Biomass Carbon Improves the Adsorption Performance of Gangue-Based Ceramsites:Adsorption Kinetics and Mechanism Analysis

The large accumulation of coal gangue,a common industrial solid waste,causes severe environmental problems,and green development strategies are required to transform this waste into high-value-added products.In this study,low-cost ceramsites adsorbents were prepared from waste gangue,silt coal,and peanut shells and applied to remove the organic dye methylene blue from wastewater.We investigated the microstructure of ceramsites and the effects of the sintering atmosphere,sintering temperature,and solution pH on their adsorption performance.The ceramsites sintered at 800℃under a nitrogen atmosphere exhibited the largest three-dimensional-interconnected hierarchical porous structure among the prepared ceramsites;further,it exhibited the highest methylene blue adsorption performance,with an adsorption capacity of 0.954 mg·g^(−1),adsorption efficiency of over 95%,and adsorption equilibrium time of 1 h at a solution pH of 9.The removal efficiency remained greater than 75%after five adsorption cycles.The adsorption kinetics data were analyzed using various models,including the pseudosecond-order kinetic model and Langmuir equation,and the adsorption was attributed to electrostatic interactions between the dyes and ceramsites,n-interactions,and hydrogen bonds.The prepared coal gangue ceramsites exhibited excellent adsorption capacities,removal rates,and cyclic stabilities,demonstrating their promising application prospects for the comprehensive utilization of solid waste and for wastewater treatment.

Syntheses,Crystal Structures and Kinetic Mechanisms of Thermal Decomposition of Rare Earth Complexes with Schiff Base Derived from o-Vanillin and p-Toluidine

Three complexes, [Pr（NO3）3（HL）2] （1）, [Nd（NO3）3（HL）2] （2） and [Er（NO3）3（HL）2]·0.5H2O （3）, were synthesized from the reaction of a Schiff base ligand 2-[（4-methylphenylimino）methyl]-6-methoxyphenol （C 15H 15NO2, HL） with Ln（NO3）3·6H2O （Ln=Pr, Nd, Er）. Characterization by single-crystal X-ray diffraction technique, elemental analysis, molar conductance, FT-IR, UV-Vis, 1H NMR and thermal analysis shows the title complexes are neutral molecules where the central Ln（Ⅲ） ion is ten-coordinated in biapical anti-hexahedron prism geometry, with four oxygen atoms of the phenolic hydroxy and methoxy groups in the two bidentate Schiff base ligands and six oxygen atoms provided by the three bidentate NO3- anions. Additionally, the kinetic mechanism of thermal decomposition of complex 3 was determined with a TG-DTG curves by both integral and differential methods. The functions of thermal decomposition reaction mechanism and the equation of kinetic compensation effect were obtained.

Kinetics and Dissolution Mechanisms of Oolitic Limestone Under Burial Condition

In order to study the control factors and mechanism of oolitic limestone reservoir being corroded by organic acid produced in burial stage,the reactions of acetic acid(pH=3) with oolitic limestone were investigated using the rotating-disk Corrosion Reactor System(CRS).The effects of disk rotational speed, temperature and system pressure were examined. Scanning Electron Microscope attached with Energy Dispersive X-Ray Analyzer(SEM-EDX) was

Kinetics and formation mechanisms of intragranular ferrite in V?N microalloyed 600 MPa high strength rebar steel

To systematically investigate the kinetics and formation mechanisms of intragranular ferrite(IGF), isothermal heat treatment in the temperature range of 450℃to 600℃ with holding for 30 s to 300 s, analysis of the corresponding microstructures, and observation of the precipitated particles were conducted in V-N microalloyed 600 MPa high strength rebar steel. The potency of V(C,N) for IGF nucleation was also analyzed statistically. The results show that the dominant microstructure transforms from bainite(B) and acicular ferrite(AF) to grain boundary ferrite(GBF), intragranular polygonal ferrite(IPF), and pearlite(P) as the isothermal temperature increases from 450℃ to 600℃. When the holding time at 600℃ is extended from 30 s to 60 s, 120 s, and 300 s, the GBF content ranges from 6.0vol% to 6.5vol% and the IPF content increases from 0.5vol% to 2.8vol%, 13.1vol%, and 13.5vol%, respectively, because the ferrite transformation preferentially occurs at the grain boundaries and then occurs at the austenite grains. Notably, V(C,N) particles are the most effective nucleation site for the formation of IPF, accounting for 51% of the said formation.

