In an effort to clarify the formation mechanism of LPSO structure in Mg-Y-Zn alloy,the chemical environment and structural ordering in liquid Mg-rich Mg-Y-Zn system are investigated with the aid of ab-initio molecular...In an effort to clarify the formation mechanism of LPSO structure in Mg-Y-Zn alloy,the chemical environment and structural ordering in liquid Mg-rich Mg-Y-Zn system are investigated with the aid of ab-initio molecular dynamics simulation.In liquid Mg-rich Mg-Y alloys,the strong Mg-Y interaction is determined,which promotes the formation of fivefold symmetric local structure.For Mg-Zn alloys,the weak Mg-Zn interaction results in the fivefold symmetry weakening in the liquid structure.Due to the coexistence of Y and Zn,the strong attractive interaction is introduced in liquid Mg-Y-Zn ternary alloy,and contributes to the clustering of Mg,Y,Zn launched from Zn.What is more,the distribution of local structures becomes closer to that in pure Mg compared with that in binary Mg-Y and Mg-Zn alloys.These results should relate to the origins of the Y/Zn segregation zone and close-packed stacking mode in LPSO structure,which provides a new insight into the formation mechanism of LPSO structure at atomic level.展开更多
The mixing enthalpies and structural order in liquid Mg−Si system were investigated via ab-initio molecular dynamics at 1773 K.By calculating the transferred charges and electron density differences,the dominance of S...The mixing enthalpies and structural order in liquid Mg−Si system were investigated via ab-initio molecular dynamics at 1773 K.By calculating the transferred charges and electron density differences,the dominance of Si−Si interactions in the chemical environments around Si was demonstrated,which determined that the mixing enthalpy reached the minimum on Mg-rich side.In terms of Honeycutt and Anderson(HA)bond pairs based on the partial pair correlation functions,the attraction between Si−Si pairs and Mg atoms was revealed,and the evolution of structural order with Si content was characterized as a process of constituting frame structures by Si−Si pairs that dispersed Mg atoms.Focusing on tetrahedral order of local Si-configurations,a correlation between the mixing enthalpy and structural order was uncovered ultimately,which provided a new perspective combining the energetics with geometry to understand the liquid Mg−Si binary system.展开更多
Inverse problem-solving methods have found applications in various fields,such as structural mechanics,acoustics,and non-destructive testing.However,accurately solving inverse problems becomes challenging when observe...Inverse problem-solving methods have found applications in various fields,such as structural mechanics,acoustics,and non-destructive testing.However,accurately solving inverse problems becomes challenging when observed data are incomplete.Fortunately,advancements in computer science have paved the way for data-based methods,enabling the discovery of nonlinear relationships within diverse data sets.In this paper,a step-by-step completion method of displacement information is introduced and a data-driven approach for predicting structural parameters is proposed.The accuracy of the proposed approach is 23.83%higher than that of the Genetic Algorithm,demonstrating the outstanding accuracy and efficiency of the data-driven approach.This work establishes a framework for solving mechanical inverse problems by leveraging a data-based method,and proposes a promising avenue for extending the application of the data-driven approach to structural health monitoring.展开更多
Phonon coherence can reflect electron‒phonon coupling information and has been proven to modulate electronic states and charge transport.The manipulation of phonon coherence through spacer cation engineering in organi...Phonon coherence can reflect electron‒phonon coupling information and has been proven to modulate electronic states and charge transport.The manipulation of phonon coherence through spacer cation engineering in organic‒inorganic hybrid perovskites(OIHPs)has been extensively demonstrated;however,the underlying structural origin remains elusive at the molecular level.Herein,we present molecular structure and temperature-dependent coherent phonon studies via a combination of sum frequency generation vibrational spectroscopy(SFG-VS)and transient absorption spectroscopy(TAS).The conformational order of spacer cations dictates the coherent phonon oscillations in 2D OIHPs.Our study further analyzes the static order and dynamic disorder in 2D perovskites.This work provides molecular-level insights into the role of spacer cations in tuning structural order and may provide valuable guidance for advancing emergent optoelecltronics development.展开更多
Mimicking the electric microenvironment of natural tissue is a promising strategy for developing biomedical implants. However, current research has not taken biomimetic electrical functional units into consideration w...Mimicking the electric microenvironment of natural tissue is a promising strategy for developing biomedical implants. However, current research has not taken biomimetic electrical functional units into consideration when designing biomedical implants. In this research, ordered structures with Schottky heterojunction functional unit (OSSH) were constructed on titanium implant surfaces for bone regeneration regulation. The Schottky heterojunction functional unit is composed of periodically distributed titanium microdomain and titanium oxide microdomain with different carrier densities and surface potentials. The OSSH regulates the M2-type polarization of macrophages to a regenerative immune response by activating the PI3K-AKT-mTOR signal pathway and further promotes osteogenic differentiation of rat bone marrow mesenchymal stem cells. This work provides fundamental insights into the biological effects driven by the Schottky heterojunction functional units that can electrically modulate osteogenesis.展开更多
Weak interactions prevent the magnetic particles from achieving excellent electromagnetic wave absorp-tion(EMA)at a low filler loading(FL).The construction of one-dimensional magnetic metal fibers(1D-MMFs)contributes ...Weak interactions prevent the magnetic particles from achieving excellent electromagnetic wave absorp-tion(EMA)at a low filler loading(FL).The construction of one-dimensional magnetic metal fibers(1D-MMFs)contributes to the formation of an electromagnetic(EM)coupling network,enhancing EM properties at a low FL.However,precisely controlling the length of 1D-MMFs to regulate permittivity at low FL poses a challenge.Herein,a novel magnetic field-assisted growth strategy was used to fabricate Co-based fibers with adjustable permittivity and aspect ratios.With a variety of FL changes,centimeter-level Co long fibers(Co-lf)consistently exhibited higher permittivity than Co particles and Co short fibers due to the enhancement of the effective EM coupling.The Co-lf exhibits excellent EMA performance(-54.85 dB,5.8 GHz)at 10 wt.%FL.Meanwhile,heterogeneous interfaces were introduced to increase the interfacial polarization through a fine phosphorylation design,resulting in elevated EMA performances(-51.50 dB,6.6 GHz)at 10 wt.%FL for Co_(2)P/Co long fibers.This study improves the orderliness of the particle arrangement by regulating the length of 1D-MMFs,which affects the behavior of electrons inside the fibers,providing a new perspective for improving the EMA properties of magnetic materials at a low FL.展开更多
