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Mechanism of the generation of benzaldehyde and benzoic acid on Pd (111) surface during the destruction of toluene: Verification of experiments and models
期刊论文
APPLIED SURFACE SCIENCE, 2024, 卷号: 657, 页码: 11
作者:
Zhu, Yuxue
;
Li, Xiang
;
Zhang, Chenhang
;
Fang, Hongping
;
Bin, Feng
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2024/05/14
Catalysis
DFT
Activation energy
Pd
By-product
Theoretical and experimental investigations about the role of MXene nanosheets covered with ZnO quantum dots on barrier resistance of epoxy coatings
期刊论文
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING, 2024, 卷号: 12, 期号: 1, 页码: 15
作者:
Pourhashem, Sepideh
;
Seif, Abdolvahab
;
Zhou, Ziyang
;
Ji, Xiaohong
;
Sgroi, Mauro Francesco
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  |  
浏览/下载:1/0
  |  
提交时间:2024/04/07
Hybrid of MXene@ZnO QDs
Silane functionalization
Epoxy coating
Corrosion resistance
DFT studies
Nickel-Based Bifunctional Cocatalyst to Enhance CdS Photocatalytic Hydrogen Production
期刊论文
LANGMUIR, 2023, 卷号: 39, 期号: 51, 页码: 18935-18945
作者:
Chen, Haoyu
;
Ye, Kun
;
Zhang, Wenya
;
Fan, Lele
;
Kong, Fanjie
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  |  
浏览/下载:1/0
  |  
提交时间:2024/01/26
Assessing Effects of van der Waals Corrections on Elasticity of Mg
3
Bi
2-x
Sb
x
in DFT Calculations
期刊论文
MATERIALS, 2023, 卷号: 16, 期号: 19, 页码: 15
作者:
Peng, Qing
;
Ma, Xinjie
;
Yang, Xiaoyu
;
Zhao, Shuai
;
Yuan, Xiaoze
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  |  
浏览/下载:9/0
  |  
提交时间:2023/11/13
thermoelectric materials
PBE-D3
vdW-DFq
first-principles calculation
Mg3Bi2-xSbx
Chiral Recognition of D/L-Ribose by Visual and SERS Assessments
期刊论文
MOLECULES, 2023, 卷号: 28
作者:
Yao, Guohua
;
Liu, Chao
;
Elsherbiny, Shereen M.
;
Huang, Qing
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  |  
浏览/下载:5/0
  |  
提交时间:2023/11/10
ribose
chiral recognition
visual sensor
colorimetry
SERS
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
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  |  
浏览/下载:8/0
  |  
提交时间:2023/09/05
Surface modification
Iron carbide
Support -like ligand
Catalytic selectivity
Fischer-Tropsch Synthesis
Introducing Novel, Multiple Cd Coordination Modes into Gold Nanoclusters by Combined Doping for Enhancing Electrocatalytic Performance
期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2023, 卷号: 39
作者:
Liu, Zhen
;
Meng, Xiangfu
;
Gu, Wanmiao
;
Zha, Jun
;
Yan, Nan
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  |  
浏览/下载:11/0
  |  
提交时间:2023/11/10
Metal Nanocluster
Combined doping
Cd-coordination mode
Structure-property correlation
Electrocatalytic reduction of CO2
Multi-treatments based on polydimethylsiloxane and metal-organic framework wrapped with graphene oxide for achieving long-term corrosion and fouling protection: experimental and density functional theory aspects
期刊论文
CONSTRUCTION AND BUILDING MATERIALS, 2023, 卷号: 384, 页码: 14
作者:
Zhou, Ziyang
;
Seif, Abdolvahab
;
Pourhashem, Sepideh
;
Duan, Jizhou
;
Rashidi, Alimorad
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2023/12/07
Graphene oxide
Metal-organic frameworks
Nanohybrids
Corrosion resistance
Density functional theory
Study on Vibrational Spectra of Cypermethrin Based on Density Functional Theory
期刊论文
SPECTROSCOPY AND SPECTRAL ANALYSIS, 2023, 卷号: 43, 期号: 5, 页码: 1381-1386
作者:
Liang Xiao-rui
;
Cong Jing-xian
;
Li Yin
;
Liu Jie
;
Jin Liang-jie
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2024/01/26
Cypermethrin
Density functional theory
Infrared spectroscopy
Raman spectroscopy
1D Bi2S3 nanorods modified 2D BiOI nanoplates for highly efficient photocatalytic activity: Pivotal roles of oxygen vacancies and Z-scheme heterojunction
期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2023, 卷号: 142, 页码: 45-59
作者:
Ju, Peng
;
Zhang, Yu
;
Hao, Lei
;
Cao, Jiazhen
;
Zhai, Xiaofan
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  |  
浏览/下载:18/0
  |  
提交时间:2023/02/01
Antifouling 
Photocatalysis
BiOI
Biofouling
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