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Polyacrylate modified Cu electrode for selective electrochemical CO_(2) reduction towards multicarbon products

Science Bulletin 2024年第15期69卷 2395-2404页

作者： Yuchuan Shi Kaini Zhang Chung-Li Dong Ta Thi Thuy Nga Miao Wang Daixing Wei Jialin Wang Yiqing Wang Shaohua Shen International Research Center for Renewable Energy State Key Laboratory of Multiphase Flow in Power EngineeringXi’an Jiaotong UniversityXi’an 710049China Department of Physics Tamkang UniversityNew Taipei City 25137China

Highly selective production of value-added multicarbon(C^(2+))products via electrochemical CO_(2) reduction reaction(eCO_(2)RR)on polycrystalline copper(Cu)remains ***,the facile surface modification using poly(α-ethyl cyanoacrylate)(PECA)is presented to greatly enhance the C^(2+)selectivity for eCO_(2)RR over polycrystalline Cu,with Faradaic efficiency(FE)towards C^(2+)products increased from30.1%for the Cu electrode to 72.6%for the obtained Cu-PECA electrode at-1.1 V *** hydrogen electrode(RHE).Given the well-determined FEs towards C^(2+)products,the partial current densities for C^(2+)production could be estimated to be-145.4 mA cm~(-2)for the Cu-PECA electrode at-0.9 V *** in a homemade flow ***-situ spectral characterizations and theoretical calculations reveal that PECA featured with electron-accepting-C≡N and-COOR groups decorated onto the Cu electrode could inhibit the adsorption of^(*)H intermediates and stabilize the^(*)CO intermediates,given the redistributed interfacial electron density and the raised energy level of d-band center(E_(d))of Cu active sites,thus facilitating the C-C coupling and then the C^(2+)selective *** study is believed to be guidable to the modification of electrocatalysts and electrodes with polymers to steer the surface adsorption behaviors of reaction intermediates to realize practical eCO_(2)RR towards value-added C^(2+)products with high activity and selectivity.

关键词： Electrochemical CO_(2)reduction Polymer modification Electron transfer C_(2+)products

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Numerical investigations on cluster characteristics in the supercritical water circulating fluidized bed riser

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Particuology 2024年第11期94卷 281-293页

作者： Kenan Xi Runqing Li Xiazhi Li Mei Li Xiudong Xu Yu Zhang Hao Wang Youjun Lu Northwest Institute of Nuclear Technology Xi'an710024China State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong UniversityXi'an710049China Xi'an Institute of Applied Optics Xi'an710065China

There are currently no reports about clusters in the supercritical water circulating fluidized bed(SCWCFB).Simulations were conducted to investigate the numbers,diameters,aspect ratios,circularity,and orientation angles of cluster in the riser of SCWCFB via two-fluid model across different flow velocities,solid circulation rates,pressures,and *** results show that cluster numbers are mainly between 10 and 80 per *** are more at the bottom but less at the top,and more near the wall but less at the *** diameters are mainly between 0.2 and 0.5 times the bed *** are large at the bottom but small at the top,and large at the center but small near the *** aspect ratios are mainly between 0 and 1,indicating that most clusters have shorter width than their ***-like clusters are more likely to appear near the walls,and clusters at the center of the riser are more likely to be *** circularity is mainly between 0.2 and 0.4,suggesting that the shapes of clusters are far from the *** absolute values of cluster orientation angles are mainly between 75°and 90°,indicating that most clusters move in the vertical *** fluid velocities may facilitate cluster coalescence.

关键词： Supercritical water Circulating fluidized bed Cluster Two-fluid model Riser

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DISTRIBUTED MULTI-ENERGY SYSTEMS CONSIDERING power-TO-X TECHNOLOGY: PLANNING, SCHEDULING, AND PERFORMANCE ASSESSMENT 37

DISTRIBUTED MULTI-ENERGY SYSTEMS CONSIDERING POWER-TO-X TECH...

