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Carbon Energy 2025年第2期7卷 121-130页

作者： Tianyi Xu Dongxu Jiao Jinchang Fan Yilong Dong Zhaoyong Jin Lei Zhang Wei Zhang Jingxiang Zhao Weitao Zheng Xiaoqiang Cui State Key Laboratory of Automotive Simulation and Control Key Laboratory of Automobile MaterialsMinistry of EducationSchool of Materials Science and EngineeringJilin UniversityChangchunChina College of Chemistry Jilin UniversityChangchunChina Key Laboratory of Photonic and Electronic Bandgap Materials Ministry of EducationCollege of Chemistry and Chemical EngineeringHarbin Normal UniversityHarbinChina

Strain effects have garnered significant attention in catalytic applications due to their ability to modulate the electronic structure and surface adsorption properties of *** this study,we propose a novel approach called“similar stacking”for stress modulation,achieved through the loading of Co_(2)P on Ni_(2)P(Ni_(2)P/Co_(2)P).Theoretical simulations reveal that the compressive strain induced by Co_(2)P influences orbital overlap and electron transfer with hydrogen ***,the number of stacked layers can be adjusted by varying the precursor soaking time,which further modulates the strain range and hydrogen *** a 2-h soaking condition,the strain effect proves favorable for efficient hydrogen *** characterizations using X-ray diffraction,high-angel annular dark-field scanning transmission election microscope(HAADF-STEM),and X-ray absorption near-edge structure spectroscopy successfully demonstrate lattice contraction of Co_(2)P and bond length shortening of ***,our catalyst shows an ultrahigh current density of 1 A cm^(-2) at an overpotential of only 388 mV,surpassing that of commercial Pt/C,while maintaining long-term *** material design strategy of similar stacking opens up new avenues of strain modulation and the deeper development of electrocatalysts.

关键词： compressive strain heterogeneous phosphide hydrogen evolution reaction similar stacking

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Microbial Electrochemical Wastewater Refining

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Engineering 2025年第3期46卷 245-256页

作者： Na Chu Daping Li Raymond Jianxiong Zeng Yong Jiang Peng Liang Fujian Key Laboratory of Pollution Control and Resource Reuse College of Environmental and Resource SciencesFujian Normal UniversityFuzhou 350117China CAS Key Laboratory of Environmental and Applied Microbiology Environmental Microbiology Key Laboratory of Sichuan ProvinceChengdu Institute of BiologyChinese Academy of SciencesChengdu 610041China Fujian Provincial Key Laboratory of Soil Environmental Health and Regulation College of Resources and EnvironmentFujian Agriculture and Forestry UniversityFuzhou 350002China State Key Joint Laboratory of Environment Simulation and Pollution Control School of EnvironmentTsinghua UniversityBeijing 100084China

Wastewater treatment significantly contributes to greenhouse gas emissions,which are further exacerbated by the environmental impact of external chemical *** response,microbial electrochemical wastewater refining has gained prominence at the interdisciplinary frontier of wastewater resource recovery and green *** progress has been made in utilizing active electrodes to stimulate CO_(2) fixation rates,applying“binary electron donors”to produce high-value-added chemicals,and developing novel processes and *** review explores various aspects of microbial electrochemical wastewater refining,including microbial electrochemical monitoring of water quality,chemical synthesis from diverse carbon sources,and the deployment of pilot-scale systems for generating electricity,hydrogen,and methane,as well as for in-situ ***,it discusses the challenges and future directions,highlighting the importance of understanding mechanisms,advancing electrocatalyst and microbial engineering,and innovating hybrid *** conclusion,the widespread adoption of microbial electrochemical wastewater refining is emphasized for resource recovery and sustainable chemical production,ultimately reducing environmental impact.

关键词： Microbial electrosynthesis Extracellular electron transfer CO_(2)reduction Wastewater treatment Resources recovery

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simulation study on stratification and homogeneous combustion of an H2O2-ethanol/gasoline combined injection engine 5

Simulation study on stratification and homogeneous combustio...