Lithium-sulfur batteries(LSBs)have drawn significant attention owing to their high theoretical discharge capacity and energy density.However,the dissolution of long-chain polysulfides into the electrolyte during the c...Lithium-sulfur batteries(LSBs)have drawn significant attention owing to their high theoretical discharge capacity and energy density.However,the dissolution of long-chain polysulfides into the electrolyte during the charge and discharge process(“shuttle effect”)results in fast capacity fading and inferior electrochemical performance.In this study,Mn_(2)O_(3)with an ordered mesoporous structure(OM-Mn_(2)O_(3))was designed as a cathode host for LSBs via KIT-6 hard templating,to effectively inhibit the polysulfide shuttle effect.OM-Mn_(2)O_(3)offers numerous pores to confine sulfur and tightly anchor the dissolved polysulfides through the combined effects of strong polar-polar interactions,polysulfides,and sulfur chain catenation.The OM-Mn_(2)O_(3)/S composite electrode delivered a discharge capacity of 561 mAh g^(-1) after 250 cycles at 0.5 C owing to the excellent performance of OM-Mn_(2)O_(3).Furthermore,it retained a discharge capacity of 628mA h g^(-1) even at a rate of 2 C,which was significantly higher than that of a pristine sulfur electrode(206mA h g^(-1)).These findings provide a prospective strategy for designing cathode materials for high-performance LSBs.展开更多
Magnetic fluids,also known as ferrofluids,are versatile functional materials with a wide range of applications.These applications span from industrial uses such as vacuum seals,actuators,and acoustic devices to medica...Magnetic fluids,also known as ferrofluids,are versatile functional materials with a wide range of applications.These applications span from industrial uses such as vacuum seals,actuators,and acoustic devices to medical uses,including serving as contrast agents for magnetic resonance imaging(MRI),delivering medications to specific locations within the body,and magnetic hyperthermia for cancer treatment.The use of a non-wettable immiscible liquid substrate to support a layer of magnetic fluid opens up new possibilities for studying various fluid flows and related instabilities in multi-phase systems with both a free surface and an interface.The presence of two deformable boundaries within a ferrofluid layer significantly reduces the critical magnetic field strength required to transform the layer into an organized system of drops or polygonal figures evolving according to the intensity,frequency and direction of the considered magnetic field.This paper experimentally investigates this problem by assuming a uniform magnetic field perpendicular to the surface.This specific subject has not been previously explored experimentally.The critical magnetic field intensity required to destabilize the ferrofluid layer is determined based on the layer’s thickness and the fluid’s initial magnetic susceptibility.It is demonstrated that the critical magnetic field strength needed to disrupt the initially continuous ferrofluid layer increases with the layer’s thickness.Conversely,an increase in the ferrofluid’s magnetic susceptibility results in a decrease in the critical magnetic field strength.The emerging droplet structures are analyzed in terms of the number of drops,their size,and the periodicity of their arrangement.The number of droplets formed depends on the initial thickness of the layer,the presence or absence of a stable rupture in the upper layer,and the rate at which the magnetic field strength is increased to the critical value.A characteristic viscous time is proposed to evaluate the decomposition of the ferrofluid layer,which depends on the duration of the magnetic field’s application.The experimental data on the instability of a ferrofluid layer on a liquid substrate are compared with the theoretical results from the study of“magnetic fluid sandwich structures”conducted by Rannacher and Engel.This comparison highlights the similarities and differences between experimental observations and theoretical predictions,providing a deeper understanding of the behavior of ferrofluid layers under the influence of magnetic fields.展开更多
The microstructure and mechanical properties of Mg94Zn2Y4 extruded alloy containing long-period stacking ordered structures were systematically investigated by SEM and TEM analyses. The results show that the 18R-LPSO ...The microstructure and mechanical properties of Mg94Zn2Y4 extruded alloy containing long-period stacking ordered structures were systematically investigated by SEM and TEM analyses. The results show that the 18R-LPSO structure and α-Mg phase are observed in cast Mg94Zn2Y4 alloy. After extrusion, the LPSO structures are delaminated and Mg-slices with width of 50-200 nm are generated. By ageing at 498 K for 36 h, the ageing peak is attained andβ′phase is precipitated. Due to this novel precipitation, the microhardness ofα-Mg matrix increases apparently from HV108.9 to HV129.7. While the microhardness for LPSO structure is stabilized at about HV145. TEM observations and SAED patterns indicate that the β′ phase has unique orientation relationships betweenα-Mg and LPSO structures, the direction in the close-packed planes ofβ′precipitates perpendicular to that ofα-Mg and LPSO structures. The ultimate tensile strength for the peak-aged alloy achieves 410.7 MPa and the significant strength originates from the coexistence ofβ′precipitates and 18R-LPSO structures.展开更多
The intrinsic origins and formation of atomic-scale structure in multicomponent alloys remain largely unknown owing to limited simulations and inaccessible experiments.Herein,we report the formation of three-dimension...The intrinsic origins and formation of atomic-scale structure in multicomponent alloys remain largely unknown owing to limited simulations and inaccessible experiments.Herein,we report the formation of three-dimensional periodicity from a disordered atomic-scale structure to an imperfect/perfect ordered cluster and finally to long-range translational and rotational symmetry coupled with Nb heterogeneity.Significant atomic-scale structural clustering and atomic arrangements involving solvent or solute atoms simultaneously occurred during isothermal annealing.A close relationship between atomic-scale structural evolution and composition variation has important implications in depicting the chemical and topological packing during the early crystallization stage in metallic glasses.This work can provide a comprehensive understanding of how short-range orders evolve into long-range periodicity and will further shed light on the origins and nature of metallic glasses.展开更多
