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厦门大学 [5]
大连理工大学 [4]
西安交通大学 [2]
上海大学 [2]
兰州理工大学 [1]
北京航空航天大学 [1]
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期刊论文 [21]
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2022 [1]
2020 [1]
2019 [2]
2018 [3]
2017 [2]
2016 [1]
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Kinetic Evidence of Most Abundant Surface Intermediates Variation over Pt-n and Pt-p: Few-Atom Pt Ensembles Enable Efficient Catalytic Cyclohexane Dehydrogenation for Hydrogen Production-II
期刊论文
ACS CATALYSIS, 2022, 卷号: 12, 期号: 12, 页码: 7248-7261
作者:
Guo, Jinqiu
;
Peng, Mi
;
Jia, Zhimin
;
Li, Chengyu
;
Liu, Hongyang
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2022/09/16
cyclohexane dehydrogenation
H-2 dependencies
most abundant surface intermediates
rate-determining step
universal model
parity plots
Seasonal variation characteristics of hydroxyl radical pollution and its potential formation mechanism during the daytime in Lanzhou
期刊论文
Journal of Environmental Sciences (China), 2020, 卷号: 95, 页码: 58-64
作者:
Wang, Guoying
;
Jia, Shiming
;
Li, Ruihong
;
Ma, Shangrong
;
Chen, Xuefu
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2020/11/14
Air pollution control
Atmospheric chemistry
Atmospheric humidity
Free radicals
Nitrogen oxides
Ozone
Particles (particulate matter)
Volatile organic compounds
Fine particulate matter
Fine particulate matter (PM2.5)
Formation mechanism
Hydroxyl free radicals
Ozone concentration
Rate determining step
Regeneration pathway
Seasonal variation
Development of Prediction Models on Base-Catalyzed Hydrolysis Kinetics of Phthalate Esters with Density Functional Theory Calculation
期刊论文
ENVIRONMENTAL SCIENCE & TECHNOLOGY, 2019, 卷号: 53, 页码: 5828-5837
作者:
Xu, Tong
;
Chen, Jingwen
;
Wang, Zhongyu
;
Tang, Weihao
;
Xia, Deming
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2019/12/02
Catalysis
Esters
Forecasting
Hydrolysis
Kinetics
Rate constants, Base-catalyzed hydrolysis
Density functional theory methods
Environmental persistences
Experimental determination
High production volumes
Quantitative structure activity relationship
Rate determining step
Second-order rate constants, Density functional theory, article
catalysis
density functional theory
half life time
hydrolysis kinetics
prediction
quantitative structure activity relation
rate constant
Transfer Hydrogenation of Biomass-Derived Furfural to 2-Methylfuran over CuZnAl Catalysts
期刊论文
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2019, 卷号: 58, 页码: 6298-6308
作者:
Niu, Hongyu
;
Luo, Jingjie
;
Li, Chuang
;
Wang, Baowei
;
Liang, Changhai
收藏
  |  
浏览/下载:73/0
  |  
提交时间:2019/12/02
Aldehydes
Costs
Furfural
Hydrogenation
Molar ratio
Precious metals
Ternary alloys, Catalytic transfer hydrogenation
Copper content
Furfuryl alcohol
Hydrogen donor
Noble metal catalysts
Rate determining step
Reaction cycles
Transfer hydrogenations, Catalyst activity
Theoretical Mechanistic Studies on Redox-Switchable Polymerization of Trimethylene Carbonate Catalyzed by an Indium Complex Bearing a Ferrocene-Based Ligand
期刊论文
ORGANOMETALLICS, 2018, 卷号: 37, 页码: 4599-4607
作者:
Xu, Xiaowei
;
Luo, Gen
;
Mehmood, Andleeb
;
Zhao, Yanan
;
Zhou, Guangli
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2019/12/02
Catalysis
Computation theory
Density functional theory
Indium compounds
Iron compounds
Ligands
Nitrogen compounds
Organometallics
Oxidation, Computational results
Energy decomposition
Higher-energy barriers
Migratory insertion
Polymerization reaction
Rate determining step
Theoretical mechanistic studies
Trimethylene carbonate, Ring opening polymerization
Cathodic reaction kinetics for CO2 capture and utilization in molten carbonates at mild temperatures
期刊论文
ELECTROCHEMISTRY COMMUNICATIONS, 2018, 卷号: 88
作者:
Gao, Muxing
;
Deng, Bowen
;
Chen, Zhigang
;
Tao, Meng
;
Wang, Dihua
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/12/05
Carbon dioxide utilization
Molten carbonates
Electrochemical reduction
Electrode kinetics
Rate-determining step
Structure and Reactivity of Methanol Adsorbed on Rutile TiO2(011) Surface
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2018, 卷号: 122, 页码: 24202-24208
作者:
Liang, Yanhong
;
Lang, Xiufeng
;
Zhang, Ying
;
Ji, Jing
;
You, Tingting
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2019/12/30
Calculations
Electronic structure
Methanol
Oxidation
Oxide minerals
Photocatalysis
Aqueous environment
First-principles calculation
Methanol adsorption
Photocatalytic activities
Photocatalytic application
Rate determining step
Reconstructed surfaces
Synergistic effect
Titanium dioxide
Aqueous Oxidations Started by TiO2 Photoinduced Holes Can Be a Rate-Determining Step
期刊论文
CHEMISTRY-AN ASIAN JOURNAL, 2017, 卷号: 12, 期号: 16, 页码: 2048-2051
作者:
Gong, Yuanzheng
;
Yang, Chun
;
Ji, Hongwei
;
Chen, Chuncheng
;
Ma, Wanhong
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2018/05/25
h(Vb)(+)/(Oh)-o-center Dot Oxidation
Hydroxylation Of Aromatics
Inverse Kinetic Isotope Effect
Rate-determining Step
Tio2 Photocatalysis
Synthesis, CO2-tolerance and rate-determining step of Nb-doped Ce0.8Gd0.2O2-delta-Pr0.6Sr0.4Co0.5Fe0.5O3-delta ceramic membranes
期刊论文
CERAMICS INTERNATIONAL, 2017, 卷号: 43, 页码: 6477-6486
作者:
Cheng, Hongwei[1]
;
Wang, Pengfei[2]
;
Zhao, Hongbin[3]
;
Li, Kongzhai[4]
;
Lu, Xionggang[5]
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2019/04/24
Dual-phase membrane
Oxygen permeability
CO2-tolerance
Stability
Rate-determining step
Decomposition mechanism of formic acid on Cu (111) surface: A theoretical study
期刊论文
Applied Surface Science, 2016, 期号: [db:dc_citation_issue]
作者:
Jiang, Zhao
;
Qin, Pei
;
Fang, Tao
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/12/02
Cu(1 1 1)
Decomposition mechanism
Direct formic acid fuel cells
Formic acid decompositions
Minimum energy pathways
Periodic density functional theory calculations
Rate determining step
Transition metal surfaces
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