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37th International Conference on Efficiency, Cost, Optimization, Simulation and Environmental Impact of Energy Systems, ECOS 2024

作者： Xue, Kai Wang, Jinshi Han, Xiaoqu Zhao, Quanbin Chong, Daotong Chen, Weixiong Yan, Junjie State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Shannxi Xi'an China

ISBN: (纸本)9798331307660

The distributed multi-energy systems place emphasis on the complementary and local application of heterogeneous energy sources, and power to methanol process can be coupled, reducing carbon emissions while increasing the *** providing an economical and low-carbon solution, a real community energy system integrated with solar energy and natural gas has been investigated in this *** at the minimization of the daily cost referring to the net expenditure after considering the offsetting benefits, the carbon capture, water electrolysis, and methanol synthesis are combined, with the methanol and oxygen exported as *** capacity planning and operation scheduling have been performed, and the results indicated that the daily cost can be reduced by 69.67% compared to the conventional energy supply after the scheduling *** the case scenario and typical day, the production of methanol and oxygen is 6.30 t and 13.49 t based on an electricity demand of 28.78 MWh and a heat demand of 11.85 *** to the contribution of carbon capture, the purchase of 5.90 t of carbon allowances is avoided and instead there are 3.86 t of allowances available for ***, the effect of device capacity and operating parameters on economics has been *** study could help to promote the application of power to methanol in distributed energy systems. © 2024 37th International Conference on Efficiency, Cost, Optimization, Simulation and Environmental Impact of Energy Systems, ECOS 2024. All rights reserved.

关键词： Carbon capture and utilization

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Construction of Z-Scheme In_(2)S_(3)-TiO_(2) for CO_(2) Reduction under Concentrated Natural Sunlight

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Chinese Journal of Structural Chemistry 2022年第1期41卷 34-39页

作者： Ya Liu Fangbo Yu Feng Wang Shengjie Bai Guiwei He State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong UniversityXi’an 710049China

Producing chemical fuels from sunlight enables a sustainable way for energy *** various solar fuel generation approaches,photocatalytic CO_(2) reduction has the advantages of simple structure,mild reaction condition,directly reducing carbon emissions,***,most of the current photocatalytic systems can only absorb the UV-visible spectrum of solar ***,finding a way to utilize infrared light in the photocatalytic system has attracted more and more ***,a Z-scheme In_(2)S_(3)-TiO_(2) was constructed for CO_(2) reduction under concentrated natural *** infrared light was used to create a high-temperature environment for photocatalytic *** evolution rates of H2,CO,and C2H5OH reached 262.2,73.9,and 27.56μmol・h^(-1)・g^(-1),respectively,with an overall solar to fuels efficiency of 0.002%.This work provides a composite photocatalyst towards the utilization of full solar light spectrum,and could promote the research on photocatalytic CO_(2) reduction.

关键词： solar energy CO_(2) In_(2)S_(3) TiO_(2)

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High tension cyclic hydrocarbons synthesized from biomass-derived platform molecules for aviation fuels in two steps

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Green Energy & Environment 2023年第1期8卷 331-337页

作者： Zhanchao Li Yizhuo Wang Qing Li Liqing Xu Hong Wang Frontier Institute of Science and Technology Xi'an Jiaotong UniversityXi'an710054China State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong UniversityXi'an710054China

Synthesizing ring structure aviation fuels from biomass-derived platform molecules is challenging,especially for bridged ring structure aviation fuels which are typically achieved from fossil-derived ***,we report the synthesis of a series of ring structure biofuels in two steps by a combination of a solvent-free Michael-cyclization reaction and a hydrodeoxygenation(HDO)reaction from lignocellulosederived 5,5-dimethyl-1,*** biofuels are obtained with high overall yields up to 90%,which exhibit high densities of 0.81 g cm^(-3)-0.88 g cm^(-3)and high volumetric neat heat of combustion(VNHOC)values of 36.0 MJ L^(-1)-38.6 MJ L^(-1).More importantly,bridged-ring structure hydrocarbons can also be achieved in two steps by a combination of a Robinson annulation reaction and an HDO reaction to afford the final products at high overall yields up to 90%.The bridged-ring structure products have comparable high densities and high VNHOC values to the best artificial fuel JP-10(0.94 g cm^(-3)and 39.6 MJ L^(-1)).The results demonstrate a promising way for the synthesis of high-density aviation fuels with different fuel properties at high yields.

