Two-dimensional(2D)multilayer kagome materials hold significant research value for regulating kagome-related physical properties and exploring quantum effects.However,their development is hindered by the scarcity of a...Two-dimensional(2D)multilayer kagome materials hold significant research value for regulating kagome-related physical properties and exploring quantum effects.However,their development is hindered by the scarcity of available material systems,making the identification of novel 2D multilayer kagome candidates particularly important.In this work,three types of 2D materials with trilayer kagome lattices,namely Sc_(6)S_(5)X_(6)(X=Cl,Br,I),are predicted based on first-principles calculations.These 2D materials feature two kagome lattices composed of Sc atoms and one kagome lattice composed of S atoms.Stability analysis indicates that these materials can exist as free-standing 2D materials.Electronic structure calculations reveal that Sc_(6)S_(5)X_(6)are narrow-bandgap semiconductors(0.76–0.95 e V),with their band structures exhibiting flat bands contributed by Sc-based kagome lattices and Dirac band gaps resulting from symmetry breaking.The sulfur-based kagome lattice in the central layer contributes an independent flat band below the Fermi level.Additionally,Sc_(6)S_(5)X_(6)exhibit high carrier mobility,with hole and electron mobilities reaching up to 10^(3)cm^(2)·V^(-1)·s^(-1),indicating potential applications in low-dimensional electronic devices.This work provides an excellent example for the development of novel multilayer 2D kagome materials.展开更多
Multiferroic tunnel junctions(MFTJs),which combine tunneling magnetoresistance(TMR)and electroresistance(TER)efects,have emerged as key candidates for data storage.Two-dimensional van der Waals(vdW)MFTJs,in particular...Multiferroic tunnel junctions(MFTJs),which combine tunneling magnetoresistance(TMR)and electroresistance(TER)efects,have emerged as key candidates for data storage.Two-dimensional van der Waals(vdW)MFTJs,in particular,are promising spintronic devices for the post-Moore era.However,these vdW MFTJs are typically based on multiferroics composed of ferromagnetic and ferroelectric materials or multilayer magnetic materials with sliding ferroelectricity,which increases device fabrication complexity.In this work,we design a vdW MFTJ using bilayer MoPtGe_(2)S_(6),a material with homologous multiferroicity in each monolayer,combined with symmetric PtTe_(2)electrodes.Using frst-principles calculations based on density functional theory and nonequilibrium Green's functions,we theoretically explore the spin-polarized electronic transport properties of this MFTJ.By controlling the ferroelectric and ferromagnetic polarization directions of bilayer MoPtGe_(2)S_(6),the MFTJ can exhibit six distinct non-volatile resistance states,with maximum TMR(137%)and TER(1943%)ratios.Under biaxial strain,TMR and TER can increase to 265%and 4210%,respectively.The TER ratio also increases to 2186%under a 0.1 V bias voltage.Remarkably,the MFTJ exhibits a pronounced spin-fltering and a signifcant negative diferential resistance efect.These fndings not only highlight the potential of monolayer multiferroic MoPtGe_(2)S_(6)for MFTJs but also ofer valuable theoretical insights for future experimental investigations.展开更多
In recent years,there has been a surge of interest in higher-order topological phases(HOTPs)across various disciplines within the field of physics.These unique phases are characterized by their ability to harbor topol...In recent years,there has been a surge of interest in higher-order topological phases(HOTPs)across various disciplines within the field of physics.These unique phases are characterized by their ability to harbor topological protected boundary states at lower-dimensional boundaries,a distinguishing feature that sets them apart from conventional topological phases and is attributed to the higher-order bulk-boundary correspondence.Two-dimensional(2D)twisted systems offer an optimal platform for investigating HOTPs,owing to their strong controllability and experimental feasibility.Here,we provide a comprehensive overview of the latest research advancements on HOTPs in 2D twisted multilayer systems.We will mainly review the HOTPs in electronic,magnonic,acoustic,photonic and mechanical twisted systems,and finally provide a perspective of this topic.展开更多
