Microstructure Characteristics and Possible Phase Evolution of the Coal Gangue-Steel Slag Ceramics Prepared by the Solid-State Reaction Methods

Industrial wastes such as steel slag and coal gangue etc.were chosen as raw materials for preparing ceramic via the conventional solid-state reaction method.With steel slag and coal gangue mixed in various mass ratios,from 100%steel slag to 100%coal gangue at 10%intervals,microstructure and possible phase evolution of the coal gangue-steel slag ceramics were investigated using X-ray powder diffraction,scanning electron microscopy,mercury intrusion porosimetry and Archimedes boiling method.The experimental results suggest that the phase compositions of the as-prepared ceramics could be altered with the increased amount of coal gangue in the ceramics.The anorthite-diopside eutectic can be formed in the ceramics with the mass ratios of steel slag to coal gangue arranged from 8:2 to 2:8,which was responsible for the melting of the steel slag-coal gangue ceramics at relatively high temperature.Further investigations on the microstructure suggested that the addition of the proper amount of steel slag in ceramic compositions was conducive to the pore formation and further contributed to an increment in porosity.

Inkjet-Printing Controlled Phase Evolution Boosts the Efficiency of Hole Transport Material Free and Carbon-Based CsPbBr_(3) Perovskite Solar Cells Exceeding 9%

Hole transport material free carbon-based all-inorganic CsPbBr_(3)perovskite solar cells(PSCs)are promising for commercialization due to its low-cost,high open-circuit voltage(V_(oc))and superior stability.Due to the different solubility of PbBr_(2)and CsBr in conventional solvents,CsPbBr_(3)films are mainly obtained by multi-step spin-coating through the phase evolution from PbBr_(2)to CsPb_(2)Br_(5)and then to CsPbBr_(3).The scalable fabrication of high-quality CsPbBr_(3)films has been rarely studied.Herein,an inkjet-printing method is developed to prepare high-quality CsPbBr_(3)films.The formation of long-range crystalline CsPb_(2)Br_(5)phase can effectively improve phase purity and promote regular crystal stacking of CsPbBr_(3).Consequently,the inkjet-printed CsPbBr_(3)C-PSCs realized PCEs up to 9.09%,8.59%and 7.81%with active areas of 0.09,0.25,and 1 cm^(2),respectively,demonstrating the upscaling potential of our fabrication method and devices.This high performance is mainly ascribed to the high purity,strong crystal orientation,reduced surface roughness and lower trap states density of the as-printed CsPbBr_(3)films.This work provides insights into the relationship between the phase evolution mechanisms and crystal growth dynamics of cesium lead bromide halide films.

Mineralogical characteristics,metallurgical properties and phase structure evolution of Ca-rich hematite sintering

In order to study the sintering characteristics of Ca-rich iron ore,chemical analysis,laser diffraction,scanning electron microscopy,XRD-Rietveld method,and micro-sintering were used to analyze the mineralogical properties and sintering pot tests were used to study the sintering behavior.In addition,a grey correlation mathematical model was used to calculate and compare the comprehensive sintering performance under different calcium-rich iron ore contents.The results demonstrate that the Ca-rich iron ore has coarse grain size and strong self-fusing characteristics with Ca element in the form of calcite(CaCO_(3)) and the liquid phase produced by the self-fusing of the calcium-rich iron ore is well crystallized.Its application with a 20wt%content in sintering improves sinter productivity,reduces fuel consumption,enhances reduction index,and improves gas permeability in blast furnace by 0.45 t/(m^(2)·h),6.11 kg/t,6.17%,and 65.39 kPa·℃,respectively.The Ca-rich iron ore sintering can improve the calorific value of sintering flue gas compared with magnetite sintering,which is conducive to recovering heat for secondary use.As the content of the Ca-rich iron ore increases,sinter agglomeration shifts from localized liquid-phase bonding to a combination of localized liquid-phase bonding and iron oxide crystal connection.Based on an examination of the greater weight value of productivity with grey correlation analysis,the Ca-rich iron ore is beneficial for the comprehensive index of sintering in the range of 0-20wt%content.Therefore,it may be used in sintering with magnetite concentrates as the major ore species.

