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A hybrid spatial-temporal deep learning prediction model of industrial methanol-to-olefins process

Frontiers of Chemical Science and Engineering 2024年第4期18卷 73-85页

作者： Jibin Zhou Xue Li Duiping Liu Feng Wang Tao Zhang Mao Ye Zhongmin Liu National Engineering Research Center of Lower-Carbon Catalysis Technology Dalian Institute of Chemical PhysicsChinese Academy of SciencesDalian 116023China Yulin Innovation institute for clean energy Clean Energy Innovation Institute of Chinese Academy of SciencesYulin 719053China Xuelang Industrial Intelligence Technology Co. Ltd.Wuxi 214000China

Methanol-to-olefins,as a promising non-oil pathway for the synthesis of light olefins,has been successfully *** accurate prediction of process variables can yield significant benefits for advanced process control and *** challenge of this task is underscored by the failure of traditional methods in capturing the complex characteristics of industrial processes,such as high nonlinearities,dynamics,and data distribution shift caused by diverse operating *** this paper,we propose a novel hybrid spatial-temporal deep learning prediction model to address these ***,a unique data normalization technique called reversible instance normalization is employed to solve the problem of different data ***,convolutional neural network integrated with the self-attention mechanism are utilized to extract the temporal ***,a multi-graph convolutional network is leveraged to model the spatial ***,the extracted temporal and spatial features are fused as input into a fully connected neural network to complete the ***,the outputs are denormalized to obtain the ultimate *** monitoring results of the dynamic trends of process variables in an actual industrial methanol-to-olefins process demonstrate that our model not only achieves superior prediction performance but also can reveal complex spatial-temporal relationships using the learned attention matrices and adjacency matrices,making the model more ***,this model is deployed onto an end-to-end Industrial Internet Platform,which achieves effective practical results.

关键词： methanol-to-olefins process variables prediction spatial-temporal self-attention mechanism graph convolutional network

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Liquid metal as an efficient protective layer for lithium metal anodes in all-solid-state batteries

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Carbon energy 2024年第7期6卷 219-229页

作者： Shiqiang Zhou Mengrui Li Peike Wang Lukuan Cheng Lina Chen Yan Huang Boxuan Cao Suzhu Yu Qingju Liu Jun Wei Shenzhen Key Laboratory of Flexible Printed Electronics Technology Harbin Institute of TechnologyShenzhenChina School of materials Science and Engineering Harbin Institute of TechnologyShenzhenChina State Key Laboratory of advanced Welding and Joining Harbin Institute of TechnologyHarbinChina Yunnan Key Laboratory for Micro/Nano materials and Technology School of Materials and EnergyYunnan UniversityKunmingChina

Lithium metal batteries with inorganic solid-state electrolytes have emerged as strong and attractive candidates for electrochemical energy storage devices because of their high-energy content and ***,inherent challenges of deleterious lithium dendrite growth and poor interfacial stability hinder their commercial ***,we report a liquid metal-coated lithium metal(LM@Li)anode strategy to improve the contact between lithium metal and a Li6PS5Cl inorganic *** LM@Li symmetric cell shows over 1000 h of stable lithium plating/stripping cycles at 2mA cm^(-2) and a significantly higher critical current density of 9.8 mAcm^(-2) at 25°*** addition,a full battery assembled with a high-capacity composite LiNbO3@-LiNi_(0.7)Co_(0.2)Mn_(0.1)O_(2)(LNO@NCM721)cathode shows stable cycling *** and computational results have demonstrated that dendrite growth tolerance and physical contact in solid-state batteries can be reinforced by using LM interlayers for interfacial modification.

关键词： all-solid-state batteries interface engineering liquid metals lithium metal anodes

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Tuning oxygen redox via transition-metal cation species

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Science China Chemistry 2024年第7期67卷 2130-2131页

作者： Sichen Jiao Xuelong Wang Xiqian Yu Beijing Frontier Research Center on clean energy Institute of PhysicsChinese Academy of SciencesBeijing 100190China Center of materials Science and Optoelectronics Engineering University of Chinese Academy of SciencesBeijing 100049China

Lithium-rich layered oxides with a general formula of Li[Li_(x)Ni_(y)MnzCo_(1–x–y–z)]O_(2)(Li-rich NMCs,elements in bracket reside in the same layer)are recognized as promising candidates for the next generation hi... 详细信息

