Modern materials science generates vast and diverse datasets from both experiments and computations,yet these multi-source,heterogeneous data often remain disconnected in isolated“silos”.Here,we introduce MaterialsG...Modern materials science generates vast and diverse datasets from both experiments and computations,yet these multi-source,heterogeneous data often remain disconnected in isolated“silos”.Here,we introduce MaterialsGalaxy,a comprehensive platform that deeply fuses experimental and theoretical data in condensed matter physics.Its core innovation is a structure similarity-driven data fusion mechanism that quantitatively links cross-modal records—spanning diffraction,crystal growth,computations,and literature—based on their underlying atomic structures.The platform integrates artificial intelligence(AI)tools,including large language models(LLMs)for knowledge extraction,generative models for crystal structure prediction,and machine learning property predictors,to enhance data interpretation and accelerate materials discovery.We demonstrate that MaterialsGalaxy effectively integrates these disparate data sources,uncovering hidden correlations and guiding the design of novel materials.By bridging the long-standing gap between experiment and theory,MaterialsGalaxy provides a new paradigm for data-driven materials research and accelerates the discovery of advanced materials.展开更多
Our understanding of how photons couple to different degrees of freedom in solids forms the bedrock of ultrafast physics and materials sciences.In this review,the emergent ultrafast dynamics in condensed matter at the...Our understanding of how photons couple to different degrees of freedom in solids forms the bedrock of ultrafast physics and materials sciences.In this review,the emergent ultrafast dynamics in condensed matter at the attosecond timescale have been intensively discussed.In particular,the focus is put on recent developments of attosecond dynamics of charge,exciton,and magnetism.New concepts and indispensable role of interactions among multiple degrees of freedom in solids are highlighted.Applications of attosecond electronic metrology and future prospects toward attosecond dynamics in condensed matter are further discussed.These pioneering studies promise future development of advanced attosecond science and technology such as attosecond lasers,laser medical engineering,and ultrafast electronic devices.展开更多
Deep learning combining the physics information is employed to solve the Boussinesq equation with second-order time derivative.High prediction accuracies are achieved by adding a new initial loss term in the physics-i...Deep learning combining the physics information is employed to solve the Boussinesq equation with second-order time derivative.High prediction accuracies are achieved by adding a new initial loss term in the physics-informed neural networks along with the adaptive activation function and loss-balanced coefficients.The numerical simulations are carried out with different initial and boundary conditions,in which the relative L2-norm errors are all around 10^(−4).The prediction accuracies have been improved by two orders of magnitude compared to the former results in certain simulations.The dynamic behavior of solitons and their interaction are studied in the colliding and chasing processes for the Boussinesq equation.More training time is needed for the solver of the Boussinesq equation when the width of the two-soliton solutions becomes narrower with other parameters fixed.展开更多
Thermomagnetic generation(TMG),a heat-to-electricity conversion technology based on the thermomagnetic effect,offers high reliability and broad adaptability to diverse heat sources.By exploiting the temperature-depend...Thermomagnetic generation(TMG),a heat-to-electricity conversion technology based on the thermomagnetic effect,offers high reliability and broad adaptability to diverse heat sources.By exploiting the temperature-dependent magnetization of thermomagnetic materials,TMG converts thermal energy into electrical energy through cyclic changes in magnetic flux based on Faraday's law.The performance of TMG systems is largely governed by the intrinsic properties of the working materials and the design of device architecture.Ideal TMG materials exhibit sharp and reversible magnetization transitions near the operating temperature,low thermal hysteresis,and high thermal conductivity.Device configurations can be broadly categorized into active and passive systems:active TMG devices rely on controlled thermal cycling and optimized magnetic circuits for enhanced output,whereas passive devices utilize self-actuated mechanical motion to generate electricity.In this topical review,we provide a comprehensive overview of recent advances in TMG materials and device configurations.Furthermore,we discuss future development trends and offer perspectives on experimental strategies to advance this field.展开更多
Accessing the milli-Kelvin regime is increasingly important for next-generation quantum technologies and deep-space observations.Among established cryogenic techniques,adiabatic demagnetization refrigeration(ADR)is di...Accessing the milli-Kelvin regime is increasingly important for next-generation quantum technologies and deep-space observations.Among established cryogenic techniques,adiabatic demagnetization refrigeration(ADR)is distinctive for its all-solid-state design,low vibration,and intrinsic gravity independence.Here we present a materials-centered review of ADR refrigerants,connecting classical thermodynamics to modern quantum many-body behavior.Beyond hydrated paramagnetic salts,dense rare-earth oxides and correlated-disorder ceramics,we highlight emerging quantum-engineered refrigerants,including geometrically frustrated magnets,and quantum-critical systems.In these materials,suppressing long-range order and tailoring low-energy excitations redistribute spin entropy into the sub-Kelvin window,enabling large and reversible entropy changes at the lowest accessible temperatures.We discuss the central trade-offs among volumetric entropy density,thermal transport,and magnetic ordering,and outline possible design rules for staged ADR architectures.展开更多
The haloscope based on the TM_(010)mode cavity is a well-established technique for detecting QCD axions.However,the method has limitations in detecting high-mass axion due to significant volume loss in the high-freque...The haloscope based on the TM_(010)mode cavity is a well-established technique for detecting QCD axions.However,the method has limitations in detecting high-mass axion due to significant volume loss in the high-frequency cavity.Utilizing a higher-order mode cavity can effectively reduce the volume loss of the high-frequency cavity.The rotatable dielectric pieces as a tuning mechanism can compensate for the degradation of the form factor of the higher-order mode.Nevertheless,the introduction of dielectric causes additional volume loss.To address these issues,this paper proposes a novel design scheme by adding a central metal rod to the higher-order mode cavity tuned by dielectrics,which improves the performance of the haloscope due to the increased effective volume of the cavity detector.The superiority of the novel design is demonstrated by comparing its simulated performance with previous designs.Moreover,the feasibility of the scheme is verified by the full-wave simulation results of the mechanical design model.展开更多
