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作品数:189被引量:249H指数:6
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相关领域:自动化与计算机技术更多>>
相关作者:储德林蔡大用梅园孙怀江夏德深更多>>
相关机构:清华大学南京理工大学大连理工大学大连海事大学更多>>
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相关基金:国家自然科学基金国家重点基础研究发展计划中国博士后科学基金国家高技术研究发展计划更多>>
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Toward the rational design for low-temperature hydrogenation of silicon tetrachloride:Mechanism and data-driven interpretable descriptor
《Chinese Journal of Chemical Engineering》2025年第3期172-184,共13页Zhe Ding Li Guo Fang Bai Chao Hua Ping Lu Jinyi Chen 
supported by Hubei Three Gorges Laboratory Open Innovation Fund Project(SC231002);CFD Simulation to Explore the Mass and Heat Transfer Laws of Thermal Decomposition of Mixed Salt Organic Compounds Project(2021YFC 3201404).
Low-temperature hydrogenation of silicon tetrachloride(STC)is an essential step in polysilicon production.The addition of CuCl to silicon powder is currently a commonly used catalytic method and the silicon powder act...
关键词:Silicon tetrachloride HYDROGENATION Reaction mechanism Interpretable machine learning Catalyst Structure-activity relationship 
Few-shot anomaly detection with adaptive feature transformation and descriptor construction
《Chinese Journal of Aeronautics》2025年第3期491-504,共14页Zhengnan HU Xiangrui ZENG Yiqun LI Zhouping YIN Erli MENG Leyan ZHU Xianghao KONG 
supported by the National Natural Science Foundation of China(No.52188102).
Anomaly Detection (AD) has been extensively adopted in industrial settings to facilitate quality control of products. It is critical to industrial production, especially to areas such as aircraft manufacturing, which ...
关键词:Industrial applications Anomaly detection Learning algorithms Feature extraction Feature selection 
Monitoring C-C coupling in catalytic reactions via machine-learned infrared spectroscopy
《National Science Review》2025年第2期171-179,共9页Li Yang Zhicheng Zhao Tongtong Yang Donglai Zhou Xiaoyu Yue Xiyu Li Yan Huang Xijun Wang Ruyun Zheng Thomas Heine Changyin Sun Jun Jiang Sheng Ye 
supported by the National Natural Science Foundation of China(21803063,22003060,22203001,22025304,22033007,62236002,61921004 and 62306005);the Natural Science Foundation of Anhui Province(2308085MB47,2208085Y04 and 2208085QF192);Anhui Provincial Department of Education university natural science research project(2024AH050070);the Innovation Program for Quantum Science and Technology(2021ZD0303303);the CAS Project for Young Scientists in Basic Research(YSBR-005);the University Synergy Innovation Program of Anhui Province(GXXT-2022-062);Sol2H2 project of the European Union’s Horizon 2020 research and innovation programme(101031846).
Tracking atomic structural evolution along chemical transformation pathways is essential for optimizing chemical transitions and enhancing control.However,molecule-level knowledge of structural rearrangements during c...
关键词:chemical evolution machine learning spectroscopic descriptor dynamic monitoring catalytic reaction 
Recognition for underground voids in C-scans based on GMM-HMM
《Journal of Systems Engineering and Electronics》2025年第1期82-94,共13页BAI Xu LI Yuhao GUO Shizeng LIU Jinlong WEN Zhitao LI Hongrui ZHANG Jiayan 
National Natural Science Foundation of China(62071147)。
Ground penetrating radar(GPR),as a fast,efficient,and non-destructive detection device,holds great potential for the detection of shallow subsurface environments,such as urban road subsurface monitoring.However,the in...
关键词:ground penetrating rader(GPR) RECOGNITION edge histogram descriptor(EHD) histogram of oriented gradient(HOG) Log-Gabor filter 
Why do CuAl catalysts outperform in CO_(2) electro-reduction to C_(2)H_(4)?
《Science China Chemistry》2025年第2期763-771,共9页Dongfang Cheng Gong Zhang Lulu Li Xiangcheng Shi Wenjin Zhu Xintong Yuan Lyudmila Moskaleva Peng Zhang Zhi-Jian Zhao Jinlong Gong 
supported by the National Key R&D Program of China(2022YFE0102000);the National Natural Science Foundation of China(22121004,U22A20409);the Haihe Laboratory of Sustainable Chemical Transformations,the Program of Introducing Talents of Discipline to Universities(BP0618007);the XPLORER PRIZE for financial support.
