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Customized interfacial electronic interactions in protonated g-C3N4/ZnIn2S4 S-scheme 2D/2D edge-to-face heterostructures for boosted CO2 photoconversion

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Chemical engineering Journal 2025年 514卷

作者： Li, Lei Dai, Xinyan Gao, Kangjie Yu, Hangjing Chen, Fang Wang, Wentao Ning, Jiqiang Hu, Yong Key Laboratory of the Ministry of Education for Advanced Catalysis Materials Department of Chemistry Zhejiang Normal University Jinhua321004 China Division of Natural and Applied Sciences Duke Kunshan University Kunshan215316 China College of Chemistry and Materials Engineering Zhejiang A&F University Hangzhou311300 China Hangzhou Institute of Advanced Studies Zhejiang Normal University Hangzhou311231 China Guizhou Provincial Key Laboratory of Computational Nano-Material Science Guizhou Education University Guiyang550018 China Department of Optical Science and Engineering Fudan University Shanghai200438 China

Incorporating surface modification with heterojunction engineering is a key strategy for developing high-efficiency carbon dioxide photoreduction (CO2PR) catalysts. In this study, an acid-assisted hydrothermal method is employed to simultaneously protonate g-C3N4 nanosheets and facilitate the vertical growth of ZnIn2S4 nanosheet clusters on the protonated g-C3N4 (PCN) substrate guided by proton ligands. The resulting PCN/ZnIn2S4 heterojunction features an S-scheme 2D/2D edge-to-face structure, characterized by an improved active surface area, intimate line contact interfaces and strong interfacial electronic interactions. The optimized PCN/ZnIn2S4 catalyst achieves a CO evolution rate of 43.6 μmol g−1 h−1 with nearly 100% selectivity. Both experimental analyses and theoretical calculations reveal that the interfacial built-in electric field enhances charge carrier separation and migration, while the strengthened CO2 adsorption and reduced energy barrier further facilitate CO2 reduction. This work offers a "two birds with one stone" strategy for rationally constructing energy-conversion heterojunctions without using organic surfactants. © 2025 Elsevier B.V.

关键词： Nanosheets

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Effects of pre-precipitation of Cr_2N on microstructures and properties of high nitrogen stainless steel

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Journal of Central South University 2012年第5期19卷 1189-1195页

作者：李静媛刘慧男黄佩武 School of Materials Science and Engineering University of Science and Technology Beijing Materials Science and Engineering Program University of California School of Metallurgical Engineering Hunan University of Technology

Aging precipitation and solid solution heat treatment were carried out on three steels which have chromium content of 18%, manganese content of 12%, 15%, 18%, and nitrogen content of 0.43%, 0.53%, 0.67%, respectively. The mechanisms of precipitation and solid solution of high nitrogen anstenitic stainless steel were studied using the scanning electron microscopy, transmission electron microscopy, electron probe micro analysis and mechanical testing. The results show that, Cr2N is the primary precipitate in the tested stainless steels instead of Cr23C6. Cr2N nucleates at austenitic grain boundaries and grows towards inner grains with a lameUar morphology. By means of pre-precipitation of Cr2N at 800 ~C, the microstructure of the steels at solid solution state can be refined, thus improving the strength and plasticity. After the proposed treatment, the tensile strength, the proof strength and the elongation of the tested steel reach 881 MPa, 542 MPa and 54%, respectively.

关键词： Cr2N precipitation refinement high nitrogen stainless steel （HNSS）

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Phase Transitions of the CU6Sn5 Phase Under Electric Currents

Phase Transitions of the CU6Sn5 Phase Under Electric Current...

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International Conference on Electronics Packaging (ICEP)

作者： Shubhayan Mukherjee Yu-Chen Liu Shih-Kang Lin Department of Materials Science and Engineering National Cheng Kung University Tainan Taiwan Hierarchical Green-Energy Materials (Hi-GEM) Research Centre National Cheng Kung University Tainan Taiwan Program on Smart and Sustainable Manufacturing Academy of Innovative Semiconductor and Sustainable Manufacturing National Cheng Kung University Tainan Taiwan Department of Mechanical Engineering National Cheng Kung University Tainan Taiwan