DOUBLE SYNERGISTIC EFFECTS AND EXTRACTION KINETICS OF A MICELLE MIXED EXTRACTANT SYSTEM I DOUBLE(KINETIC AND THERMODYNAMIC)SYNERGISTIC EFFECTS AND EXTRACTION MECHANISMS

The equilibria and kinetic characteristics of a micelle mixed extractant system-D2 EHPA-MPA（MPA-monoalkyl phosphoric acid with long carbon chain and micellization）in extractionof the Al3+ions were studied.It was found that the system has double synergistic effects on theextraction of the Al3+ions.The compositions of the synergistic complexes were determined andthe synergistic reaction equations were obtained.

Mechanisms and Kinetics of Radical Reaction of O（^1D,^3P） ＋ HCN System

The reaction of HCN with O(1D, 3P) radical has been investigated by density functional theory (DFT) and ab initio methods. The stationary points on the reaction paths (reactants, intermediates and products) were optimized at the (U)B3LYP/aug-cc-pVTZ level. Single-point calculations were performed at the (U)QCISD(T)/aug-cc-pVTZ level for the optimized structures and all the total energies were corrected by zero-point energy. It is shown that there exist three competing mechanisms of oxygen attacking nitrogen O→N, oxygen attacking carbon O→C and oxygen attacking hydrogen O→H. The rate constants were obtained via Eyring transition-state theory in the temperature range of 600～2000 K. The linear relationship between lnk and 1/T was presented. The results show that path 1 is the main reaction channel and the product of NCO + H is predominant.

Kinetics and Mechanism of Hypophosphite Electrooxidation on a Nickel Electrode

用电化学质谱(EMS)和动力学模型分析等方法研究了次亚磷酸根在镍电极上的电化学氧化机理和动力学.研究表明,次亚磷酸根的电化学氧化是通过从P-H键脱离一个原子H,形成磷中心自由基(PHO-●2),而磷中心自由基(PHO-●2)进一步进行电化学反应形成最终产物亚磷酸。利用该模型,推导出相关动力学方程并通过与实验数据拟合获得动力学参数.结果表明,该模型能很好地模拟次亚磷酸根在镍电极上的电化学氧化过程.

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.

Kinetics and Mechanism of Oxidation of Glycol by Dihydroxydiperiodatonickelate ( Ⅳ )Complex in Aqueous Alkaline Medium

The kinetics of oxidation of glycol by dihydroxydiperiodato nickelate ( Ⅳ) complex (DDN) was studied by spectrophotometry in aqueous alkaline medium in a temperature range of 25-40℃. The reaction was found to be first order with respect to Ni( Ⅳ ) and also to be first order with respect to glycol. The rate increases with the increase in [OH ] and decreases with the increase in [IO-4], showing that dihydroxymonoperiodatonickelate ( Ⅳ )(DMN) is the reactive species of oxidant. Salt effect indicated that the reaction is of ion-dipole type. No free radical was detected. A mechanism of an inner-sphere two-electron transfer reaction involving a preequilibrium between DDN and DMN is proposed, and the rate equation derived from the mechanism can explain all experimental observations. Activation parameters of the rate-determing step and the equilibrium constants were calculated.

Comparative investigations of ternary thermite Al/Fe_(2)O_(3)/CuO and Al/Fe_(2)O_(3)/Bi_(2)O_(3) from pyrolytic,kinetics and combustion behaviors

