Electronic structure modulation with ultrafine Fe_(3)O_(4) nanoparticles on 2D Ni-based metal-organic framework layers for enhanced oxygen evolution reaction

Two-dimensional(2D)metal organic frameworks(MOFs)are emerging as low-cost oxygen evolution reaction(OER)electrocatalysts,however,suffering aggregation and poor operation stability.Herein,ultrafine Fe_(3)O_(4) nanoparticles(diameter:6±2 nm)are homogeneously immobilized on 2D Ni based MOFs(Ni-BDC,thickness:5±1 nm)to improve the OER stability.Electronic structure modulation for enhanced catalytic activity is studied via adjusting the amount of Fe_(3)O_(4) nanoparticles on Ni-BDC.The optimal Fe_(3)O_(4)/Ni-BDC achieves the best OER performance with an overpotential of 295 mV at 10 mA cm^(-2),a Tafel slope of 47.8 mV dec^(-1) and a considerable catalytic durability of more than 40 h(less than 5 h for Ni-BDC alone).DFT calculations confirm that the active sites for Fe_(3)O_(4)/Ni-BDC are mainly contributed by Fe species with a higher oxidation state,and the potential-determining step(PDS)is the formation of the adsorbed O*species,which are facilitated in the composite.

From VIB‑to VB‑Group Transition Metal Disulfides:Structure Engineering Modulation for Superior Electromagnetic Wave Absorption

The laminated transition metal disulfides(TMDs),which are well known as typical two-dimensional(2D)semiconductive materials,possess a unique layered structure,leading to their wide-spread applications in various fields,such as catalysis,energy storage,sensing,etc.In recent years,a lot of research work on TMDs based functional materials in the fields of electromagnetic wave absorption(EMA)has been carried out.Therefore,it is of great significance to elaborate the influence of TMDs on EMA in time to speed up the application.In this review,recent advances in the development of electromagnetic wave(EMW)absorbers based on TMDs,ranging from the VIB group to the VB group are summarized.Their compositions,microstructures,electronic properties,and synthesis methods are presented in detail.Particularly,the modulation of structure engineering from the aspects of heterostructures,defects,morphologies and phases are systematically summarized,focusing on optimizing impedance matching and increasing dielectric and magnetic losses in the EMA materials with tunable EMW absorption performance.Milestones as well as the challenges are also identified to guide the design of new TMDs based dielectric EMA materials with high performance.

Improved multi-scale inverse bottleneck residual network based on triplet parallel attention for apple leaf disease identification

Accurate diagnosis of apple leaf diseases is crucial for improving the quality of apple production and promoting the development of the apple industry. However, apple leaf diseases do not differ significantly from image texture and structural information. The difficulties in disease feature extraction in complex backgrounds slow the related research progress. To address the problems, this paper proposes an improved multi-scale inverse bottleneck residual network model based on a triplet parallel attention mechanism, which is built upon ResNet-50, while improving and combining the inception module and ResNext inverse bottleneck blocks, to recognize seven types of apple leaf(including six diseases of alternaria leaf spot, brown spot, grey spot, mosaic, rust, scab, and one healthy). First, the 3×3 convolutions in some of the residual modules are replaced by multi-scale residual convolutions, the convolution kernels of different sizes contained in each branch of the multi-scale convolution are applied to extract feature maps of different sizes, and the outputs of these branches are multi-scale fused by summing to enrich the output features of the images. Second, the global layer-wise dynamic coordinated inverse bottleneck structure is used to reduce the network feature loss. The inverse bottleneck structure makes the image information less lossy when transforming from different dimensional feature spaces. The fusion of multi-scale and layer-wise dynamic coordinated inverse bottlenecks makes the model effectively balances computational efficiency and feature representation capability, and more robust with a combination of horizontal and vertical features in the fine identification of apple leaf diseases. Finally, after each improved module, a triplet parallel attention module is integrated with cross-dimensional interactions among channels through rotations and residual transformations, which improves the parallel search efficiency of important features and the recognition rate of the network with relatively small computational costs while the dimensional dependencies are improved. To verify the validity of the model in this paper, we uniformly enhance apple leaf disease images screened from the public data sets of Plant Village, Baidu Flying Paddle, and the Internet. The final processed image count is 14,000. The ablation study, pre-processing comparison, and method comparison are conducted on the processed datasets. The experimental results demonstrate that the proposed method reaches 98.73% accuracy on the adopted datasets, which is 1.82% higher than the classical ResNet-50 model, and 0.29% better than the apple leaf disease datasets before preprocessing. It also achieves competitive results in apple leaf disease identification compared to some state-ofthe-art methods.