ISBN: (数字)9784991191190

ISBN: (纸本)9798331514747

The performance and reliability of interfacial regions in electronic solder joints are critical for the durability of lead-free solder systems. The intermetallic compound $\text{Cu}_{6}\text{Sn}_{5}$ , which forms at the interface between Sn-based solders and Cu substrates, exists in two crystal structures: the low-temperature monoclinic phase $(\eta^{\prime}-\text{Cu}_{6}\text{Sn}_{5})$ and the high-temperature hexagonal phase $(\eta-\text{Cu}_{6}\text{Sn}_{5})$ . Although the thermal behavior of these phases is well-documented, the effects of electric current on the stability and mechanical properties of $\eta^{\prime}-\text{Cu}_{6}\text{Sn}_{5}$ remain less understood. This study investigates the impact of electric current on the microstructural evolution of $\eta^{\prime}-\text{Cu}_{6}\text{Sn}_{5}$ through high-resolution transmission electron microscopy (HR-TEM) following the synchrotron radiation-based X-ray diffraction (SR-XRD). Single-phase $\eta^{\prime}-\text{Cu}_{6}\text{Sn}_{5}$ samples were subjected to a current density of 1.5 x 10 3 A/cm 2 for 5 hours. Microstructural observations from HR-TEM, following SR-XRD, reveal significant insights into the behavior of monoclinic $\eta^{\prime}-\text{Cu}_{6}\text{Sn}_{5}$ under electric current stressing. These findings offer insights into the relationship between electric current and phase stability in interfacial compounds, which could enhance the reliability of solder joints in advanced electronic systems.

关键词： X-ray scattering Synchrotrons High-resolution transmission electron microscopy materials reliability X-ray diffraction Stability analysis Compounds Current Soldering Thermal stability

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Intermetallic Compound Formation and Growth Behavior Between Ruthenium and Tin System

Intermetallic Compound Formation and Growth Behavior Between...

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International Conference on Electronics Packaging (ICEP)

作者： Hsiu-mei Yang Tzu-hsuan Huang Yu-hsuan Lin Min-cian Chen Shih-kang Lin Department of Materials Science and Engineering National Cheng Kung University Tainan Taiwan Program on Semiconductor Packaging and Testing Academy of Innovative Semiconductor and Sustainable Manufacturing National Cheng Kung University Tainan Taiwan Taiwan Semiconductor Manufacturing Company Limited Hsinchu Taiwan

ISBN: (数字)9784991191190

ISBN: (纸本)9798331514747

This study investigates the liquid/solid reflow process under a vacuum environment of 1 Pa at reflow temperatures of 300°C for different reaction times. The research finds that at the Sn/Ru interface, during 300°C reflow for 24 hours, the RU 3 Sn 7 intermetallic compound was formed. As the reflow time increases, the IMC thickness increases. This study provides a fundamental understanding of the interfacial reactions between Sn and Ru. The mechanisms of the interfacial reactions and the growth kinetics of the intermetallic compounds (IMC) will be revealed through phase diagrams, thermodynamics, and kinetic analysis.

关键词： Thermodynamics Ruthenium Tin Atoms Kinetic theory Intermetallic Compounds Microstructure Substrates Electronics packaging

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Observation of mechanical kink control and generation via phonons

arXiv

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arXiv 2025年

作者： Qian, Kai Cheng, Nan Serafin, Francesco Sun, Kai Theocharis, Georgios Mao, Xiaoming Boechler, Nicholas Department of Mechanical and Aerospace Engineering University of California San Diego La Jolla CA92093 United States Department of Physics University of Michigan Ann ArborMI48109 United States Department of Physics and Materials Science University of Luxembourg 2 Avenue de l’Universite L Esch-sur-Alzette4365 Luxembourg CNRS Le Mans Université France Program in Materials Science and Engineering University of California San Diego La Jolla CA92093 United States

Kinks (or domain walls) are localized transitions between distinct ground states associated with a topological invariant, and are central to many phenomena across physics, from condensed matter to cosmology. While phonon (i.e., small-amplitude vibration) wave packets have been theorized to deterministically interact with kinks and initiate their movement, this interaction has remained elusive in experiments, where only uncontrollable stochastic kink motion generated by thermal phonons or dislocation glide by low-frequency quasi-static loading have been observed. This is partly because all physical systems that support kinks are, at some level, discrete, making deterministic phonon control of kinks extremely challenging due to the existence of Peierls-Nabarro (PN) barrier. Here, we demonstrate, for the first time, experimental observation of phonon-mediated control and generation of mechanical kinks, which we enable using a topological metamaterial that constitutes an elastic realization of the Kane-Lubensky chain model. Our metamaterial overcomes the PN barrier by supporting a single, topologically protected kink that requires zero energy to form and move. Using simulations that show close agreement with our experimental observations, we also reveal unique dynamics of phonon interplay with highly discrete kinks, including long-duration motion and a continuous family of internal modes, features absent in other discrete nonlinear systems. This work introduces a new paradigm for topological kink control, with potential applications in material stiffness tuning, shape morphing, locomotion, and robust signal transmission. © 2025, CC BY-NC-ND.

