rare Metals 2025年第1期44卷 253-263页

作者： Jing-Yi Liu Rong-Jie Zhe Zhan-Hong Peng Yi-Hui Song Lin-Xuan Yang Chen Qing Jun-Ling Guo Jin-Ping Liu Yunnan Key Laboratory of Opto-Electronic Information Technology College of Physics and Electronic Information TechnologyYunnan Normal UniversityKunming 650000China Country State Center for International Cooperation on Designer Low-Carbon and Environmental Materials School of Materials Science and EngineeringZhengzhou UniversityZhengzhou 450001China School of Chemistry Chemical Engineering and Life ScienceState Key Laboratory of Advanced Technology for Materials Synthesis and ProcessingWuhan University of TechnologyWuhan 430070China

As a promising cathode material for aqueous zinc-ion batteries,1T-MoS_(2)has been extensively investigated because of its facile two-dimensional ion-diffusion channels and high electrical ***,the limited number of available Zn storage sites,i.e.,limited capacity,hinders its application because the inserted Zn^(2+),which form strong electrostatic interactions with 1T-MoS_(2),preventing subsequent Zn^(2+)***,the approach of enlarging the interlayer distance to reduce electrostatic interactions has been commonly used to enhance the capacity and reduce Zn^(2+)migration ***,an enlarged interlayer spacing can weaken the van der Waals force between 1T-MoS_(2)monolayers,easily disrupting the structural ***,to address this issue,an effective strategy based on Fe doping is proposed for 1T-MoS_(2)(Fe-1T-MoS_(2)).The theoretical calculations reveal that Fe doping can simultaneously moderate the rate of decrease in the adsorption energy after gradually increasing the number of stored atoms,and enhance the electron delocalization on metal-O ***,the experiment results show that Fe doping can simultaneously activate more Zn storage sites,thus enhancing the capacity,and stabilize the structural stability for improved cycling ***,Fe-1T-MoS_(2)exhibits a larger capacity(189 mAh·g^(-1)at 0.1 A·g^(-1))and superior cycling stability(78%capacity retention after 400 cycles at 2 A·g^(-1))than pure 1T-MoS_(2).This work may open up a new avenue for constructing high-performance MoS_(2)-based cathodes.

关键词： Aqueous zinc-ion battery 1T-MoS_(2) Fe doping More Zn storage sites Enhanced structural stability

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Improving the reliability of classical molecular dynamics simulations in battery electrolyte design

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Journal of Energy Chemistry 2025年第2期101卷 34-41,I0002页

作者： Xin He Yujie Zhang Haomiao Li Min Zhou Wei Wang Ruxing Wang Kai Jiang Kangli Wang State Key Laboratory of Advanced Electromagnetic Technology School of Electrical and Electronic EngineeringHuazhong University of Science and TechnologyWuhan 430074HubeiChina State Key Laboratory of Materials Processing and Die&Mould Technology College of Materials Science and EngineeringHuazhong University of Science and Technology Wuhan 430074HubeiChina Hubei Collaborative Innovation Center for High-efficiency Utilization of Solar Energy Hubei University of TechnologyWuhan 430068HubeiChina

Explorations into new electrolytes have highlighted the critical impact of solvation structure on battery performance,Classical molecular dynamics(CMD)using semi-empirical force fields has become an essential tool for simulating solvation ***,mainstream force fields often lack accuracy in describing strong ion-solvent interactions,causing disparities between CMD simulations and experimental *** some empirical methods have been employed in some of the studies to address this issue,their effectiveness has been *** CMD research,supported by quantum chemical calculations and experimental data,reveals that the solvation structure is influenced not only by the charge model but also by the polarization *** empirical approaches that focused solely on adjusting ion-solvent interaction strengths overlooked the importance of polarization *** on this insight,we propose integrating the Drude polarization model into mainstream force fields and verify its feasibility in carbonate,ether,and nitrile *** experimental results demonstrate that this approach significantly enhances the accuracy of CMD-simulated solvation *** work is expected to provide a more reliable CMD method for electrolyte design,shielding researchers from the pitfalls of erroneous simulation outcomes.