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5th International Conference on Mechanical Engineering and Materials, ICMEM 2024

作者： Sun, Ping Zhang, Jufang Yu, Xiumin Li, Decheng College of Automotive Engineering Jilin University Changchun130022 China State Key Laboratory of Automotive Simulation and Control Jilin University Changchun130022 China State Key Laboratory of Automotive Simulation and Control Jilin University Renmin Street 5988 Changchun130022 China

ISBN: (数字)9781510688971

ISBN: (纸本)9781510688964

Due to the imperfect fuel characteristics, the specific fuel consumption of ethanol fuel was larger than that of gasoline, which limited the application of ethanol fuel in the engine field. H2O2 is a strong activity additive to regulate fuel properties. In this paper, the Converge simulation platform was used to study the effects of H2O2 additive on temperature field distribution and micro-active radicals of an SI combined injection engine fueled by ethanol/gasoline under the stratification and homogeneous combustion. The research results showed that the H2O2 additive could effectively promote flame core formation and development and have a more significant effect on the stratification combustion. Considering the whole power stroke, the combustion of the homogeneous mixture was more complete, the active groups were more, the heat loss was less, and the output power of the engine was greater. In general, 20% H2O2 additive plus DIT = 300°CA BTDC could contribute to the power and ultra-low emissions of the engine. © 2025 SPIE.

关键词： Flame research

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Thermodynamic-based ecological scaling theory in urban metabolic framework:a review

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Frontiers of Environmental Science & Engineering 2025年第1期19卷 69-85页

作者： Gengyuan Liu Mingwan Wu State Key Joint Laboratory of Environmental Simulation and Pollution Control School of EnvironmentBeijing Normal UniversityBeijing 100875China Beijing Engineering Research Center for Watershed Environmental Restoration&Integrated Ecological Regulation Beijing 100875China

Prior research has consistently demonstrated that urban economic and social systems adhere to the empirical scaling ***,a plethora of evidence,including the scale-free networks of energy metabolism,the allometric growth patterns of species and populations,and the scaling law relationship between exergy and transformity in biosphere systems across various levels,indicates that urban ecosystems exhibit multi-level scaling law characteristics in energy metabolism under self-organization,alongside significant human activity *** study synthesizes these findings to hypothesize that urban ecological components are also aligned with system-level scaling theory within the urban metabolism *** encompasses:1)the existence of multistable coexistence and mutual transformation phenomena,mirroring the dynamic nature of scaling laws;and 2)a nuanced balance between the ecosystem and the socio-economic system,particularly in the realms of spatial competition and output *** ecosystem scaling theory hypotheses of urban metabolic processes offer a theoretical foundation for identifying ecological security tipping points,which are pivotal in the strategic decision-making for ecological planning and management in the future.

关键词： Ecosystem scaling theory Urban metabolism Complexity Critical review

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Construction of Multi-Scale Aging Indicators Based on the Aging Mechanism of Fuel Cells

Construction of Multi-Scale Aging Indicators Based on the Ag...

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2024 Vehicle Powertrain Diversification Technology Forum, VPD 2024

作者： Lin, Yipeng Min, Haitao Sheng, Xia Zhang, Zhaopu Sun, Weiyi Jilin University State Key Laboratory of Automotive Simulat China China FAW Corporation Limited General Research and Developm China State Key Laboratory of Automotive Simulation and Control China

state of health (SOH) estimation is essential to ensure safety and reliability in the operation of Proton Exchange Membrane Fuel Cells (PEMFCs). The aging of fuel cells results from the deterioration of multiple internal components, and the aging degree of some key components even directly determines the end of cell life. Due to the complexity of the internal reactions in fuel cell, many internal parameters cannot be measured or recorded during aging tests. In addition, external characteristics do not reflect the internal changes in the cell. Therefore, establishing a multi-scale metric based on fuel cell components is very important for fuel cell life research. During the aging process of a fuel cell, the contributions of different components to the overall aging vary significantly. Additionally, the allocation of indicator parameters presents a challenge in multi-scale modeling. To address these issues, this paper proposes a method to construct multi-scale indicators for fuel cells. Firstly, based on the operational mechanisms of fuel cells, a 3-D Computational Fluid Dynamics (CFD) model of the fuel cell is developed using COMSOL Multiphysics 6.2 to simulate the working environment of the fuel cell. In addition, based on existing research, the aging mechanisms of various fuel cell components are analyzed, and aging models are established. The aging of selected components is then simulated in MATLAB R2023a based on the component aging mechanism model. Moreover, a co-simulation platform based on COMSOL and MATLAB is established to facilitate parameter interaction and iteration between the two models, thereby obtaining the aging data of the cell. Finally, the data is analyzed to select parameters and allocate coefficients for the multi-scale aging indicators. The multi-scale aging indicator can provide an effective approach to characterizing the aging state of fuel cells. © 2025 SAE International.