关键词： Stochastic systems

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Change in Magnetic Order in NiPS3 Single Crystals Induced by a Molecular Intercalation

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Chemistry of materials 2025年第10期37卷 3594-3607页

作者： Chakraborty, Nirman Harchol, Adi Arnold, Beatriz Costa Sharma, Kusha Prabhu Gaonkar, Diksha Abu-Hariri, Azhar Yadav, Rajesh Kumar Dawod, Muhamed Eyal, Anna Amouyal, Yaron Brumme, Thomas Heine, Thomas Naveh, Doron Lifshitz, Efrat Schulich Faculty of Chemistry Solid State Institute Russel Berrie Nanotechnology Institute Grand Program for Energy and the Helen Diller Quantum Center Technion-Israel Institute of Technology Haifa3200003 Israel Helmholtz-Zentrum Dresden-Rossendorf Bautzner Landstr. 400 Dresden01328 Germany Center for Advanced Systems Understanding CASUS Untermarkt 20 Gorlitz02826 Germany Faculty of Engineering Bar-Ilan University Ramat-Gan5290002 Israel Institute of Nanotechnology and Advanced Materials Bar-Ilan University Ramat-Gan5290002 Israel Department of Materials Science and Engineering Technion-Israel Institute of Technology Haifa3200003 Israel Department of Physics Technion Haifa3200003 Israel Department of Theoretical Chemistry Technische Universität Dresden Bergstrasse 66 Dresden01069 Germany Yonsei University and ibs-cnm Seoul120-749 Korea Republic of

Intercalation is a robust method for tuning the physical properties of a vast number of van der Waals (vdW) materials. However, the prospects of using intercalation to modify magnetism in van der Waals (vdW) systems and the associated mechanisms have not been adequately studied. In this work, we modulated magnetic order in XY antiferromagnet NiPS3 single crystals by introducing pyridine molecules into the vdW’s gap under different thermal conditions. X-ray diffraction measurements indicated pronounced changes in the lattice parameter β, while magnetization measurements at in-plane and out-of-plane configurations exposed reversal trends in the crystals’ Néel temperatures through intercalation/deintercalation processes. The changes in magnetic ordering were also supported by three-dimensional thermal diffusivity experiments. The preferred orientation of the pyridine dipoles within the vdW gaps was deciphered via polarized Raman spectroscopy. The results highlighted the relationship between the preferential alignment of the intercalants, thermal transport, and crystallographic disorder, along with the modulation of anisotropy in the magnetic order. DFT + U calculations indicated that the varying interlayer exchange interactions, regulated by intercalants, were responsible for modulating samples’ magnetic ordering. The study uncovers the possible merit of intercalation for manipulating spin orientations in spin electronics and advanced quantum devices. © 2025 American Chemical Society.

关键词： Magnetization reversal

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Large-Scale Distributed Multidisciplinary Design Optimization of the NASA Lift-Plus-Cruise Air Taxi Concept

Large-Scale Distributed Multidisciplinary Design Optimizatio...

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AIAA science and Technology Forum and Exposition, AIAA SciTech Forum 2025

作者： van Schie, Sebastiaan P. C. Ruh, Marius L. Fletcher, Andrew Warner, Michael Sperry, Mark Scotzniovsky, Luca Orndorff, Nicholas C. Xiang, Ru Yan, Jiayao Zhao, Han Krokowski, Joshua J. Chen, J.S. Sarojini, Darshan Gill, Hyunjune Lee, Seongkyu Tagg, Andrew Anderson, Ryan Green, Eric Joseph, Cibin Ning, Andrew Cheng, Zeyu Cao, Zhi Mi, Chunting Guibert, Alexandre T. R. Cronk, Ashley Kim, H. Alicia Meng, Y. Shirley Silva, Christopher Hwang, John T. University of California San Diego 9500 Gilman Dr La Jolla CA92093 United States Department of Mechanical and Aerospace Engineering University of California San Diego 9500 Gilman Dr La Jolla CA92093 United States Department of Structural Engineering University of California San Diego 9500 Gilman Dr La Jolla CA92093 United States Aerospace and Ocean Engineering Department Virginia Tech 1600 Innovation Dr BlacksburgVA24060 United States Department of Mechanical and Aerospace Engineering University of California Davis 1 Shields Avenue DavisCA95616 United States Mechanical Engineering Brigham Young University ProvoUT84602 United States Department of Electrical & Computer Engineering San Diego State University 5500 Campanile Dr San Diego92182 United States Structural Engineering Department University of California San Diego 9500 Gilman Dr La Jolla CA92093 United States Materials Science & Engineering Program University of California San Diego 9500 Gilman Dr La Jolla CA92093 United States Pritzker School of Molecular Engineering The University of Chicago ChicagoIL60607 United States NASA Ames Research Center Moffett FieldCA94035 United States