关键词： Electrolyte Classical molecular dynamics Solvation structure Simulations

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Recent Progress in the Auxiliary Phase Enhanced Flexible Piezocomposites

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Energy & Environmental materials 2025年第1期8卷 296-316页

作者： Xin Gao Mupeng Zheng Boyue Hou Junshu Wu Mankang Zhu Yunfan Zhang Ke Wang Bing Han College of Materials Science and Engineering Beijing University of Technology School of Basic Medical Sciences Capital Medical University Department of Orthodontics Peking University School and Hospital of Stomatology & National Center of Stomatology & National Engineering Laboratory for Digital and Material Technology of Stomatology & NMPA Key Laboratory for Dental Materials State Key Laboratory of New Ceramics and Fine Processing School of Materials Science and Engineering Tsinghua University

Piezocomposites with both flexibility and electromechanical conversion characteristics have been widely applied in various fields,including sensors,energy harvesting,catalysis,and biomedical *** the composition of piezocomposites or their preparation process,a category of materials is commonly employed that do not possess piezoelectric properties themselves but play a crucial role in performance *** this review,the concept of auxiliary phase is first proposed to define these materials,aiming to provide a new perspective for designing high-performance piezocomposites.

关键词： auxiliary phase flexibility microstructure piezocomposites piezoelectricity

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Elastic properties of Cu–6wt% Ag alloy wires for pulsed magnets investigated by ultrasonic techniques

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Chinese Physics B 2025年第2期34卷 90-95页

作者： Ziyu Li Tianyi Gu Wenqi Wei Yang Yuan Zhuo Wang Kangjian Luo Yupeng Pan Jianfeng Xie Shaozhe Zhang Tao Peng Lin Liu Qi Chen Xiaotao Han Yongkang Luo Liang Li Wuhan National High Magnetic Field Center Huazhong University of Science and TechnologyWuhan 430074China School of Physics Huazhong University of Science and TechnologyWuhan 430074China State Key Laboratory of Advanced Electromagnetic Engineering and Technology Huazhong University of Science and TechnologyWuhan 430074China School of Materials Science and Engineering State Key Laboratory for Materials Processing and Die&Mold TechnologyHuazhong University of Science and TechnologyWuhan 430074China

Conductor materials with good mechanical performance as well as high electrical and thermal conductivities are particularly important to break through the current bottle-neck limit(~ 100 T) of pulsed magnets. Here, we perform systematic studies on the elastic properties of the Cu–6wt% Ag alloy wire, which is a promising candidate material for the new-generation pulsed magnets, by employing two independent ultrasonic techniques, i.e., resonant ultrasound spectroscopy(RUS) and ultrasound pulse-echo experiments. Our RUS measurements manifest that the elastic properties of the Cu–6wt% Ag alloy wires can be improved by an electroplastic drawing procedure as compared with the conventional cold drawing. We also take this opportunity to test the availability of our newly-built ultrasound pulse-echo facility at the Wuhan National High Magnetic Field Center(WHMFC, China), and the results suggest that the elastic performance of the electroplastically-drawn Cu–6wt% Ag alloy wire remains excellent without anomalous softening under extreme conditions,e.g., in ultra-high magnetic field up to 50 T and nitrogen or helium cryogenic liquids.

关键词： high-field magnet Cu–Ag alloy ultrasonic techniques elastic constants

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Chiral electrolytes for rechargeable metal batteries

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Journal of Energy Chemistry 2025年第3期102卷 834-841页

作者： Lan-Qing Wu Yu-Jie Ning Zhen-Yu Fan Zhe Li Kun Li Jia Li Shuang-Xin Ren Dubin Huang Yang Yang Weiwei Xie Huan Wang Qing Zhao Frontiers Science Center for New Organic Matter Key Laboratory of Advanced Energy Materials Chemistry(Ministry of Education)State Key Laboratory of Advanced Chemical Power SourcesCollege of ChemistryNankai UniversityTianjin 300071China Beijing Golden Feather New Energy Technology Co. LtdBeijing 100080China

Charge transfer at the liquid(electrolyte)-solid(metal)interfaces is of fundamental importance to metal electrochemical deposition that further determines the reversibility and kinetics of energy-dense rechargeable metal batteries(RMBs).We demonstrate the fast charge transfer at the electrolyte-metal interfaces for lithium metal by designing and synthesizing electrolytes with chiral solvents:R(or S)-1,2-dimethoxy pro pane(R-DMP or S-DMP)and R(or S)-4-methyl-1,3-dioxolane(R-MDOL or S-MDOL).The chiral-induced spin selectivity is considered to produce spin-polarized metal surfaces,enabling the improvement in charge transfer rate and *** deposited Li metal in chiral electrolytes shows smooth and uniform morphologies,as well as high initial(>95%)and average(~99.2%)Coulombic efficiency for Li metal stripping/plating process,thus prolonging the life-span of batteries using thin lithium anode(50μm)to 400 cycles till 80%capacity *** work provides a distinct approach to regulate metal deposition beyond the limitation of ion de-solvation.

关键词： Chiral ether electrolytes Electrode kinetics Li metal batteries Metal deposition Solvation structures

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