关键词： lithium oxides transition

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Emerging high-entropy strategy: A booster to the development of cathode materials for power batteries

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Journal of advanced Ceramics 2024年第8期13卷 1093-1118页

作者： Liping Huang Jinging Zhu J-Xuan Liu Houzheng Wu Guo-Jun Zhang State Key Laboratory for Modification of Chemical Fibers and Polymer materials Institute of Functional MaterialsCollege of Materials Science and EngineeringDonghua UniversityShanghai 201620China SIAMC advanced materials Cooperation Huzhou 313100China

The coordinated development of new energy vehicles and the energy storage industry has become essential for reducing carbon *** cathode material is the key material that determines the energy density and cost of a power battery,but currently developed and applied cathode materials cannot meet the requirements for high specific capacity,low cost,safety,and good ***-entropy materials(HEMs)are a new type of single-phase material composed of multiple principal elements in equimolar or near-equimolar *** interaction between multiple elements can play an important role in improving the comprehensive properties of the material,which is expected to solve the limitations of battery materials in practical ***,this review provides a comprehensive overview of the current development status and modification strategies of power batteries(lithium-ion batteries(LiBs)and sodium-ion batteries(SIBs)),proposes a high-entropy design strategy,and analyses the structure-activity relationship between the high-entropy effects and battery ***,future research topics related to high-entropy cathode materials,including computational guide design,specific synthesis methods,high-entropy electrochemistry,and high-throughput databases,are *** review aims to provide practical guidance for the development of high-entropy cathode materials for next-generation power batteries.

关键词： cathode materials lithium-ion battery(LIB) sodium-ion battery(SIB) high-entropy strategy

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Regulating solid electrolyte interphase film on fluorinedoped hard carbon anode for sodium-ion battery

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Carbon energy 2024年第6期6卷 200-215页

作者： Cuiyun Yang Wentao Zhong Yuqiao Liu Qiang Deng Qian Cheng Xiaozhao Liu Chenghao Yang Guangzhou Key Laboratory for Surface Chemistry of energy materials New Energy Research InstituteSchool of Environment and EnergySouth China University of TechnologyGuangzhouChina

For the performance optimization strategies of hard carbon,heteroatom doping is an effective way to enhance the intrinsic transfer properties of sodium ions and electrons for accelerating the reaction ***,the previous work focuses mainly on the intrinsic physicochemical property changes of the material,but little attention has been paid to the resulting interfacial regulation of the electrode surface,namely the formation of solid electrolyte interphase(SEI)*** this work,element F,which has the highest electronegativity,was chosen as the doping source to,more effectively,tune the electronic structure of the hard *** effect of F-doping on the physicochemical properties of hard carbon was not only systematically analyzed but also investigated with spectroscopy,optics,and in situ characterization techniques to further verify that appropriate F-doping plays a positive role in constructing a homogenous and inorganic-rich SEI *** experimentally demonstrated link between the electronic structure of the electrode and the SEI film properties can reframe the doping optimization strategy as well as provide a new idea for the design of electrode materials with low reduction kinetics to the *** a result,the optimized sample with the appropriate F-doping content exhibits the best electrochemical performance with high capacity(434.53 mA h g^(-1)at 20mA g^(-1))and excellent rate capability(141 mAh g^(-1)at 400 mA g^(-1)).

关键词： F-doping hard carbon reduction kinetics sodium-ion batteries solid electrolyte interphase film

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Simultaneous removal of 1,2-dichlorobenzene and furan over Mn-Ce-Fe oxide catalyst:Catalytic activity and product analysis

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Journal of Rare Earths 2024年第5期42卷 972-979,I0006页

作者： Juan Qiu Minghui Tang Yaqi Peng Xuanhao Guo Shengyong Lu Jianhua Yan Taizhou institute of Zhejiang University Taizhou 318000China State Key Laboratory for clean energy Utilization Institute for Thermal Power EngineeringZhejiang UniversityHangzhou 310027China