关键词： Biofuels 5,5-Dimethyl-1,3-cyclohexanedione Solvent-free Michael-cyclization Robinson annulation Green reaction

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EXPERIMENTAL INVESTIGATION ON THE TRANSCRITICAL DYNAMIC CHARACTERISTICS OF WATER WALL FOR A SUPERCRITICAL CFB BOILER

EXPERIMENTAL INVESTIGATION ON THE TRANSCRITICAL DYNAMIC CHAR...

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ASME 2024 International Mechanical Engineering Congress and Exposition, IMECE 2024

作者： Yang, Dong An, Ning Du, Xiaocheng Han, Lei Guo, Zerui Wei, Ziyu State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Shaanxi Xi'an China

ISBN: (纸本)9780791888667

When the boiler load varies, the operational parameters in the water wall will change, this process is called as dynamic process. Dynamic process presents unique flow and heat transfer phenomena within the water wall. To investigate the process, the research was conducted in a vertical upward smooth tube for a supercritical circulating fluidized bed (CFB) boiler. Experiments were conducted to explore the dynamic characteristics during transcritical pressure process. The results indicate that as system pressure decreases from 23 MPa to 21 MPa, the mass flux within the tube increases sharply, and the outlet fluid temperature decreases. Concurrently, a rapid rise in wall temperature was observed. As the inlet mass flux increases, the wall temperature eventually returns to the normal value. The dynamic heat transfer coefficients were calculated throughout the transcritical pressure process, revealing stages of heat transfer deterioration, subcooled boiling, and single-phase water heat transfer. In addition, experiments and numerical simulations were carried out to explore the dynamic characteristics at supercritical pressure. The dynamic response curves during the step process of heat flux and inlet enthalpy under supercritical pressure conditions were obtained. As the inlet enthalpy decreases, the system mass flux increases, and as the heat flux increases, the system mass flux decreases. And there is no rise in wall temperature during the dynamic response at supercritical pressure. Copyright © 2024 by ASME.

关键词： Water tube boilers

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Morphology Structure Evolution and Combustion Reactivity of Bituminous Char at Around Ash Melting Temperature

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Journal of Thermal Science 2022年第6期31卷 2189-2202页

作者： ZHANG Yandi YANG Huan WANG Bo HMShahzaib KHAN DUAN Xiaoli LIU Yinhe State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong UniversityXi'an Jiaotong UniversityXi'an 710049China

In slag tapping furnaces, char particles undergo a series of complex structural evolution before and after being captured by the liquid slag layer. The evolution results affect the carbon conversion rate and are affected by temperature fluctuations, especially in the ash melting temperature zone. Experimental study on structure evolution of bituminous char prepared at around ash melting temperature was carried out on a fixed bed. The morphology, specific surface area and mineral chemical composition were measured at different temperatures. Experimental results show that the number density and the size of ash droplets exuded on the char surface increased significantly with the increasing temperature. The ash specific surface area from gasification was slightly greater than that from combustion. The residual content of chloride in the char become 1% and the contents of Fe, K, Mg and Na decrease significantly during the pyrolysis process across the ash melting temperature zone. The diffraction intensity of oldhamite increase which indicates the reaction of carbon substrate with minerals during the evolution;the diffraction intensity of quartz dramatically decreases for the reason of anorthite generation. The ignition and burnout temperatures of char were found to increase and the combustion stability decreased with the increasing pyrolysis temperature.

关键词： coal char structure evolution carbothermal reaction combustion

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Formic acid dehydrogenation reaction on high-performance Pd_(x)Au_(1−x) alloy nanoparticles prepared by the eco-friendly slow synthesis methodology

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Frontiers in Energy 2023年第6期17卷 751-762页

作者： Yibo GAO Erjiang HU Bo HUANG Zuohua HUANG State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong UniversityXi’an 710049China Institute of Chemical Engineering and Technology Xi’an Jiaotong UniversityXi’an 712000China

