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浏览/检索结果:
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Surface modification of Fe5C2 by binding silica-based ligand: A theoretical explanation of enhanced C2 oxygenate selectivity
期刊论文
MOLECULAR CATALYSIS, 2023, 卷号: 547, 页码: 113333
作者:
Yin, Junqing
;
Wang, Shuyuan
;
Xu, Dan
;
You, Yong
;
Liu, Xingchen
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2023/09/05
Surface modification
Iron carbide
Support -like ligand
Catalytic selectivity
Fischer-Tropsch Synthesis
Experiment-theory hybrid method for studying the formation mechanism of atmospheric new particle formation
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24
作者:
Liu, Yi-Rong
;
Jiang, Shuai
;
Huang, Teng
;
Zhang, Fan
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  |  
浏览/下载:24/0
  |  
提交时间:2022/12/23
Atomic-level diffusion at the amorphous Zr50Cu50/crystalline Cu interface: A molecular dynamics study
期刊论文
JOURNAL OF ADVANCED JOINING PROCESSES, 2022, 卷号: 6
作者:
Zhang, Wenzhe
;
Huang, Jiankang
;
Yu, Xiaoquan
;
Liu, Guangyin
;
Yanqin, Huang
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  |  
浏览/下载:33/0
  |  
提交时间:2022/08/09
Molecular dynamics
Interfacial diffusion
Atomic structure
Zrr-Cu amorphous
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
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  |  
浏览/下载:27/0
  |  
提交时间:2022/09/16
cyclohexane dehydrogenation
H-2 dependencies
most abundant surface intermediates
rate-determining step
universal model
parity plots
Effects of mutations of D1-R323, D1-N322, D1-D319, D1-H304 on the functioning of photosystem II in Thermosynechococcus vulcanus
期刊论文
PHOTOSYNTHESIS RESEARCH, 2022, 卷号: 152, 期号: 2, 页码: 193-206
作者:
Zhu, Qingjun
;
Yang, Yanyan
;
Xiao, Yanan
;
Han, Wenhui
;
Li, Xingyue
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  |  
浏览/下载:7/0
  |  
提交时间:2024/03/07
Photosystem II
Site-directed mutagenesis
Water oxidation
Hydrogen-bond networks
Functional binding
The nucleation mechanism of succinic acid involved sulfuric acid - Dimethylamine in new particle formation
期刊论文
ATMOSPHERIC ENVIRONMENT, 2021, 卷号: 263
作者:
Wang, Zhong-Quan
;
Liu, Yi-Rong
;
Wang, Chun-Yu
;
Jiang, Shuai
;
Feng, Ya-Juan
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  |  
浏览/下载:74/0
  |  
提交时间:2021/11/01
Nucleation mechanism
Proton transfer
Evaporation rate
Atmospheric relevance
Visualized Reaction Tracking and Physical Property Analysis for a Picked 3D Area in a Reactive Molecular Dynamics Simulation System
期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2021, 卷号: 37, 期号: 10, 页码: 11
作者:
Tang, Yujie
;
Zheng, Mo
;
Ren, Chunxing
;
Li, Xiaoxia
;
Guo, Li
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  |  
浏览/下载:24/0
  |  
提交时间:2021/08/31
ReaxFF MD
Regional reaction tracking
Physical property
Visualization
Cooperative Sites in Fully Exposed Pd Clusters for Low-Temperature Direct Dehydrogenation Reaction
期刊论文
ACS CATALYSIS, 2021, 卷号: 11, 期号: 18, 页码: 11469-11477
作者:
Wang, Linlin
;
Diao, Jiangyong
;
Peng, Mi
;
Chen, Yunlei
;
Cai, Xiangbin
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  |  
浏览/下载:24/0
  |  
提交时间:2021/11/22
atomic dispersion
Pd cluster
defect-rich graphene
dehydrogenation
heterogeneous catalysis
Cooperative Sites in Fully Exposed Pd Clusters for Low-Temperature Direct Dehydrogenation Reaction
期刊论文
ACS CATALYSIS, 2021, 卷号: 11, 期号: 18, 页码: 11469-11477
作者:
Wang, Linlin
;
Diao, Jiangyong
;
Peng, Mi
;
Chen, Yunlei
;
Cai, Xiangbin
收藏
  |  
浏览/下载:22/0
  |  
提交时间:2021/11/22
atomic dispersion
Pd cluster
defect-rich graphene
dehydrogenation
heterogeneous catalysis
Insight into the interatomic competitive mechanism for interfacial stability of room temperature liquid GaInSn/Cu electrode
期刊论文
MATERIALS CHEMISTRY AND PHYSICS, 2021, 卷号: 270, 页码: 14
作者:
Gao, Zhaoqing
;
Chen, Yinbo
;
Dong, Chong
;
Chen, Fei
;
Huang, Mingliang
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  |  
浏览/下载:63/0
  |  
提交时间:2021/10/15
Liquid GaInSn alloys
Interfacial stability
Interatomic affinity
Competitive reactive mechanism
Gibbs free energy change
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