The Mn-Ce-Fe mixed oxide(MCFe)was prepared by co-precipitation and the catalytic performance was tested by using 1,2-dichlorobenzene(1,2-DCB)and furan as model molecules of PCDD/*** effect of O_(2)concentration,SO_(2) and NO on the catalytic activity was *** 270℃,the MCFe oxide catalyst presents significant simultaneous removal efficiency of 75.25%and 100%for 1,2-DCB and furan,***-Emmett-Teller(BET)method(BET),X-ray diffraction(XRD),scanning electron microscopy(SEM),X-ray photoelectron spectroscopy(XPS),Fourier transform infrared spectroscopy(FTIR),H_2-temperature programmed reduction(H_(2)-TPR),NH_(3)-temperature programmed desorption(NH_3-TPD)and O_(2)-TPD were used to characterize the catalysts before and after the *** tests suggest that the oxidation behavior of furan occurred prior to that of 1,*** to the intermediate products detected by gas chromatography-mass spectrometry(GC-MS),the by-products include chlorinated hydrocarbons,long-chain hydrocarbons,ketone,*** catalytic oxidation reaction paths are proposed.

关键词： 1 2-dichlorobenzene Furan Catalytic oxidation Product analysis Rare earths

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Unleashing the Power of Bio-based Thermotropic Liquid Crystal Modifiers:Toughening and Reinforcing Petroleum-based Epoxy Resin without Compromising Other Properties

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Chinese Journal of Polymer Science 2024年第8期42卷 1093-1102页

作者： Qing-Yun Lu Hong-Wei Gu Jia-Hui Li Qian-Qian Fan Bei-Tao Liu Yan Kou Xi-Gao Jian Zhi-Huan Weng State Key Laboratory of Fine Chemicals Frontiers Science Center for Smart MaterialsLiaoning Technology Innovation Center of High Performance Resin MaterialsDepartment of Polymer Science&EngineeringDalian University of TechnologyDalian 116024China Thermochemistry Laboratory Liaoning Province Key Laboratory of Thermochemistry for Energy and MaterialsDalian National Laboratory for Clean EnergyDalian Institute of Chemical PhysicsChinese Academy of SciencesDalian 116023China

Toughening the petroleum-based epoxy resin blends with bio-based modifiers without compromising their modulus,mechanical strength,and other properties is still a big challenge in view of the *** this study,a bio-based liquid crystal epoxy resin(THMT-E P)with an s-triazine ring structure was utilized to modify a petroleum-based bisphenol A epoxy resin(E51)with 4,4'-diaminodiphenylsulfone(DDS)as a curing agent,and the blended systems were evaluated for their thermal stability,mechanical properties,and flame *** results showed that the impact strength of the blended system initially increased and then decreased with the increase in THMT-EP content,and it reached the a maximum value of 26.5 kJ/m^(2)when the THMT-EP content was 5%,which was 31.2%higher than that of E51/***,the flexural strength,modulus,and glass transition tem perature of the blended system were all simultaneously improved with the addition of *** the same time,the addition of THMT-EP enhanced the flame retardancy of the system by increasing the char yield at 700℃and decreasing the peak heat release rate and total heat release *** work paves the way for a more sustainable improvement in the comprehensive performance of epoxy resin.

关键词： Epoxy resin Toughening Bio-based Thermotropic liquid crystal

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Hierarchical FeO_(χ)H_(y)@Ni_(3)B hybrid for efficient alkaline oxygen evolution at high current density

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Journal of energy Chemistry 2024年第7期94卷 599-607页

作者： Fuxi Liu Qing Liang Zhenyu Li Meiqi Liu Nailin Yue Zizhun Wang Xu Zou Wei Zhang Key Laboratory of Automobile materials Ministry of Education School of Materials Science&EngineeringElectron Microscopy CenterInternational Center of Future ScienceJilin Provincial International Cooperation Key Laboratory of High-Efficiency Clean Energy MaterialsJilin UniversityChangchun 130012JilinChina

Electrocatalysts with high activity and long-term durability are vital toward large-scale hydrogen pro-duction from electrocatalytic water ***,the self-supported electrode(FeO_(χ)H_(y)@Ni_(3)B/NF)with hierarchical heterostructure was simply prepared by using Ni_(3)B chunks grown on nickel foam as sub-strate to in situ form vertical FeO_(χ)H_(y)*** hybrid shows efficient oxygen evolution reaction activity with overpotentials as low as 267 and 249 mV at 100 mA cm^(-2)in 1 M KOH solution and 30 wt%KOH solution,***,it also exhibits excellent catalytic stability,sustaining catalysis at 500 mA cm^(-2)in 1 M KOH solution for 200 h,and even for 200 h at 1000 mA cm^(-2)in 30 wt%KOH *** experimental results reveal that the FeO_(χ)H_(y)@Ni_(3)B/NF is endowed with superhydrophilic and superaerophobic surface properties,which not only provide more mass transport channels,as well as facilitated the diffusion of reaction intermediates and gas ***,it holds faster reaction kinetics,more accessible active sites and accelerated electron transfer rates due to strong synergistic interactions attheheterogeneous interface.