A combination study of magnetic and magnetostrictive properties in directionally cast(DC)(un-annealed)and differently heat-treated Fe-19 at%Ga samples was carried out at room temperature.Slow cooling leads to an incre...A combination study of magnetic and magnetostrictive properties in directionally cast(DC)(un-annealed)and differently heat-treated Fe-19 at%Ga samples was carried out at room temperature.Slow cooling leads to an increase in the occupation of[200]easy magnetic axis.However,structural ordering of Ga atoms into a metastable D03 phase decreases the saturation magnetostriction(λs)and saturation magnetization(Ms),while increases coercivity(Hc).Water quenching suppresses the formation of stable fee ordered phase(L12)and largely preserves disordered bcc single-phase(A2)structure down to room temperature,leading to enhanced magnetostriction and magnetization.Slow cooling promotes the ordering of metastable bcc ordered phase(D03).Magnetic force microscopy(MFM)study exhibits that the water-quenched(WQ)sample consists of a well-aligned stripe domain structure,while irregular maze-like domain structure is observed in furnace-cooled(FC)sample.The results confirm that in addition to an inhibitory effect of D03 ordering on magnetic domain wall motions,irregular magnetic domains also contribute to decrease in magnetic and magnetostrictive properties of FC sample.展开更多
14H, 18R and 24R long-period stacking ordered （LPSO） structures were observed in the as-cast Mg-3Cu-1Mn-2Zn-1Y damping alloy using transmission electron microscopy （TEM）. These LPSO structures contained Mg, Y, Cu ...14H, 18R and 24R long-period stacking ordered （LPSO） structures were observed in the as-cast Mg-3Cu-1Mn-2Zn-1Y damping alloy using transmission electron microscopy （TEM）. These LPSO structures contained Mg, Y, Cu and Zn and thus they were quaternary phases. Sharp diffraction pattern of the 24R structure was obtained and the angle between and g10024R was measured to be 5.03°. During high resolution TEM observations, lattice fringes with two characteristic spacings were observed within the 24R structure. Based on the experimental results, 6H, 7H and three 8H are suggested as the building blocks of 18R, 14H and 24R structures, respectively. The 24R unit cell can be interpreted as the stacking of 8H building blocks in the same shear direction with a shear angle of about 5.03°. The imperfect 24R structures are in order or disorder arrangements of principal 8H and minor 6H blocks. This double-block structure model is also applicable to other reported defects in LPSO structures.展开更多
Both solute-segregated long-period stacking ordered(LPSO)structure and stacking faults(SFs)are essential in strengthening rare-earth(RE)Mg alloys.Herein,LPSO-enriched Mg and SFs-enriched Mg are fabricated and comparab...Both solute-segregated long-period stacking ordered(LPSO)structure and stacking faults(SFs)are essential in strengthening rare-earth(RE)Mg alloys.Herein,LPSO-enriched Mg and SFs-enriched Mg are fabricated and comparably investigated for fatigue performances.During fatigue,the Mg nanolayers between LPSO lamellae or SFs act as the gliding channels of dislocations.However,SFs-enriched Mg exhibits outstanding fatigue strength due to solute strengthening within Mg nanolayers.Solute strengthening is assumed to contribute to the local accumulation of basal dislocations and the activation of non-basal dislocations.Dislocations are restricted locally and cannot glide long distances to specimen surfaces,which mitigates fatigue-induced extrusions and slip markings,ultimately leading to an increase in fatigue strength.These findings guide the development of RE-Mg alloys towards a synergy between high tensile and high fatigue performances.展开更多
Currently,electromagnetic radiation and interference have a significant effect on the operation of electronic devices and human health systems.Thus,developing excellent microwave absorbers have a huge significance in ...Currently,electromagnetic radiation and interference have a significant effect on the operation of electronic devices and human health systems.Thus,developing excellent microwave absorbers have a huge significance in the material research field.Herein,a kind of ultrafine zinc oxide(ZnO)nanoparticles(NPs)supported on three-dimensional(3D)ordered mesoporous carbon spheres(ZnO/OMCS)is prepared from silica inverse opal by using phenolic resol precursor as carbon source.The prepared lightweight ZnO/OMCS nanocomposites exhibit 3D ordered carbon sphere array and highly dispersed ultrafine ZnO NPs on the mesoporous cell walls of carbon spheres.ZnO/OMCS-30 shows microwave absorbing ability with a strong absorption(−39.3 dB at 10.4 GHz with a small thickness of 2 mm)and a broad effective absorption bandwidth(9.1 GHz).The outstanding microwave absorbing ability benefits to the well-dispersed ultrafine ZnO NPs and the 3D ordered mesoporous carbon spheres structure.This work opened up a unique way for developing lightweight and high-efficient carbon-based microwave absorbing materials.展开更多
Simultaneously enhancing the reaction kinetics,mass transport,and gas release during alkaline hydrogen evolution reaction(HER)is critical to minimizing the reaction polarization resistance,but remains a big challenge....Simultaneously enhancing the reaction kinetics,mass transport,and gas release during alkaline hydrogen evolution reaction(HER)is critical to minimizing the reaction polarization resistance,but remains a big challenge.Through rational design of a hierarchical multiheterogeneous three-dimensionally(3D)ordered macroporous Mo_(2)C-embedded nitrogen-doped carbon with ultrafine Ru nanoclusters anchored on its surface(OMS Mo_(2)C/NC-Ru),we realize both electronic and morphologic engineering of the catalyst to maximize the electrocatalysis performance.The formed Ru-NC heterostructure shows regulative electronic states and optimized adsorption energy with the intermediate H*,and the Mo_(2)C-NC heterostructure accelerates the Volmer reaction due to the strong water dissociation ability as confirmed by theoretical calculations.Consequently,superior HER activity in alkaline solution with an extremely low overpotential of 15.5 mV at 10 mAcm^(−2)with the mass activity more than 17 times higher than that of the benchmark Pt/C,an ultrasmall Tafel slope of 22.7 mV dec−1,and excellent electrocatalytic durability were achieved,attributing to the enhanced mass transport and favorable gas release process endowed from the unique OMS Mo_(2)C/NC-Ru structure.By oxidizing OMS Mo_(2)C/NC-Ru into OMS MoO_(3)-RuO_(2)catalyst,it can also be applied as efficient oxygen evolution electrocatalyst,enabling the construction of a quasi-symmetric electrolyzer for overall water splitting.Such a device's performance surpassed the state-of-the-art Pt/C||RuO2 electrolyzer.This study provides instructive guidance for designing 3D-ordered macroporous multicomponent catalysts for efficient catalytic applications.展开更多
