成果/Result
- Molecular-Level Insights into the Notorious CO Poisoning of Platinum Catalyst被引量：113收藏
- 作者：Chen, Wenyao Cao, Junbo Fu, Wenzhao Zhang, Jing Qian, Gang Yang, Jia Chen, De Zhou, Xinggui Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Norwegian Univ Sci & Technol
- 来源：ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 2022
- 关键词：Activation Adsorption CO Poisoning Electrons Kinetics
- Ruthenium/TiO2-Catalyzed Hydrogenolysis of Polyethylene Terephthalate: Reaction Pathways Dominated by Coordination Environment被引量：93收藏
- 作者：Ye, Mingxing Li, Yurou Yang, Zhirong Yao, Chang Sun, Weixiao Zhang, Xiangxue Chen, Wenyao Qian, Gang Duan, Xuezhi Cao, Yueqiang Li, Lina Zhou, Xinggui Zhang, Jing
- 机构：East China Univ Sci & Technol;Chinese Acad Sci
- 来源：ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 2023
- 关键词：Arenes Heterogeneous Catalysis Hydrogenolysis Plastic Ruthenium
- Promotional effects of multiwalled carbon nanotubes on iron catalysts for Fischer-Tropsch to olefins被引量：84收藏
- 作者：Zhang, Zhengpai Zhang, Jun Wang, Xu Si, Rui Xu, Jing Han, Yi-Fan
- 机构：East China Univ Sci & Technol;Chinese Acad Sci;Zhengzhou Univ
- 来源：JOURNAL OF CATALYSIS 2018
- 关键词：Iron nanoparticles Fischer-Tropsch Olefins FTO Multiwalled carbon nanotube Surface modification Metal-support interaction
- Chemical state of nitrogen in carbon aerogels issued from phenol-melamine-formaldehyde gels被引量：83收藏
- 作者：Long, Donghui Zhang, Jie Yang, Junhe Hu, Zijun Cheng, Guo Liu, Ximiao Zhang, Rui Zhan, Liang Qiao, Wenming Ling, Licheng
- 机构：E China Univ Sci & Technol;Shanghai Inst Technol;Aerosp Inst Mat & Proc Technol
- 来源：CARBON 2008
- Mechanism driven design of trimer Ni1Sb2 site delivering superior hydrogenation selectivity to ethylene被引量：77收藏
- 作者：Ge, Xiaohu Dou, Mingying Cao, Yueqiang Xi Liu Qiang Yuwen Jing Zhang Gang Qian Gong, Xueqing Zhou, Xinggui Chen, Liwei Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Shanghai Jiao Tong Univ;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：NATURE COMMUNICATIONS 2022
- Increasing the Distance of Adjacent Palladium Atoms for Configuration Matching in Selective Hydrogenation被引量：70收藏
- 作者：Ge, Xiaohu Cao, Yueqiang Yan, Kelin Li, Yurou Zhou, Lihui Dai, Sheng Zhang, Jing Gong, Xueqing Qian, Gang Zhou, Xinggui Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 2022
- 关键词：Configuration Matching Intermetallic Compounds Local Environment Selective Hydrogenation Site Distance
- Glycols Production from Sorbitol Hydrogenolysis Over Hydrothermally Stable Ni Catalysts and the Mechanistic Study被引量：64收藏
- 作者：Zhu, Xinyu Feng, Xindi Yao, Chang Sun, Weixiao Ma, Jianbo Zhong, Fuzeyu Zeng, Jianrong Ge, Xiaohu Chen, Wenyao Qian, Gang Duan, Xuezhi Cao, Yueqiang Liu, Zhen Zhou, Xinggui Zhang, Jing
- 机构： State Key Laboratory of Chemical Engineering; Shanghai Synchrotron Radiation Facility; Shanghai Institute of Applied Physics
- 来源：SSRN 2023
- 关键词：Catalyst activity - Catalyst selectivity - Condensation reactions - Density functional theory - Ethylene - Ethylene glycol - Hydrogenolysis - Hydrolysis - Ketones - Leaching - Nickel oxide
- Selective decarbonylation of palmitic acid over Ni–Cu alloy catalysts and its kinetic studies被引量：63收藏
- 作者：Yu, Jiankun Sun, Weixiao Huang, Kuan Xu, Jin Zhong, Fuzeyu Ge, Xiaohu Chen, Wenyao Qian, Gang Cao, Yueqiang Zeng, Jianrong Ma, Jianbo Zhou, Xinggui Duan, Xuezhi Zhang, Jing Jiang, Lilong