To develop new energy enhancement energetic materials with great combustion performance and thermal stability,two kinds of ternary thermite,Al/Fe_(2)O_(3)/CuO and Al/Fe_(2)O_(3)/Bi_(2)O_(3),were prepared and analyzed via mechanical ball milling.The samples were characterized by SEM,XRD,TG-DSC,constant volume and constant pressure combustion experiments.The first exothermic peaks of Al/Fe_(2)O_(3)/CuO and Al/Fe_(2)O_(3)/Bi_(2)O_(3) appear at 579°C and 564.5°C,respectively.The corresponding activation energies are similar.The corresponding mechanism functions are set as G(a) = [-ln(1-a)]^(3/4) and G(a) =[-ln(1-a)]2/3,respectively,which belong to the Avrami-Erofeev equation.Al/Fe_(2)O_(3)/CuO has better thermal safety.For small dose samples,its critical temperature of thermal explosion is 121.05°C higher than that of Al/Fe_(2)O_(3)/Bi_(2)O_(3).During combustion,the flame of Al/Fe_(2)O_(3)/CuO is spherical,and the main products are FeAl_(2)O_(4) and Cu.The flame of Al/Fe_(2)O_(3)/Bi_(2)O_(3)is jet-like,and the main products are Al_(2)O_(3),Bi and Fe.Al/Fe_(2)O_(3)/Bi_(2)O_(3)has better ignition and gas production performance.Its average ignition energy is 4.2 J lower than that of Al/Fe_(2)O_(3)/CuO.Its average step-up rate is 28.29 MPa/s,which is much higher than 6.84 MPa/s of Al/Fe_(2)O_(3)/CuO.This paper provides a reference for studying the thermal safety and combustion performance of ternary thermite.

Kinetics and Mechanism of the Oxidation of Glycol by Dihydroxyditelluratoargentate(Ⅲ) with Spectrophotometry

The kinetics of the oxidation of glycol by dihydroxyditelluratoargentate (Ⅲ) complex(DDA) was studied in alkaline medium with spectrophotometry(in a temperature range of 16\^6—40 ℃). The first order rates with respect to glycol and Ag(Ⅲ) were all found. The rates increased with the increase in [OH -] and decreased with the increase in [TeO 2- 4]. No effect was found with the addition of KNO 3 and no free radical was detected. In view of this, the dihydroxymonotelluratoargentate(Ⅲ) species(DMA) is assumed to be the active species. A plausible mechanism involving a two electron transfer is proposed, and the rate equation derived from the mechanism can explain all experimental observations. Activation parameters of the rate determining step and constants are evaluated.

DEBINDING MECHANISM AND KINETICS FOR PW IN PW－WC FEEDSTOCK UNDER AIR ATMOSPHERE

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Hot-deformation kinetics analysis and extrusion parameter optimization of a dilute rare-earth free magnesium alloy

The fundamental research on thermo-mechanical conditions provides an experimental basis for high-performance Mg-Al-Ca-Mn alloys.However, there is a lack of systematical investigation for this series alloys on the hot-deformation kinetics and extrusion parameter optimization. Here, the flow behavior, constitutive model, dynamic recrystallization(DRX) kinetic model and processing map of a dilute rare-earth free Mg-1.3Al-0.4Ca-0.4Mn(AXM100, wt.%) alloy were studied under different hot-compressive conditions. In addition, the extrusion parameter optimization of this alloy was performed based on the hot-processing map. The results showed that the conventional Arrhenius-type strain-related constitutive model only worked well for the flow curves at high temperatures and low strain rates. In comparison, using the machine learning assisted model(support vector regression, SVR) could effectively improve the accuracy between the predicted and experimental values. The DRX kinetic model was established, and a typical necklace-shaped structure preferentially occurred at the original grain boundaries and the second phases. The DRX nucleation weakened the texture intensity, and the further growth caused the more scattered basal texture. The hot-processing maps at different strains were also measured and the optimal hot-processing range could be confirmed at the deformation temperatures of 600~723 K and the strain rates of 0.018~0.563 s^(-1). Based on the optimum hot-processing range, a suitable extrusion parameter was considered as 603 K and 0.1 mm/s and the as-extruded alloy in this parameter exhibited a good strength-ductility synergy(yield strength of ~ 232.1 MPa, ultimate strength of ~ 278.2 MPa and elongation-to-failure of ~ 20.1%). Finally, the strengthening-plasticizing mechanisms and the relationships between the DRXed grain size, yield strength and extrusion parameters were analyzed.