Highly ordered mesoporous NiMoO4 material was successfully synthesized using mesoporous silica KIT-6 as hard template via vacuum nanocasting method. The structure was characterized by means of XRD, TEM, N2 adsorption-...Highly ordered mesoporous NiMoO4 material was successfully synthesized using mesoporous silica KIT-6 as hard template via vacuum nanocasting method. The structure was characterized by means of XRD, TEM, N2 adsorption-desorption, Raman and FT-IR. The mesoporous NiMoO4 with the coexistence of a-NiMoO4 and fl-NiMoO4 showed well-ordered mesoporous structure, a bimodal pore size distribution and crystalline framework. The catalytic performance of NiMoOa was investigated for oxidative dehydrogenation of propane. It is demonstrated that the mesoporous NiMoO4 catalyst with more surface active oxygen species showed better catalytic performance in oxidative dehydrogena- tion of propane in comparison with bulk NiMoO4.展开更多
Both the solid solution and precipitation are mainly strengthening mechanism for the magnesium-based alloys. A great number of alloying elements can be dissolved into the Mg matrix to form the solutes and precipitates...Both the solid solution and precipitation are mainly strengthening mechanism for the magnesium-based alloys. A great number of alloying elements can be dissolved into the Mg matrix to form the solutes and precipitates.Moreover, the type of precipitates varies with different alloying elements and heat treatments, which makes it quite difficult to understand the formation mechanism of the precipitates in Mg-based alloys in depth. Thus, it is very hard to give a systematical regularity in precipitation process for the Mg-based alloys. This review is mainly focused on the formation and microstructural evolution of the precipitates, as a hot topic for the past few years, including Guinier-Preston Zones, quasicrystals and long-period stacking ordered phases formed in a number of Mg-TM-RE alloy systems, where TM = Al, Zn, Zr and RE = Y,Gd, Hd, Ce and La.展开更多
The development of high-performance microwave absorption materials with strong absorption capacity and broad bandwidth is highly desirable in the field of electromagnetic pollution protection.Herein,ultralight polyimi...The development of high-performance microwave absorption materials with strong absorption capacity and broad bandwidth is highly desirable in the field of electromagnetic pollution protection.Herein,ultralight polyimide-based graphene foam with ordered lamellar structure is precisely designed and controllably constructed by bidirectional freezing process.More lamellar interfaces formed inside the foam per unit volume effectively facilitate the layer-by-layer dissipation for the vertical incident electromagnetic waves,thereby endowing the foam with efficient broadband electromagnetic absorption performance.More importantly,electromagnetic absorption performance can be controllably adjusted by optimizing impedance distribution and microstructure of skeletons.As a result,the optimized foam with an ultralow density of 9.10 mg/cm^(3)presents a minimum reflection loss value of-61.29 dB at 9.25 GHz and an effective absorption bandwidth of 5.51 GHz(7.06-12.57 GHz,covering the whole X band) when the thickness is 4.75 mm.展开更多
Sodium-ion hybrid capacitor(SIHC)is one of the most promising alternatives for large-scale energy storage due to its high energy and power densities,natural abundance,and low cost.However,overcoming the imbalance betw...Sodium-ion hybrid capacitor(SIHC)is one of the most promising alternatives for large-scale energy storage due to its high energy and power densities,natural abundance,and low cost.However,overcoming the imbalance between slow Na^(+)reaction kinetics of battery-type anodes and rapid ion adsorption/desorption of capacitive cathodes is a significant challenge.Here,we propose the high-rate-performance NiS_(2)@OMGC anode material composed of monodispersed NiS_(2) nanocrystals(8.8±1.7 nm in size)and N,S-co-doped graphenic carbon(GC).The NiS_(2)@OMGC material has a three-dimensionally ordered macroporous(3DOM)morphology,and numerous NiS_(2) nanocrystals are uniformly embedded in GC,forming a core-shell structure in the local area.Ultrafine NiS_(2) nanocrystals and their nano-microstructure demonstrate high pseudocapacitive Na-storage capability and thus excellent rate performance(355.7 mAh/g at 20.0 A/g).A SIHC device fabricated using NiS_(2)@OMGC and commercial activated carbon(AC)cathode exhibits ultrahigh energy densities(197.4 Wh/kg at 398.8 W/kg)and power densities(43.9 kW/kg at 41.3 Wh/kg),together with a long life span.This outcome exemplifies the rational architecture and composition design of this type of anode material.This strategy can be extended to the design and synthesis of a wide range of high-performance electrode materials for energy storage applications.展开更多
Magnesium alloys with a long-period stacking ordered(LPSO)structure usually possess excellent static strength,but their fatigue behaviors are poorly understood.This work presents the effect of the LPSO structure on th...Magnesium alloys with a long-period stacking ordered(LPSO)structure usually possess excellent static strength,but their fatigue behaviors are poorly understood.This work presents the effect of the LPSO structure on the crack behaviors of Mg alloys in a very high cycle fatigue(VHCF)regime.The LPSO lamellas lead to a facet-like cracking process along the basal planes at the crack initiation site and strongly prohibit the early crack propagation by deflecting the growth direction.The stress intensity factor at the periphery of the faceted area is much higher than the conventional LPSO-free Mg alloys,contributing higher fatigue crack propagation threshold of LPSO-containing Mg alloys.Microstructure observation at the facets reveals a layer of ultrafine grains at the fracture surface due to the cyclic contact of the crack surface,which supports the numerous cyclic pressing model describing the VHCF crack initiation behavior.展开更多
基金supported by National Natural Science Foundation of China,China(No.51901117,51801116)Youth Innovation and Technology Support Program of Shandong Provincial Colleges and Universities,China(No.2020KJA002)+2 种基金Youth Fund of Shandong Academy of Sciences,China(2020QN0021)Innovation Pilot Project for Fusion of Science,Education and Industry(International Cooperation)from Qilu University of Technology(Shandong Academy of Sciences),China(No.2020KJC-GH03)Several Policies on Promoting Collaborative Innovation and Industrialization of Achievements in Universities and Research Institutes,China(No.2019GXRC030)。
文摘In an effort to clarify the formation mechanism of LPSO structure in Mg-Y-Zn alloy,the chemical environment and structural ordering in liquid Mg-rich Mg-Y-Zn system are investigated with the aid of ab-initio molecular dynamics simulation.In liquid Mg-rich Mg-Y alloys,the strong Mg-Y interaction is determined,which promotes the formation of fivefold symmetric local structure.For Mg-Zn alloys,the weak Mg-Zn interaction results in the fivefold symmetry weakening in the liquid structure.Due to the coexistence of Y and Zn,the strong attractive interaction is introduced in liquid Mg-Y-Zn ternary alloy,and contributes to the clustering of Mg,Y,Zn launched from Zn.What is more,the distribution of local structures becomes closer to that in pure Mg compared with that in binary Mg-Y and Mg-Zn alloys.These results should relate to the origins of the Y/Zn segregation zone and close-packed stacking mode in LPSO structure,which provides a new insight into the formation mechanism of LPSO structure at atomic level.