The cobalt-free Mn-based Li-rich layered oxide material has the advantages of low cost,high energy density,and good performance at low temperatures,and is the promising choice for energy storage batteries.However,the ...The cobalt-free Mn-based Li-rich layered oxide material has the advantages of low cost,high energy density,and good performance at low temperatures,and is the promising choice for energy storage batteries.However,the long-cycling stability of batteries needs to be improved.Herein,the Mn-based Li-rich cathode materials with small amounts of Li2 MnO3 crystal domains and gradient doping of Al and Ti elements from the surface to the bulk have been developed to improve the structure and interface stability.Then the batteries with a high energy density of 600 Wh kg^(-1),excellent capacity retention of 99.7%with low voltage decay of 0.03 mV cycle^(-1) after 800 cycles,and good rates performances can be achieved.Therefore,the structure and cycling stability of low voltage Mn-based Li-rich cathode materials can be significantly improved by the bulk structure design and interface regulation,and this work has paved the way for developing low-cost and high-energy Mn-based energy storage batteries with long lifetime.展开更多
Silicon(Si)is a promising anode material for rechargeable batteries due to its high theoretical capacity and abundance,but its practical application is hindered by the continuous growth of porous solid-electrolyte int...Silicon(Si)is a promising anode material for rechargeable batteries due to its high theoretical capacity and abundance,but its practical application is hindered by the continuous growth of porous solid-electrolyte interphase(SEI),leading to capacity fade.Herein,a LiF-Pie structured SEI is proposed,with LiF nanodomains encapsulated in the inner layer of the organic cross-linking silane matrix.A series of advanced techniques such as cryogenic electron microscopy,time-of-flight secondary ion mass spectrometry,and matrix-assisted laser desorption/ionization time-of-flight mass spectrometry have provided detailed insights into the formation mechanism,nanostructure,and chemical composition of the interface.With such SEI,the capacity retention of LiCoO_(2)||Si is significantly improved from 49.6%to 88.9%after 300 cycles at 100 mA g^(-1).These findings provide a desirable interfacial design principle with enhanced(electro)chemical and mechanical stability,which are crucial for sustaining Si anode functionality,thereby significantly advancing the reliability and practical application of Si-based anodes.展开更多
Low-dimensional physics provides profound insights into strongly correlated interactions,leading to enhancedquantum effects and the emergence of exotic quantum states.The Ln_(3)ScBi_(5)family stands out as a chemicall...Low-dimensional physics provides profound insights into strongly correlated interactions,leading to enhancedquantum effects and the emergence of exotic quantum states.The Ln_(3)ScBi_(5)family stands out as a chemicallyversatile kagome platform with mixed low-dimensional structural framework and tunable physical properties.Ourresearch initiates with a comprehensive evaluation of the currently known Ln_(3)ScBi_(5)(Ln=La-Nd,Sm)materials,providing a robust methodology for assessing their stability frontiers within this system.Focusing on Pr_(3)ScBi_(5),we investigate the influence of the zigzag chains of quasi-one-dimensional(Q1D)motifs and the distorted kagomelayers of quasi-two-dimensional(Q2D)networks in the mixed-dimensional structure on the intricate magneticground states and unique spin fluctuations.Our study reveals that the noncollinear antiferromagnetic(AFM)moments of Pr^(3+)ions are confined within the Q2D kagome planes,displaying minimal in-plane anisotropy.Incontrast,a strong AFM coupling is observed within the Q1D zigzag chains,significantly constraining spin motion.Notably,magnetic frustration is partially a consequence of coupling to conduction electrons via Ruderman-Kittel-Kasuya-Yosida interaction,highlighting a promising framework for future investigations into mixed-dimensional frustration in Ln_(3)ScBi_(5) systems.展开更多
Rare-earth based frustrated magnets have attracted great attention as excellent candidates for magnetic refrigeration at sub-Kelvin temperatures,while the experimental identification of systems exhibiting both large v...Rare-earth based frustrated magnets have attracted great attention as excellent candidates for magnetic refrigeration at sub-Kelvin temperatures,while the experimental identification of systems exhibiting both large volumetric cooling capacity and reduced working temperatures far below 1K remains a challenge.Here,through ultra-low temperature magnetism and thermodynamic characterizations,we unveil the large magnetocaloric effect(MCE)realized at sub-Kelvin temperatures in the frustrated Kagome antiferromagnet Gd_(3)BWO_(9) with T_(N)∼1.0 K.The isothermal magnetization curves indicate the existence of field(B)induced anisotropic magnetic phase diagrams,where four distinct magnetic phases for B‖c-axis and five magnetic phases for B‖ab-plane are identified at T<T_(N).The analysis of magnetic entropy S(B,T)data and direct adiabatic demagnetization tests reveal remarkable cooling performance at sub-Kelvin temperatures featured by a large volumetric entropy density of 502.2 mJ/K/cm^(3)and a low attainable minimal temperature T_(min)∼168mK from the initial cooling condition of 2K and 6 T,surpassing most Gd-based refrigerants previously documented in temperature ranges of 0.25–4 K.The realized T_(min)∼168mK far below T_(N)∼1.0K in Gd_(3)BWO_(9) is related to the combined effects of magnetic frustration and criticality-enhanced MCE,which together leave substantial magnetic entropy at reduced temperatures by enhancing spin fluctuations.展开更多
The precise control of wrinkles and strain gradients in nanofilm is of significant interest due to their profound influence on electronic band structures and spin states.Here,we employ ultrafast electron diffraction(U...The precise control of wrinkles and strain gradients in nanofilm is of significant interest due to their profound influence on electronic band structures and spin states.Here,we employ ultrafast electron diffraction(UED)to study the picosecond-scale dynamics of laser-induced bending in 2H-MoTe2 thin films.展开更多