Based on the theoretical representation of piezoelectric quasicrystal,a generalized dynamic model is built to represent the transmission of wave aspects in surface acoustic pulse nano-devices.Surface elasticity,surfac...Based on the theoretical representation of piezoelectric quasicrystal,a generalized dynamic model is built to represent the transmission of wave aspects in surface acoustic pulse nano-devices.Surface elasticity,surface piezoelectricity,and surface permittivity help to include the surface effect,which equals additional thin sheets.It is shown that,under certain assumptions,this generalized dynamic model may be simplified to a few classical examples that are appropriate for both macro and nano-scale applications.In the current work,surface piezoelectricity is used to develop a theoretical model for shear horizontal(SH)waves where it contains the surface piezoelectricity theory and a linear spring model to quantitatively and qualitatively explore SH waves in an orthotropic piezoelectric quasicrystal layer overlying an elastic framework(Model I),a piezoelectric quasi-crystal nano substrate,and an orthotropic piezoelectric quasicrystal half-space(Model II).The theoretical model stimulates the numerical results,which establish the critical thickness.As the piezoelectric layer’s thickness gets closer to nanometres,surface energy must be included when analyzing dispersion properties.Furthermore,the effects of surface elasticity and density on wave velocity are investigated individually.The authors establish a parameter,precisely the ratio of the physical modulus along the width direction to along the direction of wave travel.The surface effect’s impact on the general char-acteristics of piezoelectric structures is seen as a spring force acting on bulk boundaries.Analytical presentation of frequency equations for both symmetric and anti-symmetric waves pertains to the case of an electrical short circuit in Model II.The project aims to analyze SH waves in orthogonal anisotropic,transversely isotropic piezoelectric layered nanostructures,providing a practical mathematical tool for surface effects analysis and adaptability to other wave types,including Rayleigh waves and acoustic surface waves.展开更多
Tin dioxide(SnO_(2))with a high theoretical specific capacity of 1494 mAh g^(-1)is a promising candidate anode material for lithium storage.However,the shortcomings of serious volume expansion and low conductivity lim...Tin dioxide(SnO_(2))with a high theoretical specific capacity of 1494 mAh g^(-1)is a promising candidate anode material for lithium storage.However,the shortcomings of serious volume expansion and low conductivity limit its wide application.Herein,coaxial nano-multilayered C/SnO_(2)/TiO_(2)composites were fabricated via layerby-layer self-assembly of TiO_(2)and SnO_(2)-gel layers on the natural cellulose filter paper,followed by thermal treatment under a nitrogen atmosphere.Through engineering design of the assembly process,the optimal C/SinO_(2)/TiO_(2)composite features five alternating SnO_(2)and TiO_(2)nanolayers,with TiO_(2)as the outside shell(denoted as C/TSTST).This unique structure endows the C/TSTST with excellent structural stability and electrochemical kinetics,making it a high-performance anode for lithium-ion batteries(LIBs).The C/TSTST composite delivers a high reversible capacity of 676 mAh g^(-1)at 0.1 A g^(-1)after 200 cycles and retains a capacity of 504 mAh g^(-1)at 1.0 A g^(-1),which can be recovered to 781 mAh g^(-1)at 0.1 A g^(-1)The significantly enhanced electrochemical performance is attributed to the hierarchical hybrid structure,where the carbon core combined with coaxial TiO_(2)nanolayers serves as a structural scaffold,ameliorating volume change of SnO_(2)while creating abundant interfacial defects for enhanced lithium storage and rapid charge transport.These findings are further demonstrated by the density functional theory(DFT)calculations.This work provides an efficient strategy for designing coaxial nano-multilayered transition metal oxide-related electrode materials,offering new insights into high-performance LIBs anodes.展开更多