基金The authors are grateful for the financial supports from the National Key Research and Development Program of China(2016YFB0701202)the National Natural Science Foundation of China(51901117,51801116,51804190,and 11804179)the Shandong Provincial Key Research and Development Plan,China(2019GGX102047).
文摘The mixing enthalpies and structural order in liquid Mg−Si system were investigated via ab-initio molecular dynamics at 1773 K.By calculating the transferred charges and electron density differences,the dominance of Si−Si interactions in the chemical environments around Si was demonstrated,which determined that the mixing enthalpy reached the minimum on Mg-rich side.In terms of Honeycutt and Anderson(HA)bond pairs based on the partial pair correlation functions,the attraction between Si−Si pairs and Mg atoms was revealed,and the evolution of structural order with Si content was characterized as a process of constituting frame structures by Si−Si pairs that dispersed Mg atoms.Focusing on tetrahedral order of local Si-configurations,a correlation between the mixing enthalpy and structural order was uncovered ultimately,which provided a new perspective combining the energetics with geometry to understand the liquid Mg−Si binary system.
基金supported by the National Natural Science Foundation of China(Grant Nos.11991030,11991031,and 11972205).
文摘Inverse problem-solving methods have found applications in various fields,such as structural mechanics,acoustics,and non-destructive testing.However,accurately solving inverse problems becomes challenging when observed data are incomplete.Fortunately,advancements in computer science have paved the way for data-based methods,enabling the discovery of nonlinear relationships within diverse data sets.In this paper,a step-by-step completion method of displacement information is introduced and a data-driven approach for predicting structural parameters is proposed.The accuracy of the proposed approach is 23.83%higher than that of the Genetic Algorithm,demonstrating the outstanding accuracy and efficiency of the data-driven approach.This work establishes a framework for solving mechanical inverse problems by leveraging a data-based method,and proposes a promising avenue for extending the application of the data-driven approach to structural health monitoring.
基金supported by the National Natural Science Foundation of China(Nos.21925302,92250306)the Strategic Priority Research Program of the Chinese Academy of Sciences(XDB0450202)+1 种基金the Innovation Program for Quantum Science and Technology(2021ZD0303303)the National Key Research and Development Program of China(2018YFA0208702).
文摘Phonon coherence can reflect electron‒phonon coupling information and has been proven to modulate electronic states and charge transport.The manipulation of phonon coherence through spacer cation engineering in organic‒inorganic hybrid perovskites(OIHPs)has been extensively demonstrated;however,the underlying structural origin remains elusive at the molecular level.Herein,we present molecular structure and temperature-dependent coherent phonon studies via a combination of sum frequency generation vibrational spectroscopy(SFG-VS)and transient absorption spectroscopy(TAS).The conformational order of spacer cations dictates the coherent phonon oscillations in 2D OIHPs.Our study further analyzes the static order and dynamic disorder in 2D perovskites.This work provides molecular-level insights into the role of spacer cations in tuning structural order and may provide valuable guidance for advancing emergent optoelecltronics development.
基金supported by the National Natural Science Foundation of China(Nos.52072127,52201297,U21A2055,and U22A20160)the China Postdoctoral Science Foundation(No.2022M711200)the Royal Society(No.IEC/NSFC/191344)(UK).
文摘Mimicking the electric microenvironment of natural tissue is a promising strategy for developing biomedical implants. However, current research has not taken biomimetic electrical functional units into consideration when designing biomedical implants. In this research, ordered structures with Schottky heterojunction functional unit (OSSH) were constructed on titanium implant surfaces for bone regeneration regulation. The Schottky heterojunction functional unit is composed of periodically distributed titanium microdomain and titanium oxide microdomain with different carrier densities and surface potentials. The OSSH regulates the M2-type polarization of macrophages to a regenerative immune response by activating the PI3K-AKT-mTOR signal pathway and further promotes osteogenic differentiation of rat bone marrow mesenchymal stem cells. This work provides fundamental insights into the biological effects driven by the Schottky heterojunction functional units that can electrically modulate osteogenesis.
基金supported by the National Key Research and Development Program of China(No.2024YFE0100600)the National Natural Science Foundation of China(No.52373303)+1 种基金the Shanghai Municipal Science and Technology Major Project(No.2021SHZDZX0100)the Fundamental Research Funds for the Central Universities and the Interdisciplinary Joint Research and Development Project of Tongji University(No.2022-4-ZD-01).
文摘Weak interactions prevent the magnetic particles from achieving excellent electromagnetic wave absorp-tion(EMA)at a low filler loading(FL).The construction of one-dimensional magnetic metal fibers(1D-MMFs)contributes to the formation of an electromagnetic(EM)coupling network,enhancing EM properties at a low FL.However,precisely controlling the length of 1D-MMFs to regulate permittivity at low FL poses a challenge.Herein,a novel magnetic field-assisted growth strategy was used to fabricate Co-based fibers with adjustable permittivity and aspect ratios.With a variety of FL changes,centimeter-level Co long fibers(Co-lf)consistently exhibited higher permittivity than Co particles and Co short fibers due to the enhancement of the effective EM coupling.The Co-lf exhibits excellent EMA performance(-54.85 dB,5.8 GHz)at 10 wt.%FL.Meanwhile,heterogeneous interfaces were introduced to increase the interfacial polarization through a fine phosphorylation design,resulting in elevated EMA performances(-51.50 dB,6.6 GHz)at 10 wt.%FL for Co_(2)P/Co long fibers.This study improves the orderliness of the particle arrangement by regulating the length of 1D-MMFs,which affects the behavior of electrons inside the fibers,providing a new perspective for improving the EMA properties of magnetic materials at a low FL.