Density-functional-theory(DFT)simulations with the Vienna Ab initio Simulation Package(VASP)are indispensable in computational materials science but often require extensive manual setup,monitoring,and postprocessing.H...Density-functional-theory(DFT)simulations with the Vienna Ab initio Simulation Package(VASP)are indispensable in computational materials science but often require extensive manual setup,monitoring,and postprocessing.Here,we introduce VASPilot,an open-source platform that fully automates VASP workflows via a multi-agent architecture built on the CrewAI framework and a standardized model context protocol(MCP).VASPilot’s agent suite handles every stage of a VASP study from retrieving crystal structures and generating input files to submitting Slurm jobs,parsing error messages,and dynamically adjusting parameters for seamless restarts.A lightweight Quart-based web interface provides intuitive task submission,real-time progress tracking,and drill-down access to execution logs,structure visualizations,and plots.We validated VASPilot on both routine and advanced benchmarks:automated band-structure and density-of-states calculations(including on-the-fly symmetry corrections),plane-wave cutoff convergence tests,lattice-constant optimizations with various van der Waals corrections,and cross-material band-gap comparisons for transition-metal dichalcogenides.In all cases,VASPilot completed the missions reliably and without manual intervention.Moreover,its modular design allows easy extension to other DFT codes simply by deploying the appropriate MCP server.By offloading technical overhead,VASPilot enables researchers to focus on scientific discovery and accelerates high-throughput computational materials research.展开更多
Metal superhydride compounds(MSHCs)have attracted much attention in the fields of high-pressure physics due to the superconductivity properties deriving from the metallic-hydrogen-like characteristics and relatively m...Metal superhydride compounds(MSHCs)have attracted much attention in the fields of high-pressure physics due to the superconductivity properties deriving from the metallic-hydrogen-like characteristics and relatively mild synthesis conditions.However,their energetic performance and related potential applications are still open issues till now.In this study,CaH_(6)and NbH_(3),which exhibit evidently differences in their geometric and electronic structures,were chosen as examples of MSHCs to investigate their energetic performance.The structure,bonding features and energetic performance of CaH_(6)and NbH_(3)were predicted based on first-principles calculations.Our results reveal that high-pressure MSHCs always exhibit high energy densities.The range of theoretical energy density of CaH_(6)was predicted as 2.3-5.3 times of TNT,while the value for NbH_(3)was predicted as 1.2 times of TNT.Our study further uncover that CaH_(6)has outstanding energetic properties,which are ascribed to the three-dimensional(3D)aromatic H sublattice and the strong covalent bonding between the H atoms.Moreover,the detonation process and products of rapid energy-release stage of CaH_(6)were simulated via AIMD method,based on which its superior combustion performance was predicted and its specific impulse was calculated as 490.66 s.This study not only enhances the chemical understanding of MSHCs,but also extends the paradigm of traditional energetic materials and provides a new route to design novel high energy density materials.展开更多
Lithium-rich manganese-based cathodes(LRMs)have garnered significant attention as promising candidates for highenergy-density batteries due to their exceptional specific capacity exceeding 300 mAh/g,achieved through s...Lithium-rich manganese-based cathodes(LRMs)have garnered significant attention as promising candidates for highenergy-density batteries due to their exceptional specific capacity exceeding 300 mAh/g,achieved through synergistic anionic and cationic redox reactions.However,these materials face challenges including oxygen release-induced structural degradation and consequent capacity fading.To address these issues,strategies such as surface modification and bulk phase engineering have been explored.In this study,we developed a facile and cost-effective quenching approach that simultaneously modifies both surface and bulk characteristics.Multi-scale characterization and computational analysis reveal that rapid cooling partially preserves the high-temperature disordered phase in the bulk structure,thereby enhancing the structural stability.Concurrently,Li^(+)/H^(+)exchange at the surface forms a robust rock-salt/spinel passivation layer,effectively suppressing oxygen evolution and mitigating interfacial side reactions.This dual modification strategy demonstrates a synergistic stabilization effect.The enhanced oxygen redox activity coexists with the improved structural integrity,leading to superior electrochemical performance.The optimized cathode delivers an initial discharge capacity approaching 307.14 mAh/g at 0.1 C and remarkable cycling stability with 94.12%capacity retention after 200 cycles at 1 C.This study presents a straightforward and economical strategy for concurrent surface–bulk modification,offering valuable insights for designing high-capacity LRM cathodes with extended cycle life.展开更多
Ferrimagnets are important for next-generation high-density ultrafast spintronic device applications.Magnetization compensation temperature(TM)is a fundamentally critical magnetic parameter for ferrimagnets besides th...Ferrimagnets are important for next-generation high-density ultrafast spintronic device applications.Magnetization compensation temperature(TM)is a fundamentally critical magnetic parameter for ferrimagnets besides their Curie temperature.Around TM,the spin-orbit switching efficiencies are extraordinarily high.Therefore,the accurate manipulation of TM from the material fabrication process is essential for the electrical steering of ferrimagnetic spins.In this work,CoTb thin films,with the 3 d and 4 f magnetic sublattices antiferromagnetically coupled to each other,are deposited at different temperatures.The magnetotransport and magnetic properties of these films are systematically investigated.It was found that the TM of this rare-earth ferrimagnet largely depends on the growth temperature and it can be tuned by over 100 K.Accordingly,the spins of an optimized ferrimagnetic CoTb thin film with its TM close to room temperature can be efficiently switched by the current-pulse-induced spin-orbit torque.Moreover,an artificial neural network utilizing the spin-orbit torque device was constructed,demonstrating an image recognition accuracy of approximately 92.5%,which is comparable to that of conventional software solutions.Thus,this work demonstrates the large tunability of TM of a rare earth ferrimagnet by chemical ordering and the great potential of such a ferrimagnet for electrically operated spintronic devices.展开更多