ISBN: (数字)9781624107238

ISBN: (纸本)9781624107238

Large-scale gradient-based Multidisciplinary Design Optimization (MDO) can aid in the exploration of high-dimensional design spaces for novel air vehicle concepts, thereby leading to more efficient and economic designs. This paper builds on past works where we demonstrated large-scale physics-based MDO capabilities and applied these to NASA’s lift-plus-cruise electric air taxi concept. We extend this comprehensive mid-fidelity system-level optimization problem with high(er)-fidelity subsystem-level optimizations of various aircraft systems and mission phases, with the aim of further enhancing the accuracy and scope of the aforementioned system-level optimization problem: 1) Power minimization during the transition mission phase;2) Electrical powertrain topology optimization;3) Cell chemistry modeling and thermomechanical battery pack topology optimization;4) Shell-based coupled aero-elastic wing structure optimization. An Analytical Target Cascading-like distributed MDO architecture allows us to couple the system- and subsystem-level optimizations in order to arrive at a consistent and feasible design. We find that the system-level design is most heavily impacted by the reduced battery pack-level energy densities that stem from power peaks in the mission profile. These power peaks seem to result from the inefficient lift rotor blade designs that are needed to satisfy noise constraints. We draw conclusions based on trends in our results and give recommendations for future MDO studies of electrical air taxi vehicle concepts. © 2025, American Institute of Aeronautics and Astronautics Inc, AIAA. All rights reserved.

关键词： Shape optimization

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A Rapid Manual Solid Phase Peptide Synthesis Method for High-Throughput Peptide Production

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Journal of Biomedical materials Research - Part A 2025年第5期113卷 e37922页

作者： Overby, Clyde Abraham, Brittany Adjei-Sowah, Emmanuella March, Alyson Ling, Kevin Basu, Sayantani Benoit, Danielle S. W. Department of Biomedical Engineering University of Rochester RochesterNY United States Center for Musculoskeletal Research University of Rochester RochesterNY United States Department of Chemical Engineering University of Rochester RochesterNY United States Materials Science Program University of Rochester RochesterNY United States Department of Bioengineering Knight Campus for Accelerating Scientific Impact University of Oregon EugeneOR United States

Solid phase peptide synthesis (SPPS) techniques are critical for developing and using peptides in various biomedical applications. However, typical synthesis routes used in SPPS are either resource-intensive (e.g., with automated synthesis or commercial services) or time-consuming (e.g., with manual benchtop synthesis). Here, a rapid manual synthesis method was developed to produce up to 8 peptides with fast cycle times simultaneously. Peptides synthesized manually were of equivalent or superior quality to those produced by in-house microwave-assisted automated peptide synthesis, with higher average crude purity of 70% compared to 50%. The method significantly reduced synthesis time, enabling the parallel coupling of up to 8 amino acids simultaneously in 15–20 min, as opposed to traditional benchtop peptide synthesis, which requires 80–150 min per amino acid. This approach offers an intermediate throughput between milligram-scale libraries and gram-scale single peptide synthesis, enabling rapid iteration for novel peptide designs without the need for expensive automated systems. As a result, peptide modifications, including incorporation of unnatural amino acids, can be explored, accelerating the development of peptides for a wide range of applications. © 2025 The Author(s). Journal of Biomedical materials Research Part A published by Wiley Periodicals LLC.