关键词： FeO_(χ)H_(y)@Ni_(3)B/NF hybrid Heterostructure Oxygen evolution reaction Electrocatalytic

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Tuning the selectivity of CO_(2)conversion to CO on partially reduced Cu_(2)O/ZnO heterogeneous interface

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Interdisciplinary materials 2024年第3期3卷 380-388页

作者： Tianci Xiang Ting Liu Ting Ouyang Shenlong Zhao Zhao-Qing Liu School of Chemistry and Chemical Engineering/institute of clean energy and materials/Guangzhou Key Laboratory for clean energy and materials/Huangpu Hydrogen Innovation Center Guangzhou Higher Education Mega CenterGuangzhou UniversityGuangzhouGuangdongPeople's Republic of China School of Chemical and Biomolecular Engineering The University of SydneySydneyNew South WalesAustralia

The development of stable and efficient low-cost electrocatalysts is conducive to the industrialization of CO_(2).The synergy effect between the heterogeneous interface of metal/oxide can promote the conversion of CO_(2).In this work,Cu_(2)O/ZnO heterostructures with partially reduced metal/oxide heterointerfaces in Zn plates(CZZ)have been synthesized for CO_(2)electroreduction in different cationic solutions(K^(+)and Cs^(+)).Physical characterizations were used to demonstrate the heterojunction of Cu_(2)O/ZnO and the heterointerfaces of metal/oxide,electrochemical tests were used to illustrate the enhancement of the selectivity of CO_(2)to CO in different cationic *** efficiency for CO with CZZ as catalyst reaches 70.9%in K+solution(current density for CO−3.77 mA cm^(−2)and stability 24 h),and the Faraday efficiency for CO is 55.2%in Cs^(+)solution(−2.47 mA cm^(−2)and 21 h).In addition,in situ techniques are used to elucidate possible reaction mechanisms for the conversion of CO_(2)to CO in K^(+)and Cs^(+)solutions.

关键词： CO CO_(2)reduction electrochemical catalysis heterogeneous interface

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Effect of ambient pressures on laser-induced breakdown spectroscopy signals

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Frontiers of physics 2024年第4期19卷 243-256页

作者： Kaifan Zhang Weiran Song Zongyu Hou Zhe Wang State Key Laboratory of Power System Operation and Control Tsinghua-Rio Tinto Joint Research Centre for ResourcesEnergy and Sustainable DevelopmentInternational Joint Laboratory on Low Carbon Clean Energy InnovationInstitute for Carbon NeutralityDepartment of Energy and Power EngineeringTsinghua UniversityBeijing 100084China Shanxi Research institute for clean energy Tsinghua UniversityTaiyuan 030032China

Laser-induced breakdown spectroscopy(LIBS)is regarded as the future superstar for analytical chemistry and widely applied in various *** the quality of LIBS signal is fundamental to achieving accurate quantification and large-scale commercialization of *** propose control methods that improve LIBS signal quality,it is essential to have a comprehensive understanding of the influence of key parameters,such as ambient gas pressure,temperature,and sample temperature on LIBS *** date,extensive research has been carried ***,different researchers often yield significantly different experimental results for LIBS,preventing the formation of consistent *** greatly prevents the understanding of influencing laws of key parameters and the improvement of LIBS quantitative *** ambient gas pressure as an example,this paper compares the effects of ambient gas pressure under different optimization conditions,reveals the influence of spatiotemporal window caused by inherent characteristics of LIBS signal sources,i.e.,intense temporal changes and spatial non-uniformity of laser-induced plasmas,on the impact patterns of key *** the perspective of plasma spatiotemporal evolution,the paper elucidates the influence patterns of ambient gas pressure on LIBS signals,clarifying seemingly contradictory research results in the literature.

关键词： laser-induced breakdown spectroscopy spatiotemporal window pressure condition signal uncertainty plasma modulation

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