Buried interface passivation is crucial for high-efficiency,stable perovskite solar cells(PSCs).Herein,we design a three-layer passivation structure toward the buried interface of inverted PSCs,consisting of NiO_(x),p...Buried interface passivation is crucial for high-efficiency,stable perovskite solar cells(PSCs).Herein,we design a three-layer passivation structure toward the buried interface of inverted PSCs,consisting of NiO_(x),poly(V-p-TPD)and PFN-Br(V-p-TPD,N,N'-di-p-tolyl-N,-N'-bis(4-vinylphenyl)-[1,1'-biphenyl]-4,4'-diamine;PFN-Br,poly[(9,9-bis(3'-((N,N-dimethyl)-N-ethylammonium)-propyl)-2,7-fluorene)-alt-2,7-(9,9-dioctylfluorene)]dibromide).Typically,in situ poly(V-p-TPD)layer on the NiO_(x) surface was obtained by a simple thermal crosslinking process.This poly(V-p-TPD)/NiO_(x) bilayer structure is beneficial for hole extraction and high-quality perovskite films with larger grain sizes and less lattice distortion.On this basis,the PFN-Br is further introduced as a surface modification layer,which can not only optimize the energy level alignment with the perovskite but also passivate defects and suppress carrier recombination at the perovskite bottom interface.Finally,inverted PSCs based on(FA_(0.95)Cs_(0.05))PbI_(3) present 25.5%efficiency with a low V_(OC)deficit.Besides,the devices could maintain 91.15%of the initial efficiency after being stored at 85℃for 1080 h,indicating excellent thermal stability.This work highlights the potential of a three-layered passivation structure based on crosslinking polymer HTLs for highly efficient and stable PSCs.展开更多
The intrinsic pressure framework,which treats self-propelling force as an external force,provides a convenient and consistent description of mechanical equilibrium in active matter.However,direct experimental evidence...The intrinsic pressure framework,which treats self-propelling force as an external force,provides a convenient and consistent description of mechanical equilibrium in active matter.However,direct experimental evidence is still lacking.To validate this framework,here we employ a programmable robotic platform,where a single light-controlled wheeled robot travels in an activity landscape.Our experiments quantitatively demonstrate that the intrinsic pressure difference across the activity interface is balanced by the emerged polarization force.This result unambiguously confirms the theoretical predictions,thus validating the intrinsic pressure framework and laying the experimental foundation for the intrinsic pressure-based mechanical description of dry active matter.展开更多
Based on the Smit-Suhl formula,we propose a universal approach for solving the magnon-magnon coupling problem in bilayer coupled systems(e.g.,antiferromagnets).This method requires only the energy expression,enabling ...Based on the Smit-Suhl formula,we propose a universal approach for solving the magnon-magnon coupling problem in bilayer coupled systems(e.g.,antiferromagnets).This method requires only the energy expression,enabling the automatic derivation of analytical expressions for the eigenmatrix elements via symbolic computation,eliminating the need for tedious manual calculations.Using this approach,we investigate the impact of magnetic hysteresis on magnon-magnon coupling in a system with interlayer Dzyaloshinskii-Moriya interaction(DMI).The magnetic hysteresis leads to an asymmetric magnetic field dependence of the resonance frequency and alters the number of degeneracy points between the pure optical and acoustic modes.Moreover,it can result in the coupling strength at the gap of the f–H phase diagram being nearly vanishing,contrary to the conventionally expected maximum.These results deepen the understanding of the effect of interlayer DMI on magnon–magnon coupling and the proposed universal method significantly streamlines the solving process of magnon–magnon coupling problems.展开更多
The magnetic properties and Kondo effect in Ce_(3)TiBi_(5) with a quasi-one-dimensional structure were investigated using in situ high-pressure resistivity measurements up to 48 GPa.At ambient pressure,Ce_(3)TiBi_(5) ...The magnetic properties and Kondo effect in Ce_(3)TiBi_(5) with a quasi-one-dimensional structure were investigated using in situ high-pressure resistivity measurements up to 48 GPa.At ambient pressure,Ce_(3)TiBi_(5) undergoes an antiferromagnetic(AFM)transition at T_(N)∼5 K.Under high pressures within 8.9 GPa,we find that Kondo scattering contributes differently to the high-temperature resistance,R(T),depending on the applied current direction,demonstrating a significantly anisotropic Kondo effect.The complete P–T phase diagram has been constructed,in which the pressure dependence of T_(N) exhibits a dome-like shape.The AFM order remains robust under pressure,even when the coherence temperature T^(*) far exceeds 300 K.We attribute the observed anisotropic Kondo effect and the robust AFM to the underlying anisotropy in electronic hybridization under high pressure.展开更多
We report a comprehensive investigation of the superconducting properties of the mineral superconductor covellite(Cu S)using high-quality single crystals.First,we establish that Cu S is an intrinsic type-Ⅱsuperconduc...We report a comprehensive investigation of the superconducting properties of the mineral superconductor covellite(Cu S)using high-quality single crystals.First,we establish that Cu S is an intrinsic type-Ⅱsuperconductor,correcting its long-standing classification as type-Ⅰ.Second,a complete set of anisotropic superconducting parameters is determined,including the critical fields,penetration depth and coherence length,which yield a Ginzburg–Landau parameterκ~1.5 and a moderate anisotropy ofγ~2.Our results indicate that this type-Ⅱsuperconductivity can be well-described by a conventional,weak-coupling,single-band s-wave pairing mechanism.This work fills a long-standing gap in the understanding of this archetypal superconductor.展开更多
基金supported by the Science Center of the National Natural Science Foundation of China(Grant No.12188101)the National Natural Science Foundation of China(Grant Nos.12274436 and 11921004)+1 种基金the National Key R&D Program of China(Grant Nos.2023YFA1607400 and 2022YFA1403800)support from the New Cornerstone Science Foundation through the XPLORER PRIZE。
文摘Modern materials science generates vast and diverse datasets from both experiments and computations,yet these multi-source,heterogeneous data often remain disconnected in isolated“silos”.Here,we introduce MaterialsGalaxy,a comprehensive platform that deeply fuses experimental and theoretical data in condensed matter physics.Its core innovation is a structure similarity-driven data fusion mechanism that quantitatively links cross-modal records—spanning diffraction,crystal growth,computations,and literature—based on their underlying atomic structures.The platform integrates artificial intelligence(AI)tools,including large language models(LLMs)for knowledge extraction,generative models for crystal structure prediction,and machine learning property predictors,to enhance data interpretation and accelerate materials discovery.We demonstrate that MaterialsGalaxy effectively integrates these disparate data sources,uncovering hidden correlations and guiding the design of novel materials.By bridging the long-standing gap between experiment and theory,MaterialsGalaxy provides a new paradigm for data-driven materials research and accelerates the discovery of advanced materials.
