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

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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Particle convective heat transfer near the wall in a supercritical water fluidized bed by single particle model coupled with CFD-DEM

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Particuology 2023年第2期73卷 47-58页

作者： Tianning Zhang Zhen Wan Youjun Lu State Key Laboratory of Multiphase Flow in Power Engineering(SKLMFPE) Xi'an Jiaotong UniversityXi'an710049ShaanxiChina Xi'an Electronic Engineering Research Institute Xi'an710100ShaanxiChina

Supercritical water fluidized bed(SCWFB)is a promising reactor to gasify biomass or *** optimization design is closely related to wall-to-bed heat transfer,where particle convective heat transfer plays an important *** paper evaluates the particle convective heat transfer coefficient(h_(pc))at the wall in SCWFB using the single particle *** critical parameters in the single particle model which is difficult to get experimentally are obtained by the computational fluid dynamics-discrete element method(CFD-DEM).The contact statistics related to particle-to-wall heat transfer,such as contact number and contact distance,are also *** results show that particle residence time(τ),as the key parameter to evaluate h_(pc),is found to decrease with rising velocity,while increase with larger thermal boundary layer thickness.τfollows a gamma function initially adopted in the gas-solid fluidized bed,making it possible to evaluate h_(pc) in SCWFB by a simplified single particle *** theoretical predicted h_(pc) tends to increase with rising thermal gradient thickness at a lower velocity(1.5 U_(mf)),while first decreases and then increases at higher velocity(1.75 and 2 U_(mf)).h_(pc) occupies 30%-57%of the overall wall-to-bed heat transfer coefficient for a particle diameter of 0.25 *** results are helpful to predict the overall wall-to-bed heat transfer coefficient in SCWFB combined with a reasonable fluid convective heat transfer model from a theoretical perspective.

关键词： Supercritical water Fluidized bed Particle residence time Discrete element method Single particle model

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Review of spatial scale dispersion models (ATDMs) to simulate environmental dispersion and deposition of radionuclides and the overview of GIS coupling with dispersion models

International Journal of Advanced Nuclear Reactor Design and...

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International Journal of Advanced Nuclear Reactor Design and Technology 2024年第4期6卷 256-280页

作者： Muhammad, Hussaini Xuan, Wang Wang, Mingjun Su, Guanghui School of Nuclear Science and Technology Shanxi Key Laboratory of Advanced Nuclear Energy and Technology State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Xi'an710049 China Abuja Nigeria

Estimation of the radiological consequences including the calculation of radiation doses to the exposed population requires numerical evaluation of atmospheric radioactive releases from nuclear facilities under accidental scenarios for implementation of adequate protective and other response actions to prevent or minimize severe deterministic effects and reduce the probability of occurrence of stochastic effects. This paper reviews various state-of-the-art spatial scale atmospheric dispersion models, known as the ATDMs, designed to evaluate atmospheric transport, dispersion, and depositions of radionuclide emissions from release sources. The ATDMs (atmospheric transport, dispersion, and deposition models) reviewed in this paper are FLEXPART, CALPUFF, LADAS, RASCAL, RIMPUFF, and HotSpot. These ATDMs are increasingly applied to perform probabilistic radiological risk assessment, which is one of the IAEA safety requirements for site evaluation of new NPP, and the calculated doses can be used to establish EPZs, an underlying basis of emergency preparedness. The numerical approaches, modeling methodology, advantages, limitations, scope of applications, and research investigations performed using these models in radiological and other environmental impact assessments within their scope of applications are presented. GIS has been widely recognized as a technique applied to aid the modeling of pollutant dispersion and visualization of model outputs in a spatial context, among other benefits. In nuclear accident consequence evaluation, spatial data provides key information such as accident location, range of radiological contamination, population density, etc, which are very important. This demonstrates the high significance of GIS-ATDMs coupling. Therefore, an overview of the coupling of dispersion models with GIS is also highlighted. © 2025 Xi'an Jiaotong University

关键词： Risk assessment

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Effect of introducing oxygen into ethylene tar pitches on their carbonaceous products

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Chinese Journal of Chemical engineering 2024年第12期76卷 135-146页

作者： Rongqi Chen Yongzheng Zhang Yanli Wang Chunyin Shen Liang Zhan Licheng Ling State Key Laboratory of Green Chemical Engineering and Industrial Catalysis Key Laboratory of Specially Functional Polymeric Materials and Related Technology(Ministry of Education)Shanghai Key Laboratory of Multiphase Materials Chemical EngineeringState Key Laboratory of Chemical EngineeringEast China University of Science and TechnologyShanghai 200237China

Ethylene tar is a prospective precursor for preparing carbonaceous materials,which is regarded as a representative soft carbon material after ***,the introduction of oxygen can influence the morphology of the final carbonaceous *** the introduction of oxygen,dealkylation and dehydrogenation will be promoted and the molecules can be linked more *** the subsequent carbonization,the biphenyl structures caused by the deoxygenation via the elimination of CO_(2),as well as the reserved aromatic ether bonds,can facilitate the strong cross-linking,which will restrain the movement of the carbon layers and the formation of the graphitic *** the graphitization treatment at 2800℃,the oxidized pitch can lead to short-range ordered and long-range unordered structures,while the sample without oxidation can result in long-range ordered graphitic *** can be proved that a simple oxidation-carbonization treatment can transform ethylene tar into hard carbon structures.