In this paper,we investigate the interfacial behavior of a thin,penny-shaped,one-dimensional(1D)hexagonal functionally graded(FG)piezoelectric quasicrystal(PQC)film bonded on a temperature-dependent elastic substrate ...In this paper,we investigate the interfacial behavior of a thin,penny-shaped,one-dimensional(1D)hexagonal functionally graded(FG)piezoelectric quasicrystal(PQC)film bonded on a temperature-dependent elastic substrate under thermal and electrical loads.The problem is modeled as axisymmetric based on the membrane theory,with the peeling stress and bending moment being disregarded.A potential theory method,combined with the Hankel transform technique,is utilized to derive the displacement field on the substrate surface.With perfect interfacial bonding assumption,an integral equation governing the phonon interfacial shear stress is formulated and numerically solved by the Chebyshev polynomials.Explicit expressions are derived for the interfacial shear stress,the internal stresses within the PQC film and the substrate,the axial strain,and the stress intensity factors(SIFs).Numerical simulations are conducted to investigate the effects of the film's aspect ratio,material inhomogeneity,material mismatch,and temperature-dependent material properties on its mechanical response.The results provide insights for the functional design and reliability assessment of FG PQC film/substrate systems.展开更多
In this study,the nonlocal strain gradient theory is adopted to investigate the static bending deformation of a functionally graded(FG)multilayered nanoplate made of onedimensional hexagonal piezoelectric quasicrystal...In this study,the nonlocal strain gradient theory is adopted to investigate the static bending deformation of a functionally graded(FG)multilayered nanoplate made of onedimensional hexagonal piezoelectric quasicrystal(PQC)materials subjected to mechanical and electrical surface loadings.The FG materials are assumed to be exponential distribution along the thickness direction.Exact closed-form solutions of an FG PQC nanoplate including nonlocality and strain gradient micro-size dependency are derived by utilizing the pseudo-Stroh formalism.The propagator matrix method is further used to solve the multilayered case by assuming that the layer interfaces are perfectly contacted.Numerical examples for two FG sandwich nanoplates made of piezoelectric crystals and PQC are provided to show the influences of nonlocal parameter,strain gradient parameter,exponential factor,length-to-width ratio,loading form,and stacking sequence on the static deformation of two FG sandwich nanoplates,which play an important role in designing new smart composite structures in engineering.展开更多
基金supported by the Fundamental Research Funds for the Central Universities(WUT:2024IVA052 and Grant No.104972025KFYjc0089)。
文摘Two-dimensional(2D)multilayer kagome materials hold significant research value for regulating kagome-related physical properties and exploring quantum effects.However,their development is hindered by the scarcity of available material systems,making the identification of novel 2D multilayer kagome candidates particularly important.In this work,three types of 2D materials with trilayer kagome lattices,namely Sc_(6)S_(5)X_(6)(X=Cl,Br,I),are predicted based on first-principles calculations.These 2D materials feature two kagome lattices composed of Sc atoms and one kagome lattice composed of S atoms.Stability analysis indicates that these materials can exist as free-standing 2D materials.Electronic structure calculations reveal that Sc_(6)S_(5)X_(6)are narrow-bandgap semiconductors(0.76–0.95 e V),with their band structures exhibiting flat bands contributed by Sc-based kagome lattices and Dirac band gaps resulting from symmetry breaking.The sulfur-based kagome lattice in the central layer contributes an independent flat band below the Fermi level.Additionally,Sc_(6)S_(5)X_(6)exhibit high carrier mobility,with hole and electron mobilities reaching up to 10^(3)cm^(2)·V^(-1)·s^(-1),indicating potential applications in low-dimensional electronic devices.This work provides an excellent example for the development of novel multilayer 2D kagome materials.