基金supported by the National Key Research and Development Program of China(Grant No.2021YFA1400200)the National Natural Science Foundation of China(Grant Nos.12025407,92250303,and 11934003)+3 种基金Chinese Academy of Sciences(Grant Nos.YSBR047 and XDB330301)financial support from the National Science Fund for Distinguished Young Scholars(Grant No.12304096)China Postdoctoral Science Foundation(Grant No.2022TQ0362)Special Research Assistant of Chinese Academy of Sciences Foundation。
文摘Our understanding of how photons couple to different degrees of freedom in solids forms the bedrock of ultrafast physics and materials sciences.In this review,the emergent ultrafast dynamics in condensed matter at the attosecond timescale have been intensively discussed.In particular,the focus is put on recent developments of attosecond dynamics of charge,exciton,and magnetism.New concepts and indispensable role of interactions among multiple degrees of freedom in solids are highlighted.Applications of attosecond electronic metrology and future prospects toward attosecond dynamics in condensed matter are further discussed.These pioneering studies promise future development of advanced attosecond science and technology such as attosecond lasers,laser medical engineering,and ultrafast electronic devices.
基金supported by the National Natural Science Foundation of China under Grant No.12475204.
文摘Deep learning combining the physics information is employed to solve the Boussinesq equation with second-order time derivative.High prediction accuracies are achieved by adding a new initial loss term in the physics-informed neural networks along with the adaptive activation function and loss-balanced coefficients.The numerical simulations are carried out with different initial and boundary conditions,in which the relative L2-norm errors are all around 10^(−4).The prediction accuracies have been improved by two orders of magnitude compared to the former results in certain simulations.The dynamic behavior of solitons and their interaction are studied in the colliding and chasing processes for the Boussinesq equation.More training time is needed for the solver of the Boussinesq equation when the width of the two-soliton solutions becomes narrower with other parameters fixed.
基金supported by the National Natural Science Foundation of China(Grant Nos.52171169 and 52101210)the National Key Research and Development Program of China(Grant No.2021YFB3501204)+3 种基金the State Key Laboratory for Advanced Metals and Materials(Grant No.2023-ZD01)USTB Concept Verification Funding Project(Grant No.GNYZ-2024-6)Fundamental Research Funds for the Central Universities(Grant No.FRF-TP-24-004A)USTB Research Center for International People-to-people Exchange in Science,Technology and Civilization(Grant Nos.2024KFZD001 and 2024KFYB004)。
文摘Thermomagnetic generation(TMG),a heat-to-electricity conversion technology based on the thermomagnetic effect,offers high reliability and broad adaptability to diverse heat sources.By exploiting the temperature-dependent magnetization of thermomagnetic materials,TMG converts thermal energy into electrical energy through cyclic changes in magnetic flux based on Faraday's law.The performance of TMG systems is largely governed by the intrinsic properties of the working materials and the design of device architecture.Ideal TMG materials exhibit sharp and reversible magnetization transitions near the operating temperature,low thermal hysteresis,and high thermal conductivity.Device configurations can be broadly categorized into active and passive systems:active TMG devices rely on controlled thermal cycling and optimized magnetic circuits for enhanced output,whereas passive devices utilize self-actuated mechanical motion to generate electricity.In this topical review,we provide a comprehensive overview of recent advances in TMG materials and device configurations.Furthermore,we discuss future development trends and offer perspectives on experimental strategies to advance this field.
基金supported by the National Key R&D Program of China(Grant No.2021YFA1400300)the Guangdong Basic and Applied Basic Research Foundation(Grant No.2022A1515111009)the National Natural Science Foundation of China(Grant Nos.12425403,12261131499,52273298)。
文摘Accessing the milli-Kelvin regime is increasingly important for next-generation quantum technologies and deep-space observations.Among established cryogenic techniques,adiabatic demagnetization refrigeration(ADR)is distinctive for its all-solid-state design,low vibration,and intrinsic gravity independence.Here we present a materials-centered review of ADR refrigerants,connecting classical thermodynamics to modern quantum many-body behavior.Beyond hydrated paramagnetic salts,dense rare-earth oxides and correlated-disorder ceramics,we highlight emerging quantum-engineered refrigerants,including geometrically frustrated magnets,and quantum-critical systems.In these materials,suppressing long-range order and tailoring low-energy excitations redistribute spin entropy into the sub-Kelvin window,enabling large and reversible entropy changes at the lowest accessible temperatures.We discuss the central trade-offs among volumetric entropy density,thermal transport,and magnetic ordering,and outline possible design rules for staged ADR architectures.
基金Project supported in part by the Equipment Development Project for Scientific Research of the Chinese Academy of Sciences(Grant No.YJKYYQ20190049)the Innovation Program for Quantum Science and Technology(Grant No.2021ZD0301800)the National Key R&D Program of China(Grant No.2022YFA1603904)。
文摘The haloscope based on the TM_(010)mode cavity is a well-established technique for detecting QCD axions.However,the method has limitations in detecting high-mass axion due to significant volume loss in the high-frequency cavity.Utilizing a higher-order mode cavity can effectively reduce the volume loss of the high-frequency cavity.The rotatable dielectric pieces as a tuning mechanism can compensate for the degradation of the form factor of the higher-order mode.Nevertheless,the introduction of dielectric causes additional volume loss.To address these issues,this paper proposes a novel design scheme by adding a central metal rod to the higher-order mode cavity tuned by dielectrics,which improves the performance of the haloscope due to the increased effective volume of the cavity detector.The superiority of the novel design is demonstrated by comparing its simulated performance with previous designs.Moreover,the feasibility of the scheme is verified by the full-wave simulation results of the mechanical design model.
基金supported by the National Key R&D Program of China(No.2022YFB2404400)the National Natural Science Foundation of China(Nos.U23A20577,52372168,92263206 and 21975006)+1 种基金the“The Youth Beijing Scholars program”(No.PXM2021_014204_000023)the Beijing Natural Science Foundation(Nos.2222001 and KM202110005009).
文摘The cobalt-free Mn-based Li-rich layered oxide material has the advantages of low cost,high energy density,and good performance at low temperatures,and is the promising choice for energy storage batteries.However,the long-cycling stability of batteries needs to be improved.Herein,the Mn-based Li-rich cathode materials with small amounts of Li2 MnO3 crystal domains and gradient doping of Al and Ti elements from the surface to the bulk have been developed to improve the structure and interface stability.Then the batteries with a high energy density of 600 Wh kg^(-1),excellent capacity retention of 99.7%with low voltage decay of 0.03 mV cycle^(-1) after 800 cycles,and good rates performances can be achieved.Therefore,the structure and cycling stability of low voltage Mn-based Li-rich cathode materials can be significantly improved by the bulk structure design and interface regulation,and this work has paved the way for developing low-cost and high-energy Mn-based energy storage batteries with long lifetime.