关键词： Fuel Oxidation Ethylene tar pitch Carbonization Hard carbon Chemical processes

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Modulating redox transition kinetics by anion regulation in Ni-Fe-X(X=O,S,Se,N,and P)electrocatalyst for efficient water oxidation

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Nano Research 2024年第6期17卷 4720-4728页

作者： Liting Wei Kaini Zhang Rui Zhao Lei Zhang Yan Zhang Suyi Yang Jinzhan Su International Research Center for Renewable Energy&State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong UniversityXi’an 710049China Department of Applied Chemistry Yuncheng UniversityYuncheng 044000China

NiFe-based electrocatalysts will experience dynamical surface reconstruction during oxygen evolution reaction(OER)process,and the derived metal(oxy)hydroxide hybrids on the surface have been considered as the actual active species for *** efforts have been dedicated to understanding the surface reconstruction,but there is rare research on recognizing the origin of improved performance derived from anion species of ***,the OER electrocatalytic characteristics were tuned with different anions in NiFe-based catalyst,using NiFe-based oxides/nitride/sulfide/selenides/phosphides(NiFeX,X=O,N,S,Se,and P)as the model *** combination of X-ray photoelectronic spectroscopy,electrochemical tests,operando spectroscopic characterizations,and density functional theory(DFT)calculations,reveals that anion with lower electronegativity in NiFe-based catalyst leads to higher conductivity and delayed valence transition of Ni sites,as well as optimized adsorption behavior towards oxygen intermediates,contributing to enhanced OER ***,NiFeP electrocatalyst demonstrates an ultralow overpotential of 265 mV at 20 mA·cm−2 for OER,as well as long-term *** work not only offers further insights into the effect of anionic electronegativity on the intrinsic OER electrocatalytic properties of NiFe-based electrocatalyst but also provides guide to design efficient non-noble metal-based electrocatalysts for water oxidation.

关键词： oxygen evolution reaction(OER) anion species electronegativity valence transition

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Electrospinning engineering of gas electrodes for high-performance lithium-gas batteries

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Carbon Energy 2024年第10期6卷 353-398页

作者： Jingzhao Wang Xin Chen Jianan Wang Xiangming Cui Ze Wang Guangpeng Zhang Wei Lyu Maxim Shkunov S.Ravi P.Silva Yaozu Liao Kai Yang Wei Yan State Key Laboratory of Multiphase Flow in Power Engineering Department of Environmental Science and EngineeringSchool of Energy and Power EngineeringXi'an Jiaotong UniversityXi'anChina Advanced Technology Institute University of SurreyGuildfordSurreyUK State Key Laboratory for Modification of Chemical Fibers and Polymer Materials College of Materials Science and EngineeringDonghua UniversityShanghaiChina

Lithium-gas batteries(LGBs)have garnered significant attention due to their impressive high-energy densities and unique gas conversion ***,the practical application of LGBs faces substantial challenges,including sluggish gas conversion kinetics inducing in low-rate performance and high overpotential,along with limited electrochemical reversibility leading to poor cycle *** imperative task is to develop gas electrodes with remarkable catalytic activity,abundant active sites,and exceptional electrochemical ***,a versatile and well-established technique for fabricating fibrous nanomaterials,has been extensively explored in LGB *** this work,we emphasize the critical structure-property for ideal gas electrodes and summarize the advancement of employing electrospun nanofibers(NFs)for performance enhancement in *** elucidating the fundamental principles of LGBs and the electrospinning technique,we focus on the systematic design of electrospun NF-based gas electrodes regarding optimal structural fabrication,catalyst handling and activation,and catalytic site optimization,as well as considerations for large-scale *** demonstrated principles and regulations for electrode design are expected to inspire broad applications in catalyst-based energy applications.

关键词： carbon nanofibers electrocatalyst electrospinning gas electrodes metal-gas batteries

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

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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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An active learning workflow for predicting hydrogen atom adsorption energies on binary oxides based on local electronic transfer features

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Green Energy & Environment 2024年第10期9卷 1489-1496页

作者： Wenhao Jing Zihao Jiao Mengmeng Song Ya Liu Liejin Guo International Research Center for Renewable Energy State Key Laboratory of Multiphase Flow in Power EngineeringXi'an Jiaotong UniversityShaanxi710049Xi'anChina Department of Energy and Power Engineering Shandong University of TechnologyZibo255000ShandongChina

Machine learning combined with density functional theory(DFT)enables rapid exploration of catalyst descriptors space such as adsorption energy,facilitating rapid and effective catalyst ***,there is still a lack of models for predicting adsorption energies on oxides,due to the complexity of elemental species and the ambiguous coordination *** work proposes an active learning workflow(LeNN)founded on local electronic transfer features(e)and the principle of coordinate rotation *** accurately characterizing the electron transfer to adsorption site atoms and their surrounding geometric structures,LeNN mitigates abrupt feature changes due to different element types and clarifies coordination *** a result,it enables the prediction of^(*)H adsorption energy on binary oxide surfaces with a mean absolute error(MAE)below 0.18 ***,we incorporate local coverage(θ_(l))and leverage neutral network ensemble to establish an active learning workflow,attaining a prediction MAE below 0.2 eV for 5419 multi-^(*)H adsorption *** findings validate the universality and capability of the proposed features in predicting^(*)H adsorption energy on binary oxide surfaces.

关键词： Machine learning Adsorption energy Binary oxide Electron transfer Active learning

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