Phase evolution of plasma sprayed Al_2O_3-13%TiO_2 coatings derived from nanocrystalline powders

Commercial nanosized alumina and titania particles were selected as raw materials to prepare the blended slurry with composition of A1203-13%TiO2 （mass fraction）, which were reconstituted into micrometer-sized granules by spray drying, subsequently sintering at different temperatures to form nanostructured feedstock for thermal spraying, and then A1203-13%TiO2 nanocoatings were deposited by plasma spraying. The evolution of morphology, microstructure, and phase transformation of the agglomerated powder and as-sprayed coatings were characterized by X-ray diffraction （XRD） and scanning electron microscopy （SEM）. The results show that A1203 retains the same a phase as the raw material during sintering, while TiO2 changes from anatase to futile. During plasma spraying, some a-A1203 phases solidify to form metastable y-A1203, and the volume fraction of a-A1203 decreases as CPSP increases. However, peaks of the TiO2 phase are not observed from the as-sprayed coatings except for the coatings sprayed at the lower CPSP. As the CPSP increases, nanostructured TiO2 is dissolved easily in y-A1203 or z-A1203＇TiO2 phase. After heat treatment, y-A1203 in the coatings transforms to a-A1203, and rutile is precipitated.

Effect of crystal morphology of ultrahigh-nickel cathode materials on high temperature electrochemical stability of lithium ion batteries

Higher nickel content endows Ni-rich cathode materials LiNi_(x)Co_yMn_(1-x-y)O_(2)(x>0.6)with higher specific capacity and high energy density,which is regarded as the most promising cathode materials for Li-ion batteries.However,the deterioration of structural stability hinders its practical application,especially under harsh working conditions such as high-temperature cycling.Given these circumstances,it becomes particularly critical to clarify the impact of the crystal morphology on the structure and high-temperature performance as for the ultrahigh-nickel cathodes.Herein,we conducted a comprehensive comparison in terms of microstructure,high-temperature long-cycle phase evolution,and high-temperature electrochemical stability,revealing the differences and the working mechanisms among polycrystalline(PC),single-crystalline(SC)and Al doped SC ultrahigh-nickel materials.The results show that the PC sample suffers a severe irreversible phase transition along with the appearance of microcracks,resulting a serious decay of both average voltage and the energy density.While the Al doped SC sample exhibits superior cycling stability with intact layered structure.In-situ XRD and intraparticle structural evolution characterization reveal that Al doping can significantly alleviate the irreversible phase transition,thus inhibiting microcracks generation and enabling enhanced structure.Specifically,it exhibits excellent cycling performance in pouch-type full-cell with a high capacity retention of 91.8%after 500 cycles at 55℃.This work promotes the fundamental understanding on the correlation between the crystalline morphology and high-temperature electrochemical stability and provides a guide for optimization the Ni-rich cathode materials.

Phases of Environmental Evolution Indicated by Primary Chemical Elements and Paleontological Records in the Upper Pleistocene-Holocene Series for the Salawusu River Valley,China

Studies of lithology, sedimentary facies and the distribution regularity of SiO2 and Al2O3 contents and Al2O3/SiO2 ratio allow us to divide the Upper Pleistocene-Holocene Series represented by the MUanggouwan section in China＇s Salawnsu River valley into six segments： MGS1, MGS2, MGS3, MGS4, MGS5 and MGS6. The boundary ages for MGS1 （the Dishaogouwan and Dagouwan Formations）, MGS2 （the upper Chengchuan Formation）, MGS3 （the middle Chengchuan Formation）, MGS4 （the lower Chengchuan Formation）, MGS5 （most strata of the Salawusu Formation） and MGS6 （the bottom of the Salawusu Formation and the top of the Lishi Formation） correspond to those of MIS1, MIS2, MIS3, MIS4, MISS and MIS6, respectively, from deep sea sediments or continental glaciers. MGS5 can be subdivided into five subsegments （MGS5a, MGS5b, MGS5c, MGS5d and MGS5e） and the boundary ages of these subsegments correspond to those of MISSa, MISSb, MIS5c, MIS5d and MIS5e, respectively. Based on the paleoenvironment and paleoecology indicated by the primary chemical elements, fossil vertebrates, mollusks and pollen grains, we hypothesize that MGS1, MGS2, MGS3, MGS4, MGS5 and MGS6 and the subsegments of MGS5 match the corresponding stages for oxygen isotopes in the deep sea sediments and continental glaciers, and the substages of MIS5 in terms of climatic characters, further explaining the phenomena that determined the formation of the late Quaternary strata and the paleontology of the Salawusu River valley. These phenomena relate to fluctuations in the global climate （and particularly in the East Asian monsoon） during the glacial and interglacial periods.