基金Ministry of Trade,Industry and Energy,Grant/Award Number:20010095Korea Evaluation Institute of Industrial Technology,Grant/Award Number:20012341。
文摘Lithium-sulfur batteries(LSBs)have drawn significant attention owing to their high theoretical discharge capacity and energy density.However,the dissolution of long-chain polysulfides into the electrolyte during the charge and discharge process(“shuttle effect”)results in fast capacity fading and inferior electrochemical performance.In this study,Mn_(2)O_(3)with an ordered mesoporous structure(OM-Mn_(2)O_(3))was designed as a cathode host for LSBs via KIT-6 hard templating,to effectively inhibit the polysulfide shuttle effect.OM-Mn_(2)O_(3)offers numerous pores to confine sulfur and tightly anchor the dissolved polysulfides through the combined effects of strong polar-polar interactions,polysulfides,and sulfur chain catenation.The OM-Mn_(2)O_(3)/S composite electrode delivered a discharge capacity of 561 mAh g^(-1) after 250 cycles at 0.5 C owing to the excellent performance of OM-Mn_(2)O_(3).Furthermore,it retained a discharge capacity of 628mA h g^(-1) even at a rate of 2 C,which was significantly higher than that of a pristine sulfur electrode(206mA h g^(-1)).These findings provide a prospective strategy for designing cathode materials for high-performance LSBs.
基金the framework of the State Program AAAA-A20-120020690030-5.
文摘Magnetic fluids,also known as ferrofluids,are versatile functional materials with a wide range of applications.These applications span from industrial uses such as vacuum seals,actuators,and acoustic devices to medical uses,including serving as contrast agents for magnetic resonance imaging(MRI),delivering medications to specific locations within the body,and magnetic hyperthermia for cancer treatment.The use of a non-wettable immiscible liquid substrate to support a layer of magnetic fluid opens up new possibilities for studying various fluid flows and related instabilities in multi-phase systems with both a free surface and an interface.The presence of two deformable boundaries within a ferrofluid layer significantly reduces the critical magnetic field strength required to transform the layer into an organized system of drops or polygonal figures evolving according to the intensity,frequency and direction of the considered magnetic field.This paper experimentally investigates this problem by assuming a uniform magnetic field perpendicular to the surface.This specific subject has not been previously explored experimentally.The critical magnetic field intensity required to destabilize the ferrofluid layer is determined based on the layer’s thickness and the fluid’s initial magnetic susceptibility.It is demonstrated that the critical magnetic field strength needed to disrupt the initially continuous ferrofluid layer increases with the layer’s thickness.Conversely,an increase in the ferrofluid’s magnetic susceptibility results in a decrease in the critical magnetic field strength.The emerging droplet structures are analyzed in terms of the number of drops,their size,and the periodicity of their arrangement.The number of droplets formed depends on the initial thickness of the layer,the presence or absence of a stable rupture in the upper layer,and the rate at which the magnetic field strength is increased to the critical value.A characteristic viscous time is proposed to evaluate the decomposition of the ferrofluid layer,which depends on the duration of the magnetic field’s application.The experimental data on the instability of a ferrofluid layer on a liquid substrate are compared with the theoretical results from the study of“magnetic fluid sandwich structures”conducted by Rannacher and Engel.This comparison highlights the similarities and differences between experimental observations and theoretical predictions,providing a deeper understanding of the behavior of ferrofluid layers under the influence of magnetic fields.
基金Project (BK2010392) supported by the Natural Science Foundation of Jiangsu Province of ChinaProject (3212000502) supported by the Innovation Foundation of Southeast University,China
文摘The microstructure and mechanical properties of Mg94Zn2Y4 extruded alloy containing long-period stacking ordered structures were systematically investigated by SEM and TEM analyses. The results show that the 18R-LPSO structure and α-Mg phase are observed in cast Mg94Zn2Y4 alloy. After extrusion, the LPSO structures are delaminated and Mg-slices with width of 50-200 nm are generated. By ageing at 498 K for 36 h, the ageing peak is attained andβ′phase is precipitated. Due to this novel precipitation, the microhardness ofα-Mg matrix increases apparently from HV108.9 to HV129.7. While the microhardness for LPSO structure is stabilized at about HV145. TEM observations and SAED patterns indicate that the β′ phase has unique orientation relationships betweenα-Mg and LPSO structures, the direction in the close-packed planes ofβ′precipitates perpendicular to that ofα-Mg and LPSO structures. The ultimate tensile strength for the peak-aged alloy achieves 410.7 MPa and the significant strength originates from the coexistence ofβ′precipitates and 18R-LPSO structures.
基金the financial support from the National Natural Science Foundation of China(Grant Nos.52074257 and 51790484)the Chinese Academy of Sciences(Grant No.ZDBSLY-JSC023)+1 种基金the Liao Ning Revitalization Talents Program(Grant Nos.XLYC1802078 and XLYC1807062)the fund of Qingdao(Grant No.19-9-2-1-wz)。
文摘The intrinsic origins and formation of atomic-scale structure in multicomponent alloys remain largely unknown owing to limited simulations and inaccessible experiments.Herein,we report the formation of three-dimensional periodicity from a disordered atomic-scale structure to an imperfect/perfect ordered cluster and finally to long-range translational and rotational symmetry coupled with Nb heterogeneity.Significant atomic-scale structural clustering and atomic arrangements involving solvent or solute atoms simultaneously occurred during isothermal annealing.A close relationship between atomic-scale structural evolution and composition variation has important implications in depicting the chemical and topological packing during the early crystallization stage in metallic glasses.This work can provide a comprehensive understanding of how short-range orders evolve into long-range periodicity and will further shed light on the origins and nature of metallic glasses.