Kinetics and Mechanism Modeling of Liquid-Phase Toluene Oxidation to Benzaldehyde Catalyzed by Mn–Mo Oxide

In this study, liquid-phase aerobic oxidation of toluene catalyzed by Mn–Mo oxide was conducted in a 1.0 L batch reactor. The macroscopic kinetics of toluene consumption and benzaldehyde generation at 413–443 K were obtained from a combination of experimental observation and hypothetical models. The results clearly showed that both the oxidation rate of toluene and generation rate of the aromatic product were proportional to the concentration of the substrate, the partial pressure of oxygen and the surface area of the catalyst. The energy barrier of toluene oxidation to benzyl alcohol was the highest(≈ 81 kJ mol^(-1)), while that of benzyl alcohol oxidation to benzaldehyde was the lowest(≈ 57 kJ mol^(-1)). Moreover, the activation energy of further oxidation of benzaldehyde in an acetic acid solvent was only slightly lower(≈ 1.9 kJ mol^(-1)) than that of toluene oxidation. Significantly, the transformation of benzyl alcohol indeed contributed to the generation of benzaldehyde and this step conformed to a first-order parallel-consecutive model. Increased reaction temperature and residence time favored the transformation of benzyl alcohol to benzaldehyde. In addition, doping with molybdenum at Mn/Mo = 3/1 enhanced the catalytic performance of the heterogeneous catalyst and was attributed to the presence of a synergetic effect between different metal cations. Regarding the microscopic kinetics, the LH-OS-ND mechanism(Langmuir–Hinshelwood adsorption of reagents on the same type of active sites and non-dissociative adsorption of oxygen) was verified as responsible for the heterogeneous oxidation of toluene. Oxygen and benzaldehyde were weakly adsorbed(Δ H_(ads,Oxy) ≈^(-1)5 kJ mol^(-1), Δ H _(ads)0,Bald) ≈-30 kJ mol^(-1)), but showed strong mobility(Δ S_(ads,Oxy) ≈-22 J mol^(-1) K^(-1)), Δ S_(ads,Bald) ≈-39 J mol^(-1) K^(-1)). The fundamental intrinsic rates were deduced based on the LH-OS-ND mechanism and showed great consistency with the macroscopic results.

Growth kinetics and mechanism of microarc oxidation coating on Ti-6Al-4V alloy in phosphate/silicate electrolyte

Microarc oxidation(MAO)is an effective surface treatment method for Ti alloys to allow their application in extreme environments.Here,binary electrolytes consisting of different amounts of sodium phosphate and sodium silicate were designed for MAO.The surface morphology,composition,and properties of MAO coatings on Ti-6Al-4V alloy treated in 0.10 mol/L electrolyte were investigated to reveal the effect of PO_(4)^(3-)and SiO_(3)^(2-)ray diffraction,and potentiodynamic polarization.The results showed that PO_(4)^(3-)is beneficial for generating microarcs and forming pores within the coating,resulting in a thick but porous coating.SiO_(3)^(2-)eration of microarcs,resulting in a thin dense coating.The thickness,density,phases content,and polarization resistance of the MAO coatings are primarily affected by the intensity of microarcs for low SiO_(3)^(2-)ciently high.The thickness of MAO coatings obtained in P/Si electrolytes shows a piecewise linear increase with increasing process time during the three stages of microarc discharge.SiO_(3)^(2-)discharge,but slows down the growth of the coating formed in the next stage.

Gaseous hydrogen storage thermodynamics and kinetics of RE-Mg-Ni-based alloys prepared by mechanical milling

Nanocrystalline/amorphous La Mg11Ni+x Ni(x=100%, 200%, mass fraction) composite hydrogen storage alloys were synthesized by ball milling technology. The effects of Ni content and milling time on the gaseous hydrogen storage thermodynamics and dynamics of the alloys were systematically investigated. The hydrogen desorption properties were studied by Sievert's apparatus and a differential scanning calorimeter(DSC) connected with a H2 detector. The thermodynamic parameters(ΔH and ΔS) for the hydrogen absorption and desorption of the alloys were calculated by Van't Hoff equation. The hydrogen desorption activation energy of the alloy hydride was estimated using Arrhenius and Kissinger methods. The results indicate that a variation in the Ni content has a slight effect on the thermodynamic properties of the alloys, but it significantly improves their absorption and desorption kinetics performances. Furthermore, varying milling time clearly affects the hydrogen storage properties of the alloys. All the as-milled alloys show so fast hydrogen absorption rate that the absorbed amount in 10 min reaches to at least more than 95% of the saturated hydrogen absorption capacity. Moreover, the improvement of the gaseous hydrogen storage kinetics of the alloys is found to be ascribed to a decrease in the hydrogen desorption activation energy caused by increasing Ni content and prolong milling time.