Phase evolution and room temperature ferroelectric and magnetic properties of Fe-doped BaTiO_3 ceramics

To make the ferroelectric BaTiO3 possess ferromagnetism simultaneously,magnetic Fe was doped into BaTiO3 ceramics at doping levels up to 10%(molar fraction).Both tetragonal and hexagonal phases coexisted in the Fe-doped BaTiO3 ceramics except at 1% doping level.X-ray diffraction analysis indicated that higher doping level of Fe,higher sintering temperature and longer sintering time promoted the formation of hexagonal phases in Fe-doped BaTiO3 ceramics.Ferroelectricity was observed in all samples at room temperature,but it was greatly depressed by Fe doping.Except at doping level of 1%,room-temperature ferromagnetism was observed in the BaTiO3 ceramics.The dependence of the saturation magnetization and coercivities of the Fe-doped BaTiO3 ceramics on doping level was systematically studied.Both the saturation magnetization and magnetic coercivities were found to be dependent on the doping level as well as the fraction of the hexagonal phase in the ceramics.

TEM observation of precipitation phase produced during tempering of steel AerMet100 and first principles calculations of phase evolution

The microstructure evolution law and the structure of precipitates produced during the tempering of steel AerMet100 based on TEM observation and the calibration of diffraction spot were revealed.The electronic structure and the stability of the MoxCr2-xC phase were calculated using the plane-wave pseudo-potential method on basis of density functional theory.TEM observations show that the precipitation phases Fe3C and Fe2-xCx(x=0.05～0.14) between martensite lath are produced at 425 and 480 ℃,respectively.The increase of tempering temperature or time can lead to the redissolution of both phases Fe3C and Fe2-xCx,and also lead to the precipitation of the phase Cr2C in martensite lath.The calculation results of formation energies and the density of state(DOS) demonstrate that in point of MoxCr2-xC structures formed during tempering,the early precipitation phase is Cr2C and finally later evolves into Mo2C phase with diffusing of incorporation of Mo atom into the Cr2C crystal cell,lattice,which can results in a energy decreases of the structure MoxCr2-xC phase with the increase of x.

Phase evolution in AlSi20/8009 aluminum alloy during high temperature heating near melting point and cooling processes

The AlSi20/8009 aluminum alloy was heated to high temperatures near the melting point and cooled to investigate the effect of external Si addition on the phase evolution of Al12(Fe,V)3 Si dispersion. Differential scanning calorimeter, scanning electron microscope, energy dispersive spectrometer and X-ray diffractometer were employed.The results showed that Al12(Fe,V)3 Si and Si phases evolved into a needle-like Al4.5 Fe Si phase and a nano-sized V-rich phase during holding the alloy at 580-600℃. With increasing holding temperature to 620-640℃, Al4.5 Fe Si and nano-sized V-rich phases evolved reversibly into Al12(Fe,V)3 Si and Si phases, of which Al12(Fe,V)3 Si occupied a coarse and hexagonal morphology. During the alloy(after holding at 640 ℃) furnace cooling to 570 ℃ or lower, Si and Al12(Fe,V)3 Si phases evolved into strip-like Al4.5 Fe Si and the V-rich phases, which is a novel formation route for Al4.5 Fe Si phase different from Al-Fe-Si ternary system.