关键词： MATLAB

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Enhanced Cd^(2+)removal from aqueous solution using olivine and magnesite combination:New insights into the mechanochemical synergistic effect

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Journal of Environmental Sciences 2025年第1期147卷 714-725页

作者： Xiaofang Chen Chao Wang Min Chen Huimin Hu Junwei Huang Ting Jiang Qiwu Zhang School of Resources&Environmental Engineering Wuhan University of TechnologyWuhan 430070China State Environmental Protection Key Laboratory of Water Environmental Simulation and Pollution Control South China Institute of Environmental SciencesMinistry of Ecology and EnvironmentGuangzhou 510655China

In this study,an efficient stabilizer material for cadmium(Cd^(2+))treatment was successfully prepared by simply co-milling olivine with *** analyticalmethods including XRD,TEM,SEM and FTIR,combined with theoretical calculations(DFT),were used to investigate mechanochemical interfacial reaction between twominerals,and the reaction mechanism of Cd removal,with ion exchange between Cd^(2+)and Mg^(2+)as the main pathway.A fixation capacity of Cd^(2+)as high as 270.61 mg/g,much higher than that of the pristine minerals and even the individual/physical mixture of milled olivine and magnesite,has been obtained at optimized conditions,with a neutral pH value of the solution after treatment to allow its direct *** as-proposed Mg-based stabilizer with various advantages such as cost benefits,green feature etc.,will boosts the utilization efficiency of naturalminerals over the elaborately prepared adsorbents.

关键词： Olivine Magnesite Interface reaction Mechanochemical activation Cadmium removal

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Enhancing ozone catalytic decomposition through acid treatment ofα-MnO_(2) for improved activity and humidity resistance

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Journal of Environmental Sciences 2025年第3期149卷 35-45页

作者： Shangchao Xiong Kai Zhang Zhenghao Xu Hongjun Ou Yuanyuan Zheng Xi Li Yue Peng Xubiao Luo Junhua Li School of Life Sciences Jinggangshan UniversityJi’an 343009China Faculty of Geosciences and Environmental Engineering Southwest Jiaotong UniversityChengdu 610031China State Key Joint Laboratory of Environment Simulation and Pollution Control School of EnvironmentTsinghua UniversityBeijing 100084China

Post-etching method using dilute acid solutions is an effective technology to modulate the surface compositions of metal-oxide *** theα-MnO_(2) catalyst treated with 0.1 mol/L nitric acid exhibits higher ozone decomposition activity at high relative humidity than the counterpart treated with acetic *** the increases in surface area and lattice dislocation,the improved activity can be due to relatively higher Mn valence on the surface and newly-formed Brønsted acid sites adjacent to oxygen *** remnant nitro species deposited on the catalyst by nitric acid treatment is ideal hydrophobic groups at ambient *** decomposition route is also proposed based on the DRIFTS and DFT calculations:ozone is facile to adsorb on the oxygen vacancy,and the protonic H of Brønsted acid sites bonds to the terminal oxygen of ozone to accelerate its cleavage to O_(2),reducing the reaction energy barrier of O_(2) desorption.

关键词： Ozone decomposition α-MnO_(2) Brønsted acid sites H-bonds Post-etching

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Machine learning driven rational design of dual atom catalysts on graphene for carbon dioxide electroreduction

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Nano Research 2025年第1期18卷 186-194页

作者： Dongxu Jiao Xinyi Li Mingzi Sun Lin Liu Jinchang Fan Jingxiang Zhao Bolong Huang Xiaoqiang Cui State Key Laboratory of Automotive Simulation and Control School of Materials Science and Engineeringand Key Laboratory of Automobile Materials of MOEJilin UniversityChangchun 130012China Department of Applied Biology and Chemical Technology The Hong Kong Polytechnic UniversityHung HomKowloonHong KongChina College of Chemistry and Chemical Engineering and Key Laboratory of Photonic and Electronic Bandgap MaterialsMinistry of EducationHarbin Normal UniversityHarbin 150025China

The development of high-performance atomiccatalysts for the carbon dioxide reduction reaction(CO_(2)RR)is atime-consuming process due to the complexity of the reactionmechanism and the uncertainty of the active ***,wehave proposed combining density functional theory(DFT)andmachine learning(ML)to investigate the potential of topologicalgraphene-based dual-atom catalysts(DACs)as CO_(2)*** analyzing the ML results,we identify thenumber of d-orbital electrons in the active site as a key factorinfluencing the CO_(2)RR catalytic ***,wepropose a simple descriptor to measure the CO_(2)RR activity ofthese *** findings provide plausible explanations for thesynergistic interactions between bimetallic atoms in CO_(2)RR andallow us to screen the homogeneous Ni-Ni pair as the mostpromising dual-atom *** work offers a fast MLapproach based on limited DFT calculations to predict the mostelectroactive and stable DACs on carbon support for CO_(2)RR,facilitating rapid screening of high-performance dual-atomcatalysts.