基金supported by the National Key Research and Development Program of China(Grant No.2022YFB2502200)the National Natural Science Foundation of China(NSFC nos.52172257 and 22409211)+2 种基金the China Postdoctoral Science Foundation(No.2023M743739)the Postdoctoral Fellowship Program of CPSF(No.GZC20232939)CAS Youth Interdisciplinary Team。
文摘Silicon(Si)is a promising anode material for rechargeable batteries due to its high theoretical capacity and abundance,but its practical application is hindered by the continuous growth of porous solid-electrolyte interphase(SEI),leading to capacity fade.Herein,a LiF-Pie structured SEI is proposed,with LiF nanodomains encapsulated in the inner layer of the organic cross-linking silane matrix.A series of advanced techniques such as cryogenic electron microscopy,time-of-flight secondary ion mass spectrometry,and matrix-assisted laser desorption/ionization time-of-flight mass spectrometry have provided detailed insights into the formation mechanism,nanostructure,and chemical composition of the interface.With such SEI,the capacity retention of LiCoO_(2)||Si is significantly improved from 49.6%to 88.9%after 300 cycles at 100 mA g^(-1).These findings provide a desirable interfacial design principle with enhanced(electro)chemical and mechanical stability,which are crucial for sustaining Si anode functionality,thereby significantly advancing the reliability and practical application of Si-based anodes.
基金supported by the National Key R&D Program of China(Grant Nos.2024YFA1408400 and 2021YFA1400401)the National Natural Science Foundation of China(Grant Nos.U22A6005 and 52271238)+2 种基金the China Postdoctoral Science Foundation(Grant No.2025M770186)the Center for Materials Genome,and the Synergetic Extreme Condition User Facility(SECUF)supported by the AI-driven experiments,simulations and model training on the robotic AI-Scientist platform from Chinese Academy of Sciences and the Research Funds for the Central Universities(Grant No.N25ZLE007).
文摘Low-dimensional physics provides profound insights into strongly correlated interactions,leading to enhancedquantum effects and the emergence of exotic quantum states.The Ln_(3)ScBi_(5)family stands out as a chemicallyversatile kagome platform with mixed low-dimensional structural framework and tunable physical properties.Ourresearch initiates with a comprehensive evaluation of the currently known Ln_(3)ScBi_(5)(Ln=La-Nd,Sm)materials,providing a robust methodology for assessing their stability frontiers within this system.Focusing on Pr_(3)ScBi_(5),we investigate the influence of the zigzag chains of quasi-one-dimensional(Q1D)motifs and the distorted kagomelayers of quasi-two-dimensional(Q2D)networks in the mixed-dimensional structure on the intricate magneticground states and unique spin fluctuations.Our study reveals that the noncollinear antiferromagnetic(AFM)moments of Pr^(3+)ions are confined within the Q2D kagome planes,displaying minimal in-plane anisotropy.Incontrast,a strong AFM coupling is observed within the Q1D zigzag chains,significantly constraining spin motion.Notably,magnetic frustration is partially a consequence of coupling to conduction electrons via Ruderman-Kittel-Kasuya-Yosida interaction,highlighting a promising framework for future investigations into mixed-dimensional frustration in Ln_(3)ScBi_(5) systems.
基金supported by the National Key Research and Development Program(Grant Nos.2024YFA1611200 and 2023YFA1406500)the National Natural Science Foundation of China(Grant Nos.12141002 and 52088101)the Strategic Priority Research Program of the Chinese Academy of Sciences(Grant No.XDB1270000)。
文摘Rare-earth based frustrated magnets have attracted great attention as excellent candidates for magnetic refrigeration at sub-Kelvin temperatures,while the experimental identification of systems exhibiting both large volumetric cooling capacity and reduced working temperatures far below 1K remains a challenge.Here,through ultra-low temperature magnetism and thermodynamic characterizations,we unveil the large magnetocaloric effect(MCE)realized at sub-Kelvin temperatures in the frustrated Kagome antiferromagnet Gd_(3)BWO_(9) with T_(N)∼1.0 K.The isothermal magnetization curves indicate the existence of field(B)induced anisotropic magnetic phase diagrams,where four distinct magnetic phases for B‖c-axis and five magnetic phases for B‖ab-plane are identified at T<T_(N).The analysis of magnetic entropy S(B,T)data and direct adiabatic demagnetization tests reveal remarkable cooling performance at sub-Kelvin temperatures featured by a large volumetric entropy density of 502.2 mJ/K/cm^(3)and a low attainable minimal temperature T_(min)∼168mK from the initial cooling condition of 2K and 6 T,surpassing most Gd-based refrigerants previously documented in temperature ranges of 0.25–4 K.The realized T_(min)∼168mK far below T_(N)∼1.0K in Gd_(3)BWO_(9) is related to the combined effects of magnetic frustration and criticality-enhanced MCE,which together leave substantial magnetic entropy at reduced temperatures by enhancing spin fluctuations.
基金supported by the High-level Talent Research Start-up Project Funding of Henan Academy of Sciences(Project No.241827012)the National Natural Science Foundation of China(Grant Nos.U22A6005 and 62271450)+1 种基金the National Key Research and Development Program of China(Grant Nos.2021YFA1301502,2024YFA1408701,and 2024YFA1408403)the Synergetic Extreme Condition User Facility(SECUF,https://cstr.cn/31123.02.SECUF)。
文摘The precise control of wrinkles and strain gradients in nanofilm is of significant interest due to their profound influence on electronic band structures and spin states.Here,we employ ultrafast electron diffraction(UED)to study the picosecond-scale dynamics of laser-induced bending in 2H-MoTe2 thin films.
基金supported by the Science Center of the National Natural Science Foundation of China(Grant No.12188101)the National Key R&D Program of China(Grant Nos.2023YFA1607400 and 2022YFA1403800)+2 种基金the National Natural Science Foundation of China(Grant Nos.12274436,11925408,and 11921004)the New Cornerstone Science Foundation through the XPLORER PRIZEperformed on the robotic AI-Scientist platform of the Chinese Academy of Science.