Phase Evolution and Magnetic Studies of La and Refractory Metals Co-substituted α-Fe/R_2Fe_(14)B-type Nanocomposites

Phase evolution and magnetic properties of (Nd_o.95La_0.05)9.5-11Febal.M_2B10.5. where M=Cr, Ti, Nb, V, Mo, Zr, Hf, Ta, Mn or W, melt spun ribbons have been investigated. Almost all the alloy ribbons. except for(Nd_0.95La_0.05)_9.5Fe_78M_2B_10.5(M=Mo and Mn),consist merely two magnetic phases, namely α-Fe and R_2Fe_14B, which display a better combination of _iH_c and magnetic energy product. Remanence (Br) and coercivity (i_H_c) values in the range of 8.0 to 9.1 kG and 9.5 to 18.9 kOe. respectively, can be achieved. Among compositions studied, the Ti and W-substitutions were found to be most effective in increasing the Br and i_H_c, respectively. For a fixed refractory metal substitution, namely, M=C_r, Ti or Nb, an increase in the total rare earth concentration resulted in nanocomposites of small grain sizes and a high volume fraction of the R_2Fe_14B phase, leading to an increase in the magnetic properties.

Microstructural evolution during ultra-rapid annealing of severely deformed low-carbon steel: strain, temperature, and heating rate effects

An interaction between ferrite recrystallization and austenite transformation in low-carbon steel occurs when recrystallization is delayed until the intercritical temperature range by employing high heating rate. The kinetics of recrystallization and transformation is affected by high heating rate and such an interaction. In this study, different levels of strain are applied to low-carbon steel using a severe plastic deformation method. Then, ultra-rapid annealing is performed at different heating rates of 200–1100°C/s and peak temperatures of near critical temperature. Five regimes are proposed to investigate the effects of heating rate, strain, and temperature on the interaction between recrystallization and transformation. The microstructural evolution of severely deformed low-carbon steel after ultra-rapid annealing is investigated based on the proposed regimes. Regarding the intensity and start temperature of the interaction, different microstructures consisting of ferrite and pearlite/martensite are formed. It is found that when the interaction is strong, the microstructure is refined because of the high kinetics of transformation and recrystallization. Moreover, strain shifts an interaction zone to a relatively higher heating rate. Therefore, severely deformed steel should be heated at relatively higher heating rates for it to undergo a strong interaction.

Structural Evolution and Phase Change Properties of C-Doped Ge_2Sb_2Te_5 Films During Heating in Air

We elucidate the importance of a capping layer on the structural evolution and phase change properties of carbondoped Ge2 Sb2 Te5（C-GST） films during heating in air. Both the C-GST films without and with a thin SiO2 capping layer（C-GST and C-GST/SiO2） are deposited for comparison. Large differences are observed between C-GST and C-GST/SiO2 films in resistance-temperature, x-ray diffraction, x-ray photoelectron spectroscopy,Raman spectra, data retention capability and optical band gap measurements. In the C-GST film, resistancetemperature measurement reveals an unusual smooth decrease in resistance above 110℃ during heating. Xray diffraction result has excluded the possibility of phase change in the C-GST film below 170℃. The x-ray photoelectron spectroscopy experimental result reveals the evolution of Te chemical valence because of the carbon oxidation during heating. Raman spectra further demonstrate that phase changes from an amorphous state to the hexagonal state occur directly during heating in the C-GST film. The quite smooth decrease in resistance is believed to be related with the formation of Te-rich GeTe4-n Gen（n = 0, 1） units above 110℃ in the C-GST film. The oxidation of carbon is harmful to the C-GST phase change properties.

Phase Evolution Study and Optimization of the Heat Treatment Process for High Current Capacity Bi-2223 Tapes

Powder in tube process（PIT） was adopted for the fabrication of single filament Bi-2223 tapes, and a heat treatment process including the first heat treatment（HT1）, intermediate rolling（IR）, and second heat treatment（HT2） was performed. The phase evolution mechanism and microstructure changes during these heat treatment processes were systematically discussed. The influences of HT1 parameters on the phase evolution process of Bi-2223 tapes were discussed. With the optimized HT1 process, a proper Bi-2223 content of about 90% was achieved. HT2 process was also optimized by adding a post annealing process. An obvious increase of current capacity was obtained due to the enhancement of intergrain connections. Single filament Bi-2223 tapes with the critical current of Ic-90 A were fabricated with the optimized sintering process.