Suppression of partially irreversible phase transition in O′3-Na_(3)Ni_(2)SbO_(6)cathode for sodium-ion batteries by interlayered structural modulation

As a promising cathode material for sodium ion batteries,honeycomb-ordered layered Na_(3)Ni_(2)Sb O_(6)still suffers from rapid capacity fading because of partially irreversible phase transition.Herein,a substitution of Na+by Rb+with a larger ionic radius in honeycomb layered Na_(3)-xRbxNi_(2)Sb O_(6)is proposed to modulate the interlayer structure.The results unveil that biphasic transition reversibility of the intermediate P′3phase is substantially enhanced,and the structure evolution behavior during the charge/discharge process changes due to the structural modulation,which contributes to a suppression of the unfavorable O_(1)phase and an alleviation of the lattice distortion.Moreover,Rb substituted samples exhibited an improved Na+(de)intercalation thermodynamics and kinetics.Attributed to the modifications,the sample with optimized Rb content delivers superior cycle stability and rate capacity,demonstrating a feasible strategy for suppressing irreversible phase transition and developing high-performance honeycomb layered materials for sodium ion batteries.

Two-coupled structural modulations in charge-density-wave state of SrPt_2As_2 superconductor

Transmission electron microscopy （TEM） study of SrPt2As2 reveals two incommensurate modulations appearing in the charge-density-wave （CDW） state below TCDW ≈ 470 K. These two structural modulations can be well explained in terms of condensations of two-coupled phonon modes with wave vectors of q1=0.62a＊ on the a＊-b＊ plane and q2 = 0.23a＊ on the a＊-c＊ plane. The atomic displacements occur along the b-axis direction for q1 and along the c-axis direction for q2, respectively. Moreover, the correlation between ql and q2 can be generally written as q1 = （q2 ＋ a＊）/2 in the CDW state, suggesting the presence of essential coupling between q1 and q2. A small fraction of Ir doping on the Pt site in Sr（Pt1-xIrx）2As2 （x ≤ 0.06） could moderately change these CDW modulations and also affect their superconductivities.

Modulated Structures in 10Ni and 18Ni Maraging Steels

1.IntroductionSince the theory of spinodal decompo-sition in a supersaturated solid solution wasformulated by Hillert[1]and Cahn[2],thephenomena of spinodal decomposition havebeen found in many alloys.Tamura[3]haspointed out that spinodal decompositioncould also occur in maraging steels.A mod-ulated structure in 8Ni maraging steel was

STRUCTURE AND MAGNETIC PROPERTIES OF Fe/Pd COMPOSITIONALLY MODULATED FILMS

Metal Fe/Pd compositionally modulated films(CMFs) were prepared by vapour depo- sition from two sources onto glass substrate under vacuum.The modulation and crystal structures of the films were examined by X-ray diffraction.The magnetic properties were determined by vibrating sample magnetometer.The Pd layers in the Fe/Pd CMFs are of fcc structure,and the Fe layer structure transits from bcc into amorphous,state with decreasing thickness of Fe layer.The dependence of specific saturation magnetization on thickness of Fe layers has also been discussed.

Boosting oxygen evolution reactivity by modulating electronic structure and honeycomb-like architecture in Ni_(2)P/N,P-codoped carbon hybrids

Oxygen evolution reaction(OER)as the foremost stumbling block to generate cost-effective clean fuels has received extensive attention in recent years.But,it still maintains the challenge to manipulate the geometric and electronic structure during single reaction process under the same conditions.Herein,we report a simple self-template strategy to generate honeycomb-like Ni_(2)P/N,P-C hybrids with preferred electronic architecture.Experiments coupled with theoretical results revealed that the synthesized catalyst has two characteristics:firstly,the unique honeycomb-like morphology not only enables the fully utilization of catalytic active sites but also optimizes the mass/electron transportation pathway,which favor the diffusion of electrolyte to accessible active sites.Secondly,N,P-C substrate,on the one hand,largely contributes the electronic distribution near Fermi level(E_(F))thus boosting its electrical conductivity.On the other hand,the support effect result in the upshift of d-band center and electropositivity of Ni sites,which attenuates the energy barrier for the adsorption of OH~àand the formation of*OOH.In consequence,the optimized Ni_(2)P/N,P-C catalysts feature high electrocatalytic activity towards OER(a low overpotential of 252 m V to achieve10 m A cm^(-2))and 10 h long-term stability,the outstanding performance is comparable to most of transition metal catalysts.This work gives a innovative tactics for contriving original OER electrocatalysts,inspirng deeper understanding of fabricating catalysts by combining theoretical simulation and experiment design.