关键词： CO_(2)reaction reduction dual-atom catalysts density functional theory machine learning

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Enhancing deformation characteristics prediction of coarse-grained soils with time-series generative adversarial network-based data augmentation and pre-training

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Frontiers of Structural and Civil Engineering 2025年第3期19卷 396-410页

作者： Ying ZHANG Meng JIA Xuedong ZHANG Liping CAO Ziying AN Hongchao WANG Jinyu WANG School of Control and Computer Engineering North China Electric Power UniversityBeijing 102206China The State Key Laboratory of Simulation and Regulation of Water Cycle in River Basin China Institute of Water Resources and Hydropower ResearchBeijing 100038China

Coarse-grained soils are fundamental to major infrastructures like embankments,roads,and *** their deformation characteristics is essential for ensuring structural *** methods,such as triaxial compression tests and numerical simulations,face challenges like high costs,time consumption,and limited generalizability across different soils and *** address these limitations,this study employs deep learning to predict the volumetric strain of coarse-grained soils as axial strain changes,aiming to obtain the axial strain(ε_(a))-volumetric strain(ε_(v))curve,which helps derive key mechanical parameters like cohesion(c),and elastic modulus(E).However,the limited data from triaxial tests poses challenges for training deep learning *** propose using a Time-series Generative Adversarial Network(TimeGAN)for data ***,we apply feature importance analysis to assess the quality of the numerical augmented data,providing feedback for improving the TimeGAN *** further enhance model performance,we introduce the pre-training strategy to reduce bias between augmented and real *** results demonstrate that our approach effectively predictscurve,with the mean absolute error(MAE)of 0.2219 and the R^(2) of *** analysis aligns with established findings in soil mechanics,underscoring the potential of our method in engineering applications.

关键词： coarse-grained soils deformation characteristics TimeGAN data augmentation pre-training

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Superhydrophobic ceramic membrane coupled with a biphasic solvent for efficient CO_(2)capture

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Green Energy & Environment 2025年第4期10卷 834-844页

作者： Kaili Xue Zhen Chen Xiaona Wu Heng Zhang Haiping Chen Junhua Li State Key Joint Laboratory of Environment Simulation and Pollution Control School of EnvironmentTsinghua UniversityBeijing100084China Beijing Key Laboratory of Pollutant Monitoring and Control in Thermoelectric Production Process School of EnergyPower and Mechanical EngineeringNorth China Electric Power UniversityBeijing102206China MOE Key Laboratory of Resources and Environmental Systems Optimization College of Environmental Science and EngineeringNorth China Electric Power UniversityBeijing102206China

An innovative strategy was proposed by integration of membrane contactor(MC)with biphasic solvent for efficient CO_(2) capture from flue *** accessible fly ash-based ceramic membrane(CM)underwent hydrophobic modification through silane grafting,followed by fluoroalkylsilane decoration,to prepare the superhydrophobic membrane(CSCM).The CSCM significantly improved resistance to wetting by the biphasic solvent,consisting of amine(DETA)and sulfolane(TMS).Morphological characterizations and chemical analysis revealed the notable enhancements in pore structure and hydrophobic chemical groups for the modified *** of wetting/bubbling behavior based on static wetting theory referred the liquid entry pressure(LEP)of CSCM increased by 20 kPa compared to pristine *** with traditional amine solvents,the biphasic solvent presented the expected phase *** experiments demonstrated that the CO_(2) capture efficiency of the biphasic solvent increased by 7%,and the electrical energy required for desorption decreased by 32%.The 60-h continuous testing and supplemental characterization of used membrane confirmed the excellent adaptability and durability of the *** study provides a potential approach for accessing hydrophobic ceramic membranes and biphasic solvents for industrial CO_(2) capture.

关键词： Carbon capture Membrane contactor Hydrophobic modification Membrane wetting Biphasic solvent

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