关键词： Medical applications

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Conditional Generative Modeling for Amorphous Multi-Element materials

arXiv

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arXiv 2025年

作者： Li, Honglin Liu, Chuhao Guo, Yongfeng Luo, Xiaoshan Chen, Yijie Liu, Guangsheng Li, Yu Wang, Ruoyu Wang, Zhenyu Wu, Jianzhuo Ma, Cheng Xie, Zhuohang Lv, Jian Ding, Yufei Zhang, Huabin Luo, Jian Zhong, Zhicheng Li, Mufan Wang, Yanchao Li, Wan-Lu Key Laboratory of Material Simulation Methods and Software Ministry of Education College of Physics Jilin University Changchun China Aiiso Yufeng Li Family Department of Chemical and Nano Engineering University of California La Jolla San DiegoCA United States Institute of Molecular Engineering Plus College of Chemistry Fuzhou University Fuzhou China College of Chemistry and Molecular Engineering Peking University Beijing China School of Physics Nankai University Tianjin China Institute of Modern Physics Fudan University Shanghai China Program in Materials Science and Engineering University of California La Jolla San DiegoCA United States School of Artificial Intelligence and Data Science University of Science and Technology of China Hefei230026 China Suzhou Institute for Advanced Research University of Science and Technology of China Suzhou215123 China International Center of Future Science Jilin University Changchun China Department of Computer Science and Engineering University of California La Jolla San DiegoCA United States Center for Renewable Energy and Storage Technologies Physical Science and Engineering Division King Abdullah University of Science and Technology Thuwal Saudi Arabia Suzhou Lab Suzhou215123 China

Amorphous multi-element materials offer unprecedented tunability in composition and properties, yet their rational design remains challenging due to the lack of predictive structure-property relationships and the vast configurational space. Traditional modeling struggles to capture the intricate short-range order that dictates their stability and functionality. We here introduce ApolloX, a pioneering predictive framework for amorphous multi-element materials, establishing a new paradigm by integrating physics-informed generative modeling with particle swarm optimization, using chemical short-range order as an explicit constraint. By systematically navigating the disordered energy landscape, ApolloX enables the targeted design of thermodynamically stable amorphous configurations. It accurately predicts atomic-scale arrangements, including composition-driven metal clustering and amorphization trends, which are well-validated by experiments, while also guiding synthesis by leveraging sluggish diffusion to control elemental distribution and disorder. The resulting structural evolution, governed by composition, directly impacts catalytic performance, leading to improved activity and stability with increasing amorphization. This predictive-experimental synergy transforms the discovery of amorphous materials, unlocking new frontiers in catalysis, energy storage, and functional disordered systems. Copyright © 2025, The Authors. All rights reserved.

关键词： Amorphization

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Sodium niobate with high photocatalytic activity for the removal of organic dye and inactivation of Escherichia coli, Staphylococcus aureus, and Klebsiella pneumoniae bacteria: the effect of Zn doping on these properties

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Ceramics International 2025年

作者： Fernandes, Daiane Raubach, Cristiane Trassante, Carla Dias, Vagner Melo, Luize Silveira, Marcelle Carvalho, Ramon Moreira, Mario Jardim, Pedro Ferrer, Mateus Giongo, Janice Vaucher, Rodrigo Longo, Elson Cava, Sergio Post-Graduate Program in Materials Science and Engineering Federal University of Pelotas RS Pelotas96010-610 Brazil Post-Graduate Program in Microbiology and Parasitology Federal University of Pelotas RS Capão do Leão96160-000 Brazil Post-Graduate Program in Physics Federal University of Pelotas RS Capão do Leão96160-000 Brazil Functional Materials Development Center São Carlos Federal University SP São Carlos13565-905 Brazil

NaNbO3 doped with Zn (0.00, 0.02, and 0.05 mmol) was synthesized by the microwave-assisted hydrothermal method. Photocatalytic and antibacterial activities were investigated. X-ray diffraction revealed the coexistence of two orthorhombic symmetries (P21ma and Pbma), with doping promoting a progressive increase in the Pbma fraction. All samples exhibited a fiber-like shape (diameter of ∼200 nm), which remained unchanged with doping. The low Zn content (0.02 mmol) reduced the band gap energy from 3.08 to 2.95 eV. As a result, this sample exhibited superior photocatalytic activity, achieving 100 % RhB dye degradation within 45 min, under UV light. Scavenger tests revealed that hydroxyl radicals, holes, and superoxide radical anions were the main active species involved in the photocatalytic reaction. Additionally, the photocatalyst demonstrated excellent recyclability over three consecutive cycles. Pure NaNbO3 exhibited strong antibacterial activity, completely inhibiting the growth of S. aureus, E. coli, and K. pneumoniae at the tested concentrations. Although the Zn-doped sample also demonstrated antibacterial action, the response was concentration-dependent. This study is the first report on Zn doping in NaNbO3, as well as the first investigation of its antibacterial activity against K. pneumoniae and S. aureus. © 2025 Elsevier Ltd and Techna Group S.r.l.

关键词： Escherichia coli

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