Room Temperature Modulated Structure of Ca and K co-Doped LaMnO_3

A series of perovskite compounds of La1-x-yCaxKyMnO3 was prepared by hydrothermal disproportionation reaction of MnO2. The three oxidation states of manganese（Mn3＋, Mn4＋ and Mn5＋） can stably exist in the compounds. Under room temperature conditions, twice and three times modulated structure produced by the charge ordering can be observed by X-ray diffraction（XRD）, select area electron diffraction（SAED） and high resolution transmission electron microscopy（HR-TEM）. The splits of the diffraction peaks of the single crystals confirmed by synchrotron X-ray diffraction experiment are in accordance with those of the powder sample. The existence of the different oxidation states of Mn3＋, Mn4＋ and Mn5＋ can be considered to be the dominating reason of the complicated room temperature modulated structure.

RECURSIVENESS OF ZERO STRUCTURES FOR SYSTEM MATRICES OF INTERCONNECTED LINEAR SYSTEMS VIA MODULE THEORETIC TOOLS

The importance of the zeros of multwariable linear systems is well-knoiun in terms of measure obstructions to the controllability and the. observability. In this paper, a recursive decarnposi Am oj interconnected systems is outlined by taking into account the sequential structure of the connnections. The paper extends the, coordinate, module-theoretic studies from the elementary algebraic systems theory to include the case oj such linear interconnected systems which need not to be controllable or observable. Also, the properties of controllability and observability, the decoupling zeros and the signal Making issues are characterized.

Modular flexible“Tetris”microsatellite platform based on sandwich assembly mode

In this paper,a flexible modular“Tetris”microsatellite platform is studied to implement the rapid integration and assembly of microsatellites.The proposed microsatellite platform is fulfilled based on a sandwich assembly mode which consists of the isomorphic module structure and the standard mechanical-electric-data-thermal interfaces.The advantages of the sandwich assembly mode include flexible reconfiguration and efficient assembly.The prototype of the sandwich assembly mode is built for verifying the performance and the feasibility of the proposed mechanical-electric-data-thermal interfaces.Finally,an assembly case is accomplished to demonstrate the validity and advantages of the proposed“Tetris”microsatellite platform.

Realizing efficient emission and triple-mode photoluminescence switching in air-stable tin(IV)-based metal halides via antimony doping and rational structural modulation

Recently,many lead-free metal halides with diverse structures and highly efficient emission have been reported.However,their poor stability and single-mode emission color severely limit their applications.Herein,three homologous Sb^(3+)-doped zero-dimensional(0D)air-stable Sn(IV)-based metal halides with different crystal structures were developed by inserting a single organic ligand into SnCl_(4)lattice,which brings different optical properties.Under photoexcitation,(C_(25)H_(22)P)SnC_(l5)@Sb⋅CH_(4O)(Sb^(3+)−1)does not emit light,(C_(25)H_(22)P)_(2)SnC_(l6)@Sb-α(Sb^(3+)−2α)shines bright yellow emission with a photoluminescence quantum yield(PLQY)of 92%,and(C_(25)H_(22)P)_(2)SnC_(l6)@Sb-β(Sb^(3+)−2β)exhibits intense red emission with a PLQY of 78%.The above three compounds show quite different optical properties should be due to their different crystal structures and the lattice distortions.Particularly,Sb^(3+)−1 can be successfully converted into Sb^(3+)−2αunder the treatment of C_(25)H_(22)PCl solution,accompanied by a transition from nonemission to efficient yellow emission,serving as a“turn-on”photoluminescence(PL)switching.Parallelly,a reversible structure conversion between Sb^(3+)−2αand Sb^(3+)−2βwas witnessed after dichloromethane or volatilization treatment,accompanied by yellow and red emission switching.Thereby,a triple-mode tunable PL switching of off-onI-onII can be constructed in Sb^(3+)-doped Sn(IV)-based compounds.Finally,we demonstrated the as-synthesized compounds in fluorescent anticounterfeiting,information encryption,and optical logic gates.