Irradiation-induced void evolution in iron：A phase-field approach with atomistic derived parameters

A series of material parameters are derived from atomistic simulations and implemented into a phase field（PF） model to simulate void evolution in body-centered cubic（bcc） iron subjected to different irradiation doses at different temperatures.The simulation results show good agreement with experimental observations — the porosity as a function of temperature varies in a bell-shaped manner and the void density monotonically decreases with increasing temperatures; both porosity and void density increase with increasing irradiation dose at the same temperature. Analysis reveals that the evolution of void number and size is determined by the interplay among the production, diffusion and recombination of vacancy and interstitial.

Phase Morphology Evolution in AISI301 Austenite Stainless Steel under Different Cooling Rates

Quenching experiments were performed at different cooling rates under non-directional solidification by differential thermal analysis, and the morphologic variation of primary phase, phase transition temperature and hardness change at the same quenching temperature were investigated. The experimental results show that, with the gradual decrease of the cooling rate from 25 K/min, the morphology of ferrite starts to transform experiencing the dendrite, radial pattern, Widmanstatten-like and wire-net. Sample starts to present the Widmanstatten-like microstructure at 10 K/min which does not exist at higher or lower cooling rates, and this microstructure is detrimental to the mechanical property. Except 10 K/min, the hardness decreases with decreasing cooling rate.

Phase separation-hydrogen etching-derived Cu-decorated Cu-Mn bimetallic oxides with oxygen vacancies boosting superior sodium-ion storage kinetics

Understanding the crystal phase evolution of bimetallic oxide anodes is the main concern to profoundly reveal the conversion reaction kinetics and sodium-ion storage mechanisms.Herein,an integrated selfsupporting anode of the Cu-decorated Cu-Mn bimetallic oxides with oxygen vacancies(Ov-BMO-Cu)are in-situ generated by phase separation and hydrogen etching using nanoporous Cu-Mn alloy as selfsacrificial templates.On this basis,we have elucidated the relationship between the phase evolution,oxygen vacancies and sodium-ion storage mechanisms,further demonstrating the evolution of oxygen vacancies and the inhibition effect of manganese oxides as an“anchor”on grain aggregation of copper oxides.The kinetic analyses confirm that the expanded lattice space and increased oxygen vacancies of cycled Ov-BMO-Cu synergistically guarantee effective sodium-ion diffusion and storage mechanisms.Therefore,the Ov-BMO-Cu electrode exhibits higher reversible capacities of 4.04 mA h cm^(-2)at 0.2 mA cm^(-2)after 100 cycles and 2.20 m A h cm^(-2)at 1.0 mA cm^(-2)after 500 cycles.Besides,the presodiated Ov-BMO-Cu anode delivers a considerable reversible capacity of 0.79 m A h cm^(-2)at 1.0 mA cm^(-2)after 60 cycles in full cells with Na_(3)V_(2)(PO_(4))_(3)cathode,confirming its outstanding practicality.Thus,this work is expected to provide enlightenment for designing high-capacity bimetallic oxide anodes.

Phase evolution and mechanical properties of low-activation refractory high-entropy alloy Ti_(1.5)ZrV_(0.5)Ta_(0.5)

A novel low-activation Ti_(1.5)ZrV_(0.5)Ta_(0.5)refractory high-entropy alloy(RHEA)was designed as a potential candidate for nuclear reactor application.At room temperature,it had an elongation of 8.4%and a yield strength of 1096 MPa.The phase evolution of this alloy and its effect on properties was investigated.At 400℃,the solid solution bcc 1 transformed into the fcc phase and bcc 2 phase,and theωphase andαphase also appeared.At 600℃,theωphase andαphase disappeared,and the microstructure of the alloy was composed of the fcc phase and bcc 2 phase.When the temperature was up to 1200℃,the fcc phase and bcc 2 phase re-transformed into solid solution bcc 1 phase.The precipitation ofωphase andαphase caused a sharp increase in strength and a decrease in plasticity.Meanwhile,the appearance of the fcc phase led to a simultaneous decrease in strength and ductility,due to larger stress concentrations at the fcc/bcc interface.Besides,the formation mechanism of each phase in the alloy was discussed in detail.