文摘Density-functional-theory(DFT)simulations with the Vienna Ab initio Simulation Package(VASP)are indispensable in computational materials science but often require extensive manual setup,monitoring,and postprocessing.Here,we introduce VASPilot,an open-source platform that fully automates VASP workflows via a multi-agent architecture built on the CrewAI framework and a standardized model context protocol(MCP).VASPilot’s agent suite handles every stage of a VASP study from retrieving crystal structures and generating input files to submitting Slurm jobs,parsing error messages,and dynamically adjusting parameters for seamless restarts.A lightweight Quart-based web interface provides intuitive task submission,real-time progress tracking,and drill-down access to execution logs,structure visualizations,and plots.We validated VASPilot on both routine and advanced benchmarks:automated band-structure and density-of-states calculations(including on-the-fly symmetry corrections),plane-wave cutoff convergence tests,lattice-constant optimizations with various van der Waals corrections,and cross-material band-gap comparisons for transition-metal dichalcogenides.In all cases,VASPilot completed the missions reliably and without manual intervention.Moreover,its modular design allows easy extension to other DFT codes simply by deploying the appropriate MCP server.By offloading technical overhead,VASPilot enables researchers to focus on scientific discovery and accelerates high-throughput computational materials research.
文摘Metal superhydride compounds(MSHCs)have attracted much attention in the fields of high-pressure physics due to the superconductivity properties deriving from the metallic-hydrogen-like characteristics and relatively mild synthesis conditions.However,their energetic performance and related potential applications are still open issues till now.In this study,CaH_(6)and NbH_(3),which exhibit evidently differences in their geometric and electronic structures,were chosen as examples of MSHCs to investigate their energetic performance.The structure,bonding features and energetic performance of CaH_(6)and NbH_(3)were predicted based on first-principles calculations.Our results reveal that high-pressure MSHCs always exhibit high energy densities.The range of theoretical energy density of CaH_(6)was predicted as 2.3-5.3 times of TNT,while the value for NbH_(3)was predicted as 1.2 times of TNT.Our study further uncover that CaH_(6)has outstanding energetic properties,which are ascribed to the three-dimensional(3D)aromatic H sublattice and the strong covalent bonding between the H atoms.Moreover,the detonation process and products of rapid energy-release stage of CaH_(6)were simulated via AIMD method,based on which its superior combustion performance was predicted and its specific impulse was calculated as 490.66 s.This study not only enhances the chemical understanding of MSHCs,but also extends the paradigm of traditional energetic materials and provides a new route to design novel high energy density materials.
基金supported by the National Key Research and Development Program of China(Grant No.2022YFB2502200)the National Natural Science Foundation of China(Grant Nos.52325207,22239003,and 22393904).
文摘Lithium-rich manganese-based cathodes(LRMs)have garnered significant attention as promising candidates for highenergy-density batteries due to their exceptional specific capacity exceeding 300 mAh/g,achieved through synergistic anionic and cationic redox reactions.However,these materials face challenges including oxygen release-induced structural degradation and consequent capacity fading.To address these issues,strategies such as surface modification and bulk phase engineering have been explored.In this study,we developed a facile and cost-effective quenching approach that simultaneously modifies both surface and bulk characteristics.Multi-scale characterization and computational analysis reveal that rapid cooling partially preserves the high-temperature disordered phase in the bulk structure,thereby enhancing the structural stability.Concurrently,Li^(+)/H^(+)exchange at the surface forms a robust rock-salt/spinel passivation layer,effectively suppressing oxygen evolution and mitigating interfacial side reactions.This dual modification strategy demonstrates a synergistic stabilization effect.The enhanced oxygen redox activity coexists with the improved structural integrity,leading to superior electrochemical performance.The optimized cathode delivers an initial discharge capacity approaching 307.14 mAh/g at 0.1 C and remarkable cycling stability with 94.12%capacity retention after 200 cycles at 1 C.This study presents a straightforward and economical strategy for concurrent surface–bulk modification,offering valuable insights for designing high-capacity LRM cathodes with extended cycle life.
基金financial support from the National Key R&D Program of China(Nos.2022YFB3506000 and 2022YFA1602700)financial support from Fundamental Research Funds for the Central Universities+6 种基金financial support from the National Natural Science Foundation of China(Nos.52425106,52121001,and 52271235)financial support from the Beijing Natural Science Foundation(No.JQ23005)financial support from the National Natural Science Foundation of China(No.52401300)funding from the China National Postdoctoral Program for Innovative Talents(No.BX20230451)from the China Postdoctoral Science Foundation(No.2024M754058)financial support from the National Natural Science Foundation of China(No.62401276)financial support from the National Natural Science Foundation of China(No.524B2003).
文摘Ferrimagnets are important for next-generation high-density ultrafast spintronic device applications.Magnetization compensation temperature(TM)is a fundamentally critical magnetic parameter for ferrimagnets besides their Curie temperature.Around TM,the spin-orbit switching efficiencies are extraordinarily high.Therefore,the accurate manipulation of TM from the material fabrication process is essential for the electrical steering of ferrimagnetic spins.In this work,CoTb thin films,with the 3 d and 4 f magnetic sublattices antiferromagnetically coupled to each other,are deposited at different temperatures.The magnetotransport and magnetic properties of these films are systematically investigated.It was found that the TM of this rare-earth ferrimagnet largely depends on the growth temperature and it can be tuned by over 100 K.Accordingly,the spins of an optimized ferrimagnetic CoTb thin film with its TM close to room temperature can be efficiently switched by the current-pulse-induced spin-orbit torque.Moreover,an artificial neural network utilizing the spin-orbit torque device was constructed,demonstrating an image recognition accuracy of approximately 92.5%,which is comparable to that of conventional software solutions.Thus,this work demonstrates the large tunability of TM of a rare earth ferrimagnet by chemical ordering and the great potential of such a ferrimagnet for electrically operated spintronic devices.