Vanadium-based polyanionic compounds as cathode materials for sodium-ion batteries:Toward high-energy and high-power applications

Sodium ion batteries(SIBs)have been regarded as one of the alternatives to lithium ion batteries owing to their wide availability and significantly low cost of sodium sources.However,they face serious challenges of low energy&power density and short cycling lifespan owing to the heavy mass and large radius of Na^(+).Vanadium-based polyanionic compounds have advantageous characteristic of high operating voltage,high ionic conductivity and robust structural framework,which is conducive to their high energy&power density and long lifespan for SIBs.In this review,we will overview the latest V-based polyanionic compounds,along with the respective characteristic from the intrinsic crystal structure to performance presentation and improvement for SIBs.One of the most important aspect is to discover the essential problems existed in the present V-based polyanionic compounds for high-energy&power applications,and point out most suitable solutions from the crystal structure modulation,interface tailoring and electrode configuration design.Moreover,some scientific issues of V-based polyanionic compounds shall be also proposed and related future direction shall be provided.We believe that this review can serve as a motivation for further development of novel V-based polyanionic compounds and drive them toward high energy&power applications in the near future.

Photoluminescent Property Effect of Sc_(3+) on Er_(3+)/Y_(3+)/Yb_(3+) Doped Al_2O_3 Powders

The photoluminescence （PL） property effect of Sc3＋ on the Er3＋/Y3＋/Yb3＋ doped Al2O3 powders prepared by sol-gel method has been investigated. The X-ray diffraction （XRD） and transmission electron microscopy （TEM） implied that the distribution of dopants （Er3＋ , Y3＋ , Yb3＋ , Sc3＋） was improved effectively with the rise of Sc3＋ concentration. The Fourier transform infrared spectra （FTIR） results demonstrated that the ligand around the quenching center -OH and the population of -OH were altered by introducing different amounts of Sc3＋ . The PL intensity centered at 1530 nm was increasingly improved with the rise of Sc3＋ concentration, as well as the corresponding full widths at the half maximum （FWHM） and lifetime. The optimized PL intensity was 4.7 times higher than that non-Sc3＋ doped sample for the Al2O3 powders codoped with 10mol% Sc3＋ . This material can be promising candidates for optical fiber amplifier.

Mechanism of Bainite Nucleation in Steel, Iron and Copper Alloys

During the incubation period of isothermal treatment（or aging） within the bainitic transformation temperature range in a salt bath （or quenching in water） immediately after solution treatment, not only are the defects formed at high temperatures maintained, but new defects can also be generated in alloys, iron alloys and steels. Due to the segregation of the solute atoms near defects through diffusion, this leads to non-uniform distributions of solute atoms in the parent phase with distinct regions of both solute enrichment and solute depletion. It is proposed that when the Ms temperature at the solute depleted regions is equal to or higher than the isothermal （or aged） temperature,nucleation of bainite occurs within these solute depleted regions in the manner of martensitic shear. Therefore it is considered that, at least in steel, iron and copper alloy systems, bainite is formed through a shear mechanism within solute depleted regions, which is controlled and formed by the solute atoms diffusion in the parent phase.

Two-dimensional MOS2 for hydrogen evolution reaction catalysis: The electronic structure regulation

Molybdenum disulfide (MoS2) has been recognized as one of the most promising candidates to replace precious Pt for hydrogen evolution reaction (HER) catalysis, due to the natural abundance, low cost, tunable electronic properties, and excellent chemical stability. Although notable processes have been achieved in the past decades, their performance is still far less than that of Pt. Searching effective strategies to boosting their HER performance is still the primary goal. In this review, the recent process of the electronic regulation of MoS2 for HER is summarized, including band structure engineering, electronic state modulation, orbital orientation regulation, interface engineering. Last, the key challenges and opportunities in the development of MoS2-based materials for electrochemical HER are also discussed.