Quantifying structural distortion manipulation for desired perovskite phase:PartⅡ.Three-step workflow to reveal phase evolution logic

Distortion manipulation emerges as an efficient approach to obtain desired perovskite phases for various applications.In part I of this study,we propose a paradigm to quantify the structural distortion manipulation,which enables us to obtain desired perovskite phases by translating relevant materials research into a single mathematical question.As part II of this continuous study,we construct normalized structures by introducing all possible couplings of dominant distortions into a cubic supercell and then compare them with variously shaped primitive/conventional cells known in the database.The structure comparison demonstrates that distortions are the only cause for phase and property variations.This confirms that our proposed distortion parameters can be directly used to construct phases,providing theoretical support for the paradigm in Part I.Given the limited number of distortion types,we identify that the positional relations involved in distortion arrangements and couplings are the keys to describe numerous phases.Furtherly,a three-step workflow is proposed with core contents related to the positional relation,distortion hierarchy,and distortion-component-generation ordering in spatial dimension,respectively.The definition basis and value changes of distortion/model parameters in this workflow illustration provide guidelines about how to reveal the logic behind the perovskite phase evolution.

Low‑Temperature Oxidation Induced Phase Evolution with Gradient Magnetic Heterointerfaces for Superior Electromagnetic Wave Absorption

Gradient magnetic heterointerfaces have injected infinite vitality in optimizing impedance matching,adjusting dielectric/magnetic resonance and promoting electromagnetic(EM)wave absorption,but still exist a significant challenging in regulating local phase evolution.Herein,accordion-shaped Co/Co_(3)O_(4)@N-doped carbon nanosheets(Co/Co_(3)O_(4)@NC)with gradient magnetic heterointerfaces have been fabricated via the cooperative high-temperature carbonization and lowtemperature oxidation process.The results indicate that the surface epitaxial growth of crystal Co_(3)O_(4) domains on local Co nanoparticles realizes the adjustment of magnetic-heteroatomic components,which are beneficial for optimizing impedance matching and interfacial polarization.Moreover,gradient magnetic heterointerfaces simultaneously realize magnetic coupling,and long-range magnetic diffraction.Specifically,the synthesized Co/Co_(3)O_(4)@NC absorbents display the strong electromagnetic wave attenuation capability of−53.5 dB at a thickness of 3.0 mm with an effective absorption bandwidth of 5.36 GHz,both are superior to those of single magnetic domains embedded in carbon matrix.This design concept provides us an inspiration in optimizing interfacial polarization,regulating magnetic coupling and promoting electromagnetic wave absorption.

Roasting oxidation behaviors of ReS_2 and MoS_2 in powdery rhenium-bearing, low-grade molybdenum concentrate

The oxidation roasting process of molybdenum concentrate has significant advantages in industrial applications.However,utilization of low-grade mineral has many problems because it is more complex than the standard concentrate.In this study,the oxidation behaviors of powdery rhenium-bearing low-grade molybdenum concentrate were investigated through thermodynamic calculation,roasting experiments,thermogravimetric analysis,and phase analysis.The results obtained show that oxidation of MoS2 begins at 450℃,and MoO3 reacts with metal-oxide forming molybdate at 600℃.Finally,MoO3 can be dissolved in ammonia with a maximum content of approximately 80%.The volatile speed of Re was considerably slower than the oxidation speed of MoS2 because the nonvolatile products ReO2 and ReO3 were generated in reactions among MoS2,SO2,and Re2O7.The final volatilization rate of Re was almost 70%.This study determined the problems related to the roasting of low-grade molybdenum concentrate,which lays the scientific foundations for subsequent enhancement of molybdenum and rhenium extraction.