基金supported by the National Key R&D Program of China(Grant No.2022YFB3505301)the National Key R&D Program of Shanxi Province(Grant No.202302050201014)+1 种基金the National Natural Science Foundation of China(Grant No.12304148)the Natural Science Basic Research Program of Shanxi Province(Grant No.202203021222219)。
文摘Multiferroic tunnel junctions(MFTJs),which combine tunneling magnetoresistance(TMR)and electroresistance(TER)efects,have emerged as key candidates for data storage.Two-dimensional van der Waals(vdW)MFTJs,in particular,are promising spintronic devices for the post-Moore era.However,these vdW MFTJs are typically based on multiferroics composed of ferromagnetic and ferroelectric materials or multilayer magnetic materials with sliding ferroelectricity,which increases device fabrication complexity.In this work,we design a vdW MFTJ using bilayer MoPtGe_(2)S_(6),a material with homologous multiferroicity in each monolayer,combined with symmetric PtTe_(2)electrodes.Using frst-principles calculations based on density functional theory and nonequilibrium Green's functions,we theoretically explore the spin-polarized electronic transport properties of this MFTJ.By controlling the ferroelectric and ferromagnetic polarization directions of bilayer MoPtGe_(2)S_(6),the MFTJ can exhibit six distinct non-volatile resistance states,with maximum TMR(137%)and TER(1943%)ratios.Under biaxial strain,TMR and TER can increase to 265%and 4210%,respectively.The TER ratio also increases to 2186%under a 0.1 V bias voltage.Remarkably,the MFTJ exhibits a pronounced spin-fltering and a signifcant negative diferential resistance efect.These fndings not only highlight the potential of monolayer multiferroic MoPtGe_(2)S_(6)for MFTJs but also ofer valuable theoretical insights for future experimental investigations.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.12304539,12074108,12474151,12347101)the Natural Science Foundation of Chongqing(Grant No.CSTB2022NSCQ-MSX0568)Beijing National Laboratory for Condensed Matter Physics(Grant No.2024BNLCMPKF025)。
文摘In recent years,there has been a surge of interest in higher-order topological phases(HOTPs)across various disciplines within the field of physics.These unique phases are characterized by their ability to harbor topological protected boundary states at lower-dimensional boundaries,a distinguishing feature that sets them apart from conventional topological phases and is attributed to the higher-order bulk-boundary correspondence.Two-dimensional(2D)twisted systems offer an optimal platform for investigating HOTPs,owing to their strong controllability and experimental feasibility.Here,we provide a comprehensive overview of the latest research advancements on HOTPs in 2D twisted multilayer systems.We will mainly review the HOTPs in electronic,magnonic,acoustic,photonic and mechanical twisted systems,and finally provide a perspective of this topic.
文摘Based on the theoretical representation of piezoelectric quasicrystal,a generalized dynamic model is built to represent the transmission of wave aspects in surface acoustic pulse nano-devices.Surface elasticity,surface piezoelectricity,and surface permittivity help to include the surface effect,which equals additional thin sheets.It is shown that,under certain assumptions,this generalized dynamic model may be simplified to a few classical examples that are appropriate for both macro and nano-scale applications.In the current work,surface piezoelectricity is used to develop a theoretical model for shear horizontal(SH)waves where it contains the surface piezoelectricity theory and a linear spring model to quantitatively and qualitatively explore SH waves in an orthotropic piezoelectric quasicrystal layer overlying an elastic framework(Model I),a piezoelectric quasi-crystal nano substrate,and an orthotropic piezoelectric quasicrystal half-space(Model II).The theoretical model stimulates the numerical results,which establish the critical thickness.As the piezoelectric layer’s thickness gets closer to nanometres,surface energy must be included when analyzing dispersion properties.Furthermore,the effects of surface elasticity and density on wave velocity are investigated individually.The authors establish a parameter,precisely the ratio of the physical modulus along the width direction to along the direction of wave travel.The surface effect’s impact on the general char-acteristics of piezoelectric structures is seen as a spring force acting on bulk boundaries.Analytical presentation of frequency equations for both symmetric and anti-symmetric waves pertains to the case of an electrical short circuit in Model II.The project aims to analyze SH waves in orthogonal anisotropic,transversely isotropic piezoelectric layered nanostructures,providing a practical mathematical tool for surface effects analysis and adaptability to other wave types,including Rayleigh waves and acoustic surface waves.