- 机构： State Key Laboratory of Chemical Engineering; National Engineering Research Center of Chemical Fertilizer Catalyst ; Shanghai Synchrotron Radiation Facility
- 来源：Green Chemical Engineering 2025
- 关键词：Biosynthesis - Crystallization kinetics - Decay (organic) - Equilibrium constants - Fuel oils - Green Synthesis - Rate constants - Reaction intermediates
- Tuning direct CO hydrogenation reaction over Fe-Mn bimetallic catalysts toward light olefins: effects of Mn promotion被引量：59收藏
- 作者：Yang, Zixu Zhang, Zhengpai Liu, Yitao Ding, Xiaoxu Zhang, Jun Xu, Jing Han, Yifan
- 机构：East China Univ Sci & Technol;SINOPEC Corp
- 来源：APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY 2021
- 关键词：Syngas Fischer-Tropsch synthesis Light olefins Fe-Mn bimetallic catalysts Structure transformation
- The synergistic effect of Cu0 and Cu+ for one-step synthesis of aviation biofuel from biomass-derived ketones被引量：59收藏
- 作者：Li, Tan Su, Jing Yin, Linjia Zhang, Xiangkun Wang, Cong Li, Xinbao Zhang, Jing Wang, Kaige
- 机构： State Key Laboratory of Clean Energy Utilization; Faculty of Maritime and Transportation; State Key Laboratory of Chemical Engineering
- 来源：Green Chemistry 2023
- 关键词：Acetone - Catalysts
- Enhanced acetylene semi-hydrogenation on a subsurface carbon tailored Ni-Ga intermetallic catalyst被引量：56收藏
- 作者：Ge, Xiaohu Ren, Zhouhong Cao, Yueqiang Liu, Xi Zhang, Jing Qian, Gang Gong, Xueqing Chen, Liwei Zhou, Xinggui Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Shanghai Jiao Tong Univ;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：JOURNAL OF MATERIALS CHEMISTRY A 2022
- 关键词：Acetylene - Atoms - Binary alloys - Carbon - Catalyst selectivity - Electronic structure - Ethylene - Intermetallics - Lighting - Nickel - X ray absorption spectroscopy
- Computational exploration of magnesium-decorated carbon nitride (g-C3N4) monolayer as advanced energy storage materials被引量：54收藏
- 作者：Gao, Peng Li, Ji-wen Zhang, Jie Wang, Guangzhao
- 机构：Univ Wollongong;East China Univ Sci & Technol;Guangzhou Regenerat Med & Hlth Guangdong Lab;Northwest Normal Univ;Yangtze Normal Univ
- 来源：INTERNATIONAL JOURNAL OF HYDROGEN ENERGY 2021
- 关键词：DFT Carbon nitride Hydrogen storage
- Molecular-level insights into the electronic effects in platinum-catalyzed carbon monoxide oxidation被引量：52收藏
- 作者：Chen, Wenyao Cao, Junbo Yang, Jia Cao, Yueqiang Zhang, Hao Jiang, Zheng Zhang, Jing Qian, Gang Zhou, Xinggui Chen, De Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Norwegian Univ Sci & Technol;Soochow Univ;Chinese Acad Sci;Chinese Acad Sci
- 来源：NATURE COMMUNICATIONS 2021
- Composition of the Green Oil in Hydrogenation of Acetylene over a Commercial Pd-Ag/Al2O3 Catalyst被引量：50收藏
- 作者：Zhang, Jian Sui, Zhijun Zhu, Yi-An Chen, De Zhou, Xinggui Yuan, Weikang
- 机构：E China Univ Sci & Technol;Norwegian Univ Sci & Technol
- 来源：CHEMICAL ENGINEERING & TECHNOLOGY 2016
- 关键词：Acetylene hydrogenation Green oil Pyrolysis GC-MS Pd-Ag catalyst
- Total hydrogenation of hydroxymethylfurfural via hydrothermally stable Ni catalysts and the mechanistic study被引量：44收藏
- 作者：Zhong, Fuzeyu Ge, Xiaohu Sun, Weixiao Du, Wei Sang, Keng Yao, Chang Cao, Yueqiang Chen, Wenyao Qian, Gang Duan, Xuezhi Yang, Zhirong Zhou, Xinggui Zhang, Jing
- 机构：East China Univ Sci & Technol
- 来源：CHEMICAL ENGINEERING JOURNAL 2023
- 关键词：Layered double hydroxide 5-Bis-(hydroxymethyl) tetrahydrofuran Sintering Leaching Density functional theory