Highly efficient CO_(2) electroreduction(CO_(2)RR)holds the promise of closing the carbon cycle.However,the strategies for enhancing activity and selectivity for single C2+ products are still limited.This paper descri...
关键词:CO_(2)RR dilute alloy DESCRIPTOR surface oxophilicity 
Establishing a new testing protocol of the electrochemical stability window for electric double-layer capacitors
《Science China Chemistry》2025年第1期217-225,共9页Ruilin Hou Xiaoxi Zhao Tingting Liang Qingyun Dou Shan Xu Xingbin Yan 
supported by the National Key R&D Program of China(2022YFB2402600);the National Natural Science Foundation of China(22279166);the Guangdong Basic and Applied Basic Research Foundation(2022B1515120019)。
The electrochemical stability window(ESW)is crucial for determining the energy density of electric double-layer capacitors(EDLCs).However,current ESW testing protocols of EDLCs are strongly affected by artificial fact...
关键词:electric double-layer capacitors electrochemical stability window testing protocol side reaction descriptor operating limitation 
Interpretable machine learning for stability and electronic structure prediction of Janus III–VI van der Waals heterostructures
《Materials Genome Engineering Advances》2024年第4期88-98,共11页Yudong Shi Yinggan Zhang Jiansen Wen Zhou Cui Jianhui Chen Xiaochun Huang Cuilian Wen Baisheng Sa Zhimei Sun 
supported by the National Key Research and Development Program of China(No.2022YFB3807200);the Natural Science Foundation of Fujian Province(No.2024J01262);the National Natural Science Foundation of China(No.52201022).
Machine learning(ML)techniques have made enormous progress in the field of materials science.However,many conventional ML algorithms operate as“blackboxes”,lacking transparency in revealing explicit relationships be...
关键词:DESCRIPTOR interpretable machine learning Janus III–VI van der Waals heterostructures 
Controllability of descriptor multi-agent systems with signed networks
《Science China(Information Sciences)》2024年第12期204-222,共19页Yu SHEN Yongqiang GUAN Ye TIAN 
supported by National Natural Science Foundation of China (Grant Nos.62073253,62036002)。
This paper studies the controllability of descriptor multi-agent systems(DMASs) with signed networks, where the networks are signed, and agents have descriptor linear dynamics. First, the basis for the eigenspace of t...
关键词:CONTROLLABILITY signed networks descriptor multi-agent systems heterogeneous dynamics 
New mechanistic insights into CO_(2) electroreduction to methane on penta-octa-graphene catalyst
《Journal of Energy Chemistry》2024年第12期529-540,共12页Yirong Ma Jinbo Hao Baonan Jia Xinhui Zhang Chunling Zhang Ge Wu Changcheng Chen Yuanzi Li Zhiyuan Zhou Qiyu Li Pengfei Lu 
supported by the Natural Science Basic Research Program of Shaanxi(2023-JC-YB-065,2024JC-YBMS-788);the Foundation of Laboratory of Computational Physics(6142A05QN22017)。
Electrocatalytic reduction of CO_(2) to produce high value-added products is an important way to achieve sustainable production of green energy,but it is limited by high complexity of the catalyst structure and reacti...
关键词:Penta-octa-graphene Carbon dioxide reduction Catalytic descriptor First-principles calculation 
Screening A-site ordered quadruple perovskites for alkaline hydrogen evolution reaction via unifying electronic configuration descriptor
《Chinese Physics B》2024年第12期448-456,共9页Ning Sun Wenbo Li Yang Qin Zhichuan Zheng Bowen Zhang Xiangjiang Dong Peng Wei Yixiao Zhang Xian He Xinyu Xie Kai Huang Lailei Wu Ming Lei Huiyang Gou Runze Yu 
Project supported financially by the National Key Research and Development Program of China(Grant No.2023YFA1406000);the National Natural Science Foundation of China(Grant Nos.22171283 and 12474002);the Fundamental Research Funds for the Central Universities(Grant Nos.2023ZCJH03 and 2021XD-A041);the Fund of State Key Laboratory of Information Photonics and Optical Communications(Beijing University of Posts and Telecommunications,China);the Teaching Reform Projects at BUPT(Grant No.2022CXCYB03);the BUPT Excellent Ph.D.Students Foundation(Grant No.CX2023108)。
Dynamic adsorption processes of reaction intermediates for alkaline hydrogen evolution(HER)catalysts are still confusing to understand.Here,we report a series of A-site ordered quadruple perovskite ruthenium-based ele...
关键词:Ru-based electrocatalyst density functional theory DESCRIPTOR quadruple perovskites hydrogen evolution reaction 
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