Structural modulation and assembling of metal halide perovskites for solar cells and light-emitting diodes

Metal halide perovskites possess appealing optoelectronic properties and have been widely applied for solar energy harvesting and light emitting.Although perovskite solar cells(PeSCs)and perovskite light-emitting diodes(PeLEDs)have been developed rapidly in recent years,there are still no universal rules for the selection of perovskites to achieve high-performance optoelectronic devices.In this review,the working mechanisms of PeSCs and PeLEDs are first demonstrated with the discussion on the factors which determine the device performance.We then examine the optoelectronic properties of perovskites with structures modulated from 3D,2D,1D to 0D,and analyze the corresponding structure-property relationships in terms of photo-electric and electric-photo conversion processes.Based on the unique optoelectronic properties of structurally modulated perovskites,we put forward the concept of structural assembling engineering that integrate the merits of different types of perovskites within one matrix and elaborate their excellent properties for applications of both PeSCs and PeLEDs.Finally,we discuss the potential challenges and provide our perspectives on the structural assembling engineering of perovskites for future optoelectronic applications.

Efficient Electronic Modulation of g-C_(3)N_(4)Photocatalyst by Implanting Atomically Dispersed Ag_(1)-N_(3)for Extremely High Hydrogen Evolution Rates

Developing an efficientmethod to improve the photocatalytic efficiency of graphitic carbon nitride(g-C3 N4)is of great significance for solar H2 production.Electronic structure modulation has been considered one of the most crucial strategies to improving the photocatalytic efficiency of g-C_(3)N_(4),but how to efficiently modulate its electronic structure remains a huge challenge.Herein,we,for the first time,report a facile and highly-efficient approach to modulating the electronic structure of g-C_(3)N_(4)through single Ag atom implantation with a Ag_(1)-N_(3)coordination configuration into the g-C_(3)N_(4)framework.

Recent progress in structural modulation of metal nanomaterials for electrocatalytic CO_(2) reduction

The electrochemical CO_(2) reduction(ECR)into value-added products presents an appealing approach to mitigate CO_(2) emission caused by excess consumption of fossil fuels.To obtain high catalytic activity and selectivity toward target product in ECR,designing and developing a stable and efficient electrocatalyst is of significant importance.To date,metal nanomaterials have been widely applied as electrocatalysts for ECR due to their unique physicochemical properties.The structural modulation of metal nanomaterials is an attractive strategy to improve the catalytic performance.In this review,the recent progress of structural modulation,including size,facet,grain boundary,composition,interface,ligand modification,and crystal phase,is systematically summarized from both theoretical and experimental aspects.Finally,the opportunities and perspectives of structural modulation of metal nanomaterials for ECR are proposed.

Structure,defects,and microwave dielectric properties of Al-doped and Al/Nd co-doped Ba_(4)Nd_(9.33)Ti_(18)O_(54)ceramics

Low-loss tungsten–bronze microwave dielectric ceramics are dielectric materials with potential application value for miniaturized dielectric filters and antennas in the fifth-generation(5G)communication technology.In this work,a novel Al/Nd co-doping method of Ba_(4)Nd_(9.33)Ti_(18)O_(54)(BNT)ceramics with a chemical formula of Ba_(4)Nd_(9.33+z/3)Ti_(18−z)Al_(z)O_(54)(BNT–AN,0≤z≤2)was proposed to improve the dielectric properties through structural and defect modulation.Together with Al-doped ceramics(Ba_(4)Nd_(9.33)Ti_(18−z)Al_(4z/3)O_(54),BNT–A,0≤z≤2)for comparison,the ceramics were prepared by a solid state method.It is found that Al/Nd co-doping method has a significant effect on improving the dielectric properties compared with Al doping.As the doping amount z increased,the relative dielectric constant(εr)and the temperature coefficient of resonant frequency(τf)of the ceramics decreased,and the Q×f values of the ceramics obviously increased when z≤1.5.Excellent microwave dielectric properties ofεr=72.2,Q×f=16,480 GHz,andτf=+14.3 ppm/℃were achieved in BNT–AN ceramics with z=1.25.Raman spectroscopy and thermally stimulated depolarization current(TSDC)technique were firstly combined to analyze the structures and defects in microwave dielectric ceramics.It is shown that the improvement on Q×f values was originated from the decrease in the strength of the A-site cation vibration and the concentration of oxygen vacancies(VO××),demonstrating the effect and mechanism underlying for structural and defect modulation on the performance improvement of microwave dielectric ceramics.