- Tailoring catalytic properties of V2O3 to propane dehydrogenation through single-atom doping: A DFT study被引量：41收藏
- 作者：Zhang, Jun Zhou, Rui-Jia Chang, Qing-Yu Sui, Zhi-Jun Zhou, Xing-Gui Chen, De Zhu, Yi-An
- 机构：East China Univ Sci & Technol;Norwegian Univ Sci & Technol
- 来源：CATALYSIS TODAY 2021
- 关键词：Single-atom doping PDH Density functional theory Lewis acid-base interaction V2O3 catalyst
- MnOx promotional effects on olefins synthesis directly from syngas over bimetallic Fe-MnOx/SiO2 catalysts被引量：39收藏
- 作者：Zhang, Zhengpai Dai, Weiwei Xu, Xin-Chao Zhang, Jun Shi, Bianfang Xu, Jing Tu, Weifeng Han, Yi-Fan
- 机构：East China Univ Sci & Technol;Zhengzhou Univ
- 来源：AICHE JOURNAL 2017
- 关键词：syngas Fischer-Tropsch to olefins Fe-MnOx catalysts intrinsic kinetics mechanism
- Catalytic conversion of polyethylene into aromatics with Pt/ZSM-5: insights into reaction pathways and rate-controlling step regulation被引量：37收藏
- 作者：Wang, Wenjie Yao, Chang Ge, Xiaohu Pu, Xin Yuan, Jiangchun Sun, Weixiao Chen, Wenyao Feng, Xiang Qian, Gang Duan, Xuezhi Cao, Yueqiang Yang, Zhirong Zhou, Xinggui Zhang, Jing
- 机构：East China Univ Sci & Technol;China Univ Petr;Zhengzhou Univ
- 来源：JOURNAL OF MATERIALS CHEMISTRY A 2023
- 关键词：Activation energy - Aromatization - Atmospheric pressure - Crystal structure - Dehydrogenation - Density functional theory - Ethylene - Platinum - Pyrolysis - Reaction intermediates
- Leveraging the Proximity and Distribution of Cu-Cs Sites for Direct Conversion of Methanol to Esters/Aldehydes被引量：32收藏
- 作者：Chen, Wenyao Zuo, Ji Sang, Keng Qian, Gang Zhang, Jing Chen, De Zhou, Xinggui Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Norwegian Univ Sci & Technol
- 来源：ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 2024
- 关键词：Esters and Aldehydes Heterogeneous Catalysis Methanol One-Step Conversion Reaction Mechanisms
- Production of biomass-derived monomers through catalytic conversion of furfural and hydroxymethylfurfural被引量：31收藏
- 作者：Yang, Zhirong Zhang, Jing Qian, Gang Duan, Xuezhi Zhou, Xinggui
- 机构：East China Univ Sci & Technol
- 来源：GREEN CHEMICAL ENGINEERING 2021
- 关键词：Biomass-derived monomers Catalyst design Furfural Hydroxymethylfurfural Heterogeneous catalysis
- Embedding Single Pd Atoms on NiGa Intermetallic Surfaces for efficient and Selective Alkyne Hydrogenation被引量：30收藏
- 作者：Ge, Xiaohu Jing, Yundao Fei, Nina Yan, Kelin Liang, Yijing Cao, Yueqiang Zhang, Jing Qian, Gang Li, Lina Jiang, Hao Zhou, Xinggui Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Chinese Acad Sci;East China Univ Sci & Technol
- 来源：ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 2024
- 关键词：Alkyne semi-hydrogenation Selectivity Ni-based catalyst Ensemble site Hydrogen dissociation
- Ultrasonic synthesis of nitrogen-doped carbon nanofibers as platinum catalyst support for oxygen reduction被引量：30收藏
- 作者：Jiang, Yue Zhang, Jia Qin, Yuan-Hang Niu, Dong-Fang Zhang, Xin-Sheng Niu, Li Zhou, Xing-Gui Lu, Tian-Hong Yuan, Wei-Kang
- 机构：E China Univ Sci & Technol;Chinese Acad Sci;Nanjing Normal Univ
- 来源：JOURNAL OF POWER SOURCES 2011
- 关键词：Carbon nanofiber Nitrogen-doping Oxygen reduction reaction Electrocatalysis
- effects of Oxygen Vacancy and Pt Doping on the Catalytic Performance of CeO2 in Propane Dehydrogenation: A First-Principles Study被引量：30收藏
- 作者：Zeeshan, Muhammad Chang, Qing-Yu Zhang, Jun Hu, Ping Sui, Zhi-Jun Zhou, Xing-Gui Chen, De Zhu, Yi-An