基金financial support from the Ministry of Science and Technology of China(2021YFB3800103)Natural Science Foundation of China(U24A6003,52361145847,52172260,52227803,52222212)Chinese Academy of Sciences-Commonwealth Scientific and Industrial Research Organization(CAS-CSIRO)Joint Project(112111KYSB20210017)。
文摘Buried interface passivation is crucial for high-efficiency,stable perovskite solar cells(PSCs).Herein,we design a three-layer passivation structure toward the buried interface of inverted PSCs,consisting of NiO_(x),poly(V-p-TPD)and PFN-Br(V-p-TPD,N,N'-di-p-tolyl-N,-N'-bis(4-vinylphenyl)-[1,1'-biphenyl]-4,4'-diamine;PFN-Br,poly[(9,9-bis(3'-((N,N-dimethyl)-N-ethylammonium)-propyl)-2,7-fluorene)-alt-2,7-(9,9-dioctylfluorene)]dibromide).Typically,in situ poly(V-p-TPD)layer on the NiO_(x) surface was obtained by a simple thermal crosslinking process.This poly(V-p-TPD)/NiO_(x) bilayer structure is beneficial for hole extraction and high-quality perovskite films with larger grain sizes and less lattice distortion.On this basis,the PFN-Br is further introduced as a surface modification layer,which can not only optimize the energy level alignment with the perovskite but also passivate defects and suppress carrier recombination at the perovskite bottom interface.Finally,inverted PSCs based on(FA_(0.95)Cs_(0.05))PbI_(3) present 25.5%efficiency with a low V_(OC)deficit.Besides,the devices could maintain 91.15%of the initial efficiency after being stored at 85℃for 1080 h,indicating excellent thermal stability.This work highlights the potential of a three-layered passivation structure based on crosslinking polymer HTLs for highly efficient and stable PSCs.
基金supported by the National Natural Science Foundation of China (Grant Nos.T2325027,12274448,T2350007,12404239,12174041,12325405,12090054,and T2221001)the National Key R&D Program of China (Grant No.2022YFF0503504)。
文摘The intrinsic pressure framework,which treats self-propelling force as an external force,provides a convenient and consistent description of mechanical equilibrium in active matter.However,direct experimental evidence is still lacking.To validate this framework,here we employ a programmable robotic platform,where a single light-controlled wheeled robot travels in an activity landscape.Our experiments quantitatively demonstrate that the intrinsic pressure difference across the activity interface is balanced by the emerged polarization force.This result unambiguously confirms the theoretical predictions,thus validating the intrinsic pressure framework and laying the experimental foundation for the intrinsic pressure-based mechanical description of dry active matter.
基金supported by the National Key Research and Development Program of China (MOST)(Grant No.2022YFA1402800)the Chinese Academy of Sciences (CAS) Presidents International Fellowship Initiative (PIFI)(Grant No.2025PG0006)+3 种基金the National Natural Science Foundation of China (NSFC)(Grant Nos.51831012,12274437,and 52161160334)the CAS Project for Young Scientists in Basic Research (Grant No.YSBR-084)the CAS Youth Interdisciplinary Teamthe China Postdoctoral Science Foundation (Grant No.2025M773402)。
文摘Based on the Smit-Suhl formula,we propose a universal approach for solving the magnon-magnon coupling problem in bilayer coupled systems(e.g.,antiferromagnets).This method requires only the energy expression,enabling the automatic derivation of analytical expressions for the eigenmatrix elements via symbolic computation,eliminating the need for tedious manual calculations.Using this approach,we investigate the impact of magnetic hysteresis on magnon-magnon coupling in a system with interlayer Dzyaloshinskii-Moriya interaction(DMI).The magnetic hysteresis leads to an asymmetric magnetic field dependence of the resonance frequency and alters the number of degeneracy points between the pure optical and acoustic modes.Moreover,it can result in the coupling strength at the gap of the f–H phase diagram being nearly vanishing,contrary to the conventionally expected maximum.These results deepen the understanding of the effect of interlayer DMI on magnon–magnon coupling and the proposed universal method significantly streamlines the solving process of magnon–magnon coupling problems.
基金supported by the National Key Research and Development Program of Chinathe National Natural Science Foundation of China (Grant Nos.2024YFA1408000,12474097,and2023YFA1406001)+2 种基金the Guangdong Provincial Quantum Science Strategic Initiative (Grant No.GDZX2201001)the Center for Computational Science and Engineering at Southern University of Science and Technology,the Major Science and Technology Infrastructure Project of Material Genome Big-science Facilities Platform supported by Municipal Development and Reform Commission of Shenzhen(for J.L.Z.and Y.L.)the Chinese funding sources applied via HPSTAR。
文摘The magnetic properties and Kondo effect in Ce_(3)TiBi_(5) with a quasi-one-dimensional structure were investigated using in situ high-pressure resistivity measurements up to 48 GPa.At ambient pressure,Ce_(3)TiBi_(5) undergoes an antiferromagnetic(AFM)transition at T_(N)∼5 K.Under high pressures within 8.9 GPa,we find that Kondo scattering contributes differently to the high-temperature resistance,R(T),depending on the applied current direction,demonstrating a significantly anisotropic Kondo effect.The complete P–T phase diagram has been constructed,in which the pressure dependence of T_(N) exhibits a dome-like shape.The AFM order remains robust under pressure,even when the coherence temperature T^(*) far exceeds 300 K.We attribute the observed anisotropic Kondo effect and the robust AFM to the underlying anisotropy in electronic hybridization under high pressure.
基金supported by the National Key Research and Development Program of China(Grant Nos.2024YFA1611102,2022YFA1403903,2022YFA1602802,and 2023YFA1406101)the National Natural Science Foundation of China(Grant No.12304075)CAS Project for Young Scientists in Basic Research(Grant No.2022YSBR-048)。
文摘We report a comprehensive investigation of the superconducting properties of the mineral superconductor covellite(Cu S)using high-quality single crystals.First,we establish that Cu S is an intrinsic type-Ⅱsuperconductor,correcting its long-standing classification as type-Ⅰ.Second,a complete set of anisotropic superconducting parameters is determined,including the critical fields,penetration depth and coherence length,which yield a Ginzburg–Landau parameterκ~1.5 and a moderate anisotropy ofγ~2.Our results indicate that this type-Ⅱsuperconductivity can be well-described by a conventional,weak-coupling,single-band s-wave pairing mechanism.This work fills a long-standing gap in the understanding of this archetypal superconductor.