基金financially supported by the National Natural Science Foundation of China(Nos.22302133 and 22405161)Central Guidance on Local Science and Technology Development Fund of Hebei Province,China(No.236Z4406G)+5 种基金the Natural Science Foundation of Hebei Education Department,China(No.BJ2025100)the Natural Science Foundation of Hebei Province,China(No.B2021210001)the Natural Science Foundation of Xinjiang Uygur Autonomous Region(No.2024D01A157)the Key R&D Plan of Karamay(No.2024zdyf0009)Karamay Innovation Environment Construction Plan(Innovative Talents)Project(No.2024hjcxrc0029)the Research Foundation of China University of Petroleum-Beijing at Karamay(No.XQZX20240023)
文摘Tin dioxide(SnO_(2))with a high theoretical specific capacity of 1494 mAh g^(-1)is a promising candidate anode material for lithium storage.However,the shortcomings of serious volume expansion and low conductivity limit its wide application.Herein,coaxial nano-multilayered C/SnO_(2)/TiO_(2)composites were fabricated via layerby-layer self-assembly of TiO_(2)and SnO_(2)-gel layers on the natural cellulose filter paper,followed by thermal treatment under a nitrogen atmosphere.Through engineering design of the assembly process,the optimal C/SinO_(2)/TiO_(2)composite features five alternating SnO_(2)and TiO_(2)nanolayers,with TiO_(2)as the outside shell(denoted as C/TSTST).This unique structure endows the C/TSTST with excellent structural stability and electrochemical kinetics,making it a high-performance anode for lithium-ion batteries(LIBs).The C/TSTST composite delivers a high reversible capacity of 676 mAh g^(-1)at 0.1 A g^(-1)after 200 cycles and retains a capacity of 504 mAh g^(-1)at 1.0 A g^(-1),which can be recovered to 781 mAh g^(-1)at 0.1 A g^(-1)The significantly enhanced electrochemical performance is attributed to the hierarchical hybrid structure,where the carbon core combined with coaxial TiO_(2)nanolayers serves as a structural scaffold,ameliorating volume change of SnO_(2)while creating abundant interfacial defects for enhanced lithium storage and rapid charge transport.These findings are further demonstrated by the density functional theory(DFT)calculations.This work provides an efficient strategy for designing coaxial nano-multilayered transition metal oxide-related electrode materials,offering new insights into high-performance LIBs anodes.
基金Project supported by the National Natural Science Foundation of China(Nos.11902293 and 12272353)。
文摘In this paper,we investigate the interfacial behavior of a thin,penny-shaped,one-dimensional(1D)hexagonal functionally graded(FG)piezoelectric quasicrystal(PQC)film bonded on a temperature-dependent elastic substrate under thermal and electrical loads.The problem is modeled as axisymmetric based on the membrane theory,with the peeling stress and bending moment being disregarded.A potential theory method,combined with the Hankel transform technique,is utilized to derive the displacement field on the substrate surface.With perfect interfacial bonding assumption,an integral equation governing the phonon interfacial shear stress is formulated and numerically solved by the Chebyshev polynomials.Explicit expressions are derived for the interfacial shear stress,the internal stresses within the PQC film and the substrate,the axial strain,and the stress intensity factors(SIFs).Numerical simulations are conducted to investigate the effects of the film's aspect ratio,material inhomogeneity,material mismatch,and temperature-dependent material properties on its mechanical response.The results provide insights for the functional design and reliability assessment of FG PQC film/substrate systems.
基金supported by the National Natural Science Foundation of China(Grant Nos.11862021,12072166)the Program for Young Talents of Science and Technology in Universities of Inner Mongolia Autonomous Region(Grant No.NJYT-19-A06)the Natural Science Foundation of Inner Mongolia Autonomous Region of China(Grant Nos.2020MS01006,2019MS01015,2019MS01017).
文摘In this study,the nonlocal strain gradient theory is adopted to investigate the static bending deformation of a functionally graded(FG)multilayered nanoplate made of onedimensional hexagonal piezoelectric quasicrystal(PQC)materials subjected to mechanical and electrical surface loadings.The FG materials are assumed to be exponential distribution along the thickness direction.Exact closed-form solutions of an FG PQC nanoplate including nonlocality and strain gradient micro-size dependency are derived by utilizing the pseudo-Stroh formalism.The propagator matrix method is further used to solve the multilayered case by assuming that the layer interfaces are perfectly contacted.Numerical examples for two FG sandwich nanoplates made of piezoelectric crystals and PQC are provided to show the influences of nonlocal parameter,strain gradient parameter,exponential factor,length-to-width ratio,loading form,and stacking sequence on the static deformation of two FG sandwich nanoplates,which play an important role in designing new smart composite structures in engineering.