- 机构：East China Univ Sci & Technol;Norwegian Univ Sci & Technol
- 来源：CHINESE JOURNAL OF CHEMISTRY 2021
- 关键词：Dehydrogenation Adsorption Doping Heterogeneous catalysis Ab initio calculations
- Accurate predictions of aqueous solubility of drug molecules via the multilevel graph convolutional network (MGCN) and SchNet architectures被引量：29收藏
- 作者：Gao, Peng Zhang, Jie Sun, Yuzhu Yu, Jianguo
- 机构：Univ Wollongong;Guangzhou Regenerat Med & Hlth Guangdong Lab;East China Univ Sci & Technol
- 来源：PHYSICAL CHEMISTRY CHEMICAL PHYSICS 2020
- 关键词：Forecasting - Network architecture - Solubility - Convolution - Deep learning - Drug delivery
- Poisoning effect of polyvinyl chloride on the catalytic pyrolysis of mixed plastics over zeolites被引量：27收藏
- 作者：Yuan, Jiangchun Wang, Wenjie Sun, Weixiao Yang, Zhirong Cao, Yueqiang Chen, Wenyao Ge, Xiaohu Qian, Gang Feng, Xiang Duan, Xuezhi Zhou, Xinggui Van Geem, Kevin M. Zhang, Jing
- 机构：East China Univ Sci & Technol;Zhengzhou Univ;Univ Ghent;China Univ Petr
- 来源：SCIENCE CHINA-CHEMISTRY 2024
- 关键词：polyvinyl chloride polyethylene zeolite aromatics deactivation
- Continuous synthesis of methyl ethyl ketone peroxide in a microreaction system with concentrated hydrogen peroxide被引量：23收藏
- 作者：Zhang, Jing Wu, Wei Qian, Gang Zhou, Xing-Gui
- 机构：E China Univ Sci & Technol
- 来源：JOURNAL OF HAZARDOUS MATERIALS 2010
- 关键词：Microreactor Peroxidation Safety Methyl ethyl ketone Hydrogen peroxide
- A general QSPR protocol for the prediction of atomic/inter-atomic properties: a fragment based graph convolutional neural network (F-GCN)被引量：23收藏
- 作者：Gao, Peng Zhang, Jie Qiu, Hongbo Zhao, Shuaifei
- 机构：Univ Wollongong;Ctr Chem & Chem Biol;East China Univ Sci & Technol;Monash Univ;Deakin Univ
- 来源：PHYSICAL CHEMISTRY CHEMICAL PHYSICS 2021
- 关键词：Convolution - Density functional theory - Graph neural networks - Chemical bonds - Atoms - Computational chemistry - Design for testability - Computation theory - Convolutional neural networks
- Pt-O4 moiety induced electron localization toward In2O-Triggered acetylene Semi-Hydrogenation被引量：23收藏
- 作者：Li, Yurou Cao, Yueqiang Ge, Xiaohu Zhang, Hao Yan, Kelin Zhang, Jing Qian, Gang Jiang, Zheng Gong, Xueqing Li, Aoming Zhou, Xinggui Yuan, Weikang Duan, Xuezhi
- 机构：East China Univ Sci & Technol;Soochow Univ;Chinese Acad Sci;Chinese Acad Sci;East China Univ Sci & Technol
- 来源：JOURNAL OF CATALYSIS 2022
- 关键词：Acetylene semi-hydrogenation Pt-O-4 moiety Ensemble site H-2 activation Atomic layer deposition
- effect of hydrothermal conditions on isomerization activity of Pt/SO 4 2--ZrO2被引量：22收藏
- 作者：Zhang, Juanjuan Song, Yueqin Zhou, Xiaolong Li, Chenglie Wang, Jin-An Xu, Longya
- 机构： Petroleum Processing Research Center; Laboratorio de Catálisis y Materiales; State Key Laboratory of Catalysis
- 来源：Advanced Materials Research 2010
- 关键词：Acidity - Chemical reactors - Sulfur compounds - Calcination - Hexane - Platinum compounds - Catalyst activity - Crystalline materials - Sulfur - Isomers - Thermoanalysis - Zirconia
- Liquid Flow and Mass Transfer Behaviors in a Butterfly-Shaped Microreactor被引量：22收藏
- 作者：Lv, Haicheng Yang, Zhirong Zhang, Jing Qian, Gang Duan, Xuezhi Shu, Zhongming Zhou, Xinggui
- 机构：East China Univ Sci & Technol
- 来源：MICROMACHINES 2021
- 关键词：millimeter-scale computational fluid dynamics (CFD) droplet liquid-liquid flow flow pattern and mass transfer