Dehydrogenation of formic acid (FA) is considered to be an effective solution for efficient storage and transport of hydrogen. For decades, highly effective catalysts for this purpose have been widely investigated, but numerous challenges remain. Herein, the Pd_(x)Au_(1−x) (x = 0, 0.2, 0.4, 0.5, 0.6, 0.8, 1) alloys over the whole composition range were successfully prepared and used to catalyze FA hydrogen production efficiently near room temperature. Small PdAu nanoparticles (5–10 nm) were well-dispersed and supported on the activated carbon to form PdAu solid solution alloys via the eco-friendly slow synthesis methodology. The physicochemical properties of the PdAu alloys were comprehensively studied by utilizing various measurement methods, such as X-ray diffraction (XRD), N2 adsorption–desorption, high angle annular dark field-scanning transmission electron microscope (HAADF-STEM), X-ray photoelectrons spectroscopy (XPS). Notably, owing to the strong metal-support interaction (SMSI) and electron transfer between active metal Au and Pd, the Pd0.5Au0.5 obtained exhibits a turnover frequency (TOF) value of up to 1648 h−1 (313 K, nPd+Au/nFA = 0.01, nHCOOH/nHCOONa = 1:3) with a high activity, selectivity, and reusability in the FA dehydrogenation.

关键词： FA dehydrogenation face-centred cubic structures PdAu solid solution alloy nanoparticles slow synthesis methodology SMSI effect

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Hydrocarbon generation reaction kinetics study on supercritical water conversion of centimeter sized medium and low maturity organic-rich shale

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Petroleum Science 2025年第5期22卷 2203-2214页

作者： Xie, Tian Zhao, Qiu-Yang Jin, Hui Wang, Ye-Chun Guo, Lie-Jin College of New Energy Xi'an Shiyou University Shaanxi Xi'an710065 China State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Shaanxi Xi'an710049 China

Accurate prediction of the composition of pyrolysis products is the prerequisite for achieving directional regulation of organic-rich shale pyrolysis and conversion products. In this paper, the classical segmented pyrolysis kinetics model and a new refined pyrolysis kinetics model were used to forecast the composition distribution of hydrocarbon generation products co-heated by supercritical water and medium and low maturity organic-rich shale. The prediction accuracy of the two reaction kinetics models for the composition of pyrolysis products of organic-rich shale was compared. The reaction path of hydrocarbon generation in centimeter sized organic-rich shale under the action of supercritical water was identified. The results show that the prediction accuracy of the classical segmented pyrolysis kinetics model was poor at the initial stage of the reaction, and gradually increased with increasing time. The prediction error can reach less than 25% when the reaction time was 12 h. The new refined model of reaction kinetics established is better than the classical reaction kinetics model in predicting the product distribution of pyrolysis oil and gas, and its prediction error is less than 14% in this paper. The reaction paths of hydrocarbon generation in centimeter sized organic-rich shale under supercritical water conversion mainly include organic-rich shale directly generates asphaltene and saturated hydrocarbon, asphaltene pyrolysis generates saturated hydrocarbon, aromatic hydrocarbon and resin, saturated hydrocarbon, aromatic hydrocarbon and resin polymerization generates asphaltene, and saturated hydrocarbon, resin and asphaltene generates gas. The reason for the difference of centimeter sized and millimeter sized medium and low maturity organic-rich shales hydrocarbon generation in supercritical water is that the increase of shale size promotes the reaction path of polymerization of saturated hydrocarbon and aromatic hydrocarbon to asphaltene. © 2025 The Author

关键词： Crystallization kinetics

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Effect of Particle Orientation on Heat Transfer in Arrays of Prolate Particles

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Computer Modeling in Engineering & Sciences 2023年第8期136卷 1509-1526页

作者： Romana Basit Xinyang Li Zheqing Huang Qiang Zhou School of Chemical Engineering and Technology Xi’an Jiaotong UniversityXi’anChina State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong UniversityXi’anChina

Direct Numerical Simulations have been carried out to study the forced convection heat transfer of flow through fixed prolate particles for a variety of aspect ratios ar={5/4,5/3,5/1}with Reynolds number(Re)up to *** variations of the solid volume fraction c={0.1,0.2,0.3}with four Hermans orientation factors S={−0.5,0,0.5,1}are *** has been found that changes in S cause prominent variations in the Nusselt *** general,Nusselt number increases with the decrease of *** all three aspect ratios,the Nusselt number remains a linear function of S at different c and ***,it is concluded that,for heat transfer from prolate muti-particle system,the effects of orientations cannot be ignored.A new correlation for Nusselt number has been developed for arrays of prolate particles using the simulation data as a function of Re,c,S and ar.

关键词： Direct Numerical Simulation heat transfer lattice Boltzmann method particle orientations prolate particles

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