文摘A combination study of magnetic and magnetostrictive properties in directionally cast(DC)(un-annealed)and differently heat-treated Fe-19 at%Ga samples was carried out at room temperature.Slow cooling leads to an increase in the occupation of[200]easy magnetic axis.However,structural ordering of Ga atoms into a metastable D03 phase decreases the saturation magnetostriction(λs)and saturation magnetization(Ms),while increases coercivity(Hc).Water quenching suppresses the formation of stable fee ordered phase(L12)and largely preserves disordered bcc single-phase(A2)structure down to room temperature,leading to enhanced magnetostriction and magnetization.Slow cooling promotes the ordering of metastable bcc ordered phase(D03).Magnetic force microscopy(MFM)study exhibits that the water-quenched(WQ)sample consists of a well-aligned stripe domain structure,while irregular maze-like domain structure is observed in furnace-cooled(FC)sample.The results confirm that in addition to an inhibitory effect of D03 ordering on magnetic domain wall motions,irregular magnetic domains also contribute to decrease in magnetic and magnetostrictive properties of FC sample.
基金Project (2009CB623704) supported by the National Basic Research Program of ChinaProject (50971076) supported by the National Natural Science Foundation of China
文摘14H, 18R and 24R long-period stacking ordered （LPSO） structures were observed in the as-cast Mg-3Cu-1Mn-2Zn-1Y damping alloy using transmission electron microscopy （TEM）. These LPSO structures contained Mg, Y, Cu and Zn and thus they were quaternary phases. Sharp diffraction pattern of the 24R structure was obtained and the angle between and g10024R was measured to be 5.03°. During high resolution TEM observations, lattice fringes with two characteristic spacings were observed within the 24R structure. Based on the experimental results, 6H, 7H and three 8H are suggested as the building blocks of 18R, 14H and 24R structures, respectively. The 24R unit cell can be interpreted as the stacking of 8H building blocks in the same shear direction with a shear angle of about 5.03°. The imperfect 24R structures are in order or disorder arrangements of principal 8H and minor 6H blocks. This double-block structure model is also applicable to other reported defects in LPSO structures.
基金supported by National Natural Science Foundation of China(Nos.12102280,12172238,12332012)Postdoctoral Fellowship Program of CPSF(No.GZB20230473)+1 种基金Support of Ultramicroscopy Research Center(URC,Kyushu University)are highly acknowledged.Yao Chen acknowledges the support of JSPS Fellowship(No.JP22F22720)JSPS KAKENHI(No JP22K03828).
文摘Both solute-segregated long-period stacking ordered(LPSO)structure and stacking faults(SFs)are essential in strengthening rare-earth(RE)Mg alloys.Herein,LPSO-enriched Mg and SFs-enriched Mg are fabricated and comparably investigated for fatigue performances.During fatigue,the Mg nanolayers between LPSO lamellae or SFs act as the gliding channels of dislocations.However,SFs-enriched Mg exhibits outstanding fatigue strength due to solute strengthening within Mg nanolayers.Solute strengthening is assumed to contribute to the local accumulation of basal dislocations and the activation of non-basal dislocations.Dislocations are restricted locally and cannot glide long distances to specimen surfaces,which mitigates fatigue-induced extrusions and slip markings,ultimately leading to an increase in fatigue strength.These findings guide the development of RE-Mg alloys towards a synergy between high tensile and high fatigue performances.
基金The authors are grateful of the financial support by the National Natural Science Foundation of China(51902083 and 21606068)the Foundation Strengthening Program(2019-JCJQ-142-00)the Higher Education Science and Technology Research Project of Hebei Province(ZD2019087).
文摘Currently,electromagnetic radiation and interference have a significant effect on the operation of electronic devices and human health systems.Thus,developing excellent microwave absorbers have a huge significance in the material research field.Herein,a kind of ultrafine zinc oxide(ZnO)nanoparticles(NPs)supported on three-dimensional(3D)ordered mesoporous carbon spheres(ZnO/OMCS)is prepared from silica inverse opal by using phenolic resol precursor as carbon source.The prepared lightweight ZnO/OMCS nanocomposites exhibit 3D ordered carbon sphere array and highly dispersed ultrafine ZnO NPs on the mesoporous cell walls of carbon spheres.ZnO/OMCS-30 shows microwave absorbing ability with a strong absorption(−39.3 dB at 10.4 GHz with a small thickness of 2 mm)and a broad effective absorption bandwidth(9.1 GHz).The outstanding microwave absorbing ability benefits to the well-dispersed ultrafine ZnO NPs and the 3D ordered mesoporous carbon spheres structure.This work opened up a unique way for developing lightweight and high-efficient carbon-based microwave absorbing materials.
基金University of Macao,Grant/Award Numbers:MYRG2018-00192-IAPME,MYRG2020-00187-IAPMEScience and Technology Development Fund,Macao SAR,Grant/Award Numbers:0021/2019/AIR,0041/2019/A1,0046/2019/AFJ,0191/2017/A3UEA funding。
文摘Simultaneously enhancing the reaction kinetics,mass transport,and gas release during alkaline hydrogen evolution reaction(HER)is critical to minimizing the reaction polarization resistance,but remains a big challenge.Through rational design of a hierarchical multiheterogeneous three-dimensionally(3D)ordered macroporous Mo_(2)C-embedded nitrogen-doped carbon with ultrafine Ru nanoclusters anchored on its surface(OMS Mo_(2)C/NC-Ru),we realize both electronic and morphologic engineering of the catalyst to maximize the electrocatalysis performance.The formed Ru-NC heterostructure shows regulative electronic states and optimized adsorption energy with the intermediate H*,and the Mo_(2)C-NC heterostructure accelerates the Volmer reaction due to the strong water dissociation ability as confirmed by theoretical calculations.Consequently,superior HER activity in alkaline solution with an extremely low overpotential of 15.5 mV at 10 mAcm^(−2)with the mass activity more than 17 times higher than that of the benchmark Pt/C,an ultrasmall Tafel slope of 22.7 mV dec−1,and excellent electrocatalytic durability were achieved,attributing to the enhanced mass transport and favorable gas release process endowed from the unique OMS Mo_(2)C/NC-Ru structure.By oxidizing OMS Mo_(2)C/NC-Ru into OMS MoO_(3)-RuO_(2)catalyst,it can also be applied as efficient oxygen evolution electrocatalyst,enabling the construction of a quasi-symmetric electrolyzer for overall water splitting.Such a device's performance surpassed the state-of-the-art Pt/C||RuO2 electrolyzer.This study provides instructive guidance for designing 3D-ordered macroporous multicomponent catalysts for efficient catalytic applications.