MECHANISM AND KINETICS OF TRANSFORMATION OF ALUMINA INCLUSIONS BY CALCIUM TREATMENT

当钙介绍了进用电报喂的钢或粉末注射时，在钢的氧化铝包括的转变过程的基本机制和动力学被报导。到机制建模的 clarify，实验被学习在艾尔 2 在一个实验室炉子并且由为艾尔 deoxidised 在一个 8kg 正式就职炉子执行钙处理的 O 3 和 CaO 融化。在在艾尔 2 O 3和 CaO 被 SEMedition 检验(扫描电子显微镜精力散分光计)，并且艾尔 2 O 3 CA 6 CA 2 CACA x (l)以试验性的观察被讨论。有氧化铝包括的钙的反应的动力学被在 Ca 沉浸氧化铝盘子模仿对待的钢融化在正式就职炉子。结果与真实包括转变的观察相比。一个运动模型基于结果被建议。

The Most Probable Mechanism Function and Kinetic Parameters of Gibbsite Dissolution in NaOH

Determination of probable mechanism function and kinetic parameters is important to hydrometallurgical kinetics.In this work,the most probable mechanism function and kinetic parameters of gibbsite dissolution in NaOH solution are studied.The sample,the mixture of synthetic gibbsite and sodium hydroxide solution,was scanned in high-pressure differential scanning calorimetry(DSC) equipment with the heating rate of 10 K·min-1. Integral equation and differential equation of non-isothermal kinetics were solved to fit the data related to DSC curve.According to the calculation results,the most probable mechanism function for pure synthetic gibbsite dissolution in sodium hydroxide solution is presented based on the optimum procedure in the database of the mechanism function.The apparent activation energy obtained is(75±1) kJ·mol-1,the frequency factor is 10 8±1mol·s-1,and the reaction is a second order reaction.

Kinetics and Mechanism of Dechlorination of o-Chlorophenol by Nanoscale Pd/Fe

Nanoscale Pd/Fe bimetallic particles were synthesized with an efficient method to dechlorinate o-chlorophenol. The nanoscale Pd/Fe particles were determined by transmission electron microscopy and BET specific surface area analysis. Most of the particles are in the size range of 20—100 nm. The BET specific surface area of synthesized nanoscale Pd/Fe particles is 12.4 m 2/g. In contrast, a commercially available fine iron powder(<100 mesh) has a specific surface area of 0.49 m 2/g. Batch studies demonstrated that the nanoscale particles can effectively dechlorinate o-chlorophenol. The dechlorination reaction takes place on the surface of synthesized nanoscale Pd/Fe bimetallic particles in a pseudo-first order reaction. The surface-area-normalized rate coefficients(k_ SA) are comparable to those reported in the literature for chlorinated ethenes. The observed reaction rate constants(k_ obs) are dominated by the mass fraction of Pd and the mass concentration of the nanoscale Pd/Fe particles.

Kinetics and mechanism of oxidation for nickel-containing pyrrhotite tailings

X-ray powder diffraction,scanning electron microscopy,energy dispersive spectroscopy,thermogravimetry,differential scanning calorimetry,and mass spectrometry have been used to study the products of nickel-containing pyrrhotite tailings oxidation by oxygen in the air.The kinetic triplets of oxidation,namely,activation energy(E_(a)),pre-exponential factor(A),and reaction model(f(α))being a function of the conversion degree(α),were adjusted by regression analysis.In case of a two-stage process representation,the first step proceeds under autocatalysis control and ends atα=0.42.The kinetic triplet in the first step is E_(a)=262.2 kJ/mol,lg A=14.53 s^(−1),and f(α)=(1-α)^(4.11)(1+1.51×10^(-4)α).For the second step,the process is controlled by the two-dimensional diffusion of the reactants in the layer of oxidation products.The kinetic triplet in the second step isЕa=215.0 kJ/mol,lg A=10.28 s^(−1),and f(α)=(-ln(1-α))^(-1).The obtained empirical formulae for the rate of pyrrhotite tailings oxidation reliably describe the macro-mechanism of the process and can be used to design automatization systems for roast-ing these materials.