基金supported by NSFC(21073235,21173270,21177160,21376261)863 Program(2013AA065302)PetroChina Innovation Foundation(2011D-5006-0403)
文摘Highly ordered mesoporous NiMoO4 material was successfully synthesized using mesoporous silica KIT-6 as hard template via vacuum nanocasting method. The structure was characterized by means of XRD, TEM, N2 adsorption-desorption, Raman and FT-IR. The mesoporous NiMoO4 with the coexistence of a-NiMoO4 and fl-NiMoO4 showed well-ordered mesoporous structure, a bimodal pore size distribution and crystalline framework. The catalytic performance of NiMoOa was investigated for oxidative dehydrogenation of propane. It is demonstrated that the mesoporous NiMoO4 catalyst with more surface active oxygen species showed better catalytic performance in oxidative dehydrogena- tion of propane in comparison with bulk NiMoO4.
基金supported by National Natural Science Fundation of China (Nos. 51171192 and51271183)National Basic Research Program of China(No. 2013CB632205)Innovation Fund of Institute of Metal Research (IMR), Chinese Academy of Sciences(CAS)
文摘Both the solid solution and precipitation are mainly strengthening mechanism for the magnesium-based alloys. A great number of alloying elements can be dissolved into the Mg matrix to form the solutes and precipitates.Moreover, the type of precipitates varies with different alloying elements and heat treatments, which makes it quite difficult to understand the formation mechanism of the precipitates in Mg-based alloys in depth. Thus, it is very hard to give a systematical regularity in precipitation process for the Mg-based alloys. This review is mainly focused on the formation and microstructural evolution of the precipitates, as a hot topic for the past few years, including Guinier-Preston Zones, quasicrystals and long-period stacking ordered phases formed in a number of Mg-TM-RE alloy systems, where TM = Al, Zn, Zr and RE = Y,Gd, Hd, Ce and La.
基金financially supported by the National Natural Science Foundation of China (Nos. 21674019, 21704014, 52003106, 22008086, and 52003107)China Postdoctoral Science Foundation (Nos. 2020M671332, 2021M691265, and 2021M691266)+2 种基金Fundamental Research Funds for the Central Universities (Nos. 2232019A3-03 and JUSRP12032)Ministry of Education of the People’s Republic of China (No. 6141A0202202)Shanghai Scientific and Technological Innovation Project (No. 18JC1410600)。
文摘The development of high-performance microwave absorption materials with strong absorption capacity and broad bandwidth is highly desirable in the field of electromagnetic pollution protection.Herein,ultralight polyimide-based graphene foam with ordered lamellar structure is precisely designed and controllably constructed by bidirectional freezing process.More lamellar interfaces formed inside the foam per unit volume effectively facilitate the layer-by-layer dissipation for the vertical incident electromagnetic waves,thereby endowing the foam with efficient broadband electromagnetic absorption performance.More importantly,electromagnetic absorption performance can be controllably adjusted by optimizing impedance distribution and microstructure of skeletons.As a result,the optimized foam with an ultralow density of 9.10 mg/cm^(3)presents a minimum reflection loss value of-61.29 dB at 9.25 GHz and an effective absorption bandwidth of 5.51 GHz(7.06-12.57 GHz,covering the whole X band) when the thickness is 4.75 mm.
基金supported by the National Natural Science Foundation of Tianjin(No.20JCQNJC01280)the National Natural Science Foundation of China(No.21905201)+1 种基金the support of the scientifi c research project from China Three Gorges Corporation(No.202103406)supported by Tohoku University and JSPS KAKENHI(No.JP16J06828).
文摘Sodium-ion hybrid capacitor(SIHC)is one of the most promising alternatives for large-scale energy storage due to its high energy and power densities,natural abundance,and low cost.However,overcoming the imbalance between slow Na^(+)reaction kinetics of battery-type anodes and rapid ion adsorption/desorption of capacitive cathodes is a significant challenge.Here,we propose the high-rate-performance NiS_(2)@OMGC anode material composed of monodispersed NiS_(2) nanocrystals(8.8±1.7 nm in size)and N,S-co-doped graphenic carbon(GC).The NiS_(2)@OMGC material has a three-dimensionally ordered macroporous(3DOM)morphology,and numerous NiS_(2) nanocrystals are uniformly embedded in GC,forming a core-shell structure in the local area.Ultrafine NiS_(2) nanocrystals and their nano-microstructure demonstrate high pseudocapacitive Na-storage capability and thus excellent rate performance(355.7 mAh/g at 20.0 A/g).A SIHC device fabricated using NiS_(2)@OMGC and commercial activated carbon(AC)cathode exhibits ultrahigh energy densities(197.4 Wh/kg at 398.8 W/kg)and power densities(43.9 kW/kg at 41.3 Wh/kg),together with a long life span.This outcome exemplifies the rational architecture and composition design of this type of anode material.This strategy can be extended to the design and synthesis of a wide range of high-performance electrode materials for energy storage applications.
基金The authors gratefully acknowledge the financial support from the National Natural Science Foundation of China(Nos.12072212 and 11832007)the National Key Research and Development Program of China(No.2018YFE0307104)the Applied Basic Research Programs of Sichuan Province(No.2021YJ0071).We also highly appreciate the help of Dr.Yan Li from the Department of Mechanics,Sichuan University.
文摘Magnesium alloys with a long-period stacking ordered(LPSO)structure usually possess excellent static strength,but their fatigue behaviors are poorly understood.This work presents the effect of the LPSO structure on the crack behaviors of Mg alloys in a very high cycle fatigue(VHCF)regime.The LPSO lamellas lead to a facet-like cracking process along the basal planes at the crack initiation site and strongly prohibit the early crack propagation by deflecting the growth direction.The stress intensity factor at the periphery of the faceted area is much higher than the conventional LPSO-free Mg alloys,contributing higher fatigue crack propagation threshold of LPSO-containing Mg alloys.Microstructure observation at the facets reveals a layer of ultrafine grains at the fracture surface due to the cyclic contact of the crack surface,which supports the numerous cyclic pressing model describing the VHCF crack initiation behavior.
