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科研机构
湖南大学 [12]
内容类型
期刊论文 [12]
发表日期
2019 [12]
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发表日期:2019
专题:湖南大学
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A calcium-based microporous metal-organic framework for efficient adsorption separation of light hydrocarbons
期刊论文
CHEMICAL ENGINEERING JOURNAL, 2019, 卷号: Vol.358, 页码: 446-455
作者:
Li, Liangying
;
Guo, Lidong
;
Pu, Siyu
;
Wang, Jiawei
;
Yang, Qiwei
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/13
Metal-organic
framework
Light
hydrocarbons
Adsorption
separation
DFT
calculation
Design, synthesis, bioactivity, and DFT calculation of 2-thiazolyl-hydrazone derivatives as influenza neuraminidase inhibitors
期刊论文
Medicinal Chemistry Research, 2019, 卷号: Vol.28 No.7, 页码: 938-947
作者:
Man-Ying Cui
;
Jian-Xia Nie
;
Zhong-Zhong Yan
;
Meng-Wu Xiao
;
Ding Lin
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2019/12/13
Thiazolylhydrazones
Neuraminidase (NA) inhibitors
Molecular docking
DFT calculation
Nature of Bimetallic Oxide SbMoO/rGO Anode for High‐Performance Potassium‐Ion Batteries
期刊论文
Advanced Science, 2019, 卷号: Vol.6 No.17
作者:
Jue Wang
;
Bin Wang
;
Zhaomeng Liu
;
Ling Fan
;
Qingfeng Zhang
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/13
anodes
bimetallic oxide
density functional theory (DFT) calculation
operando X‐ray diffraction
potassium‐ion batteries
Design, synthesis and fungicidal activity evaluation of novel pyrimidinamine derivatives containing phenyl-thiazole/oxazole moiety.
期刊论文
Bioorganic & medicinal chemistry, 2019
作者:
Yan, ZZ
;
Liu, AP
;
Ou, YC
;
Li, JM
;
Yi, HB
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  |  
浏览/下载:12/0
  |  
提交时间:2019/12/17
Antifungal activities
DFT calculation
Diflumetorim
Puccinia sorghi
Pyrimidinamine
Highly efficient and selective removal of mercury ions using hyperbranched polyethylenimine functionalized carboxymethyl chitosan composite adsorbent
期刊论文
CHEMICAL ENGINEERING JOURNAL, 2019, 卷号: Vol.358, 页码: 253-263
作者:
Zeng, Hehua
;
Wang, Lan
;
Zhang, Dan
;
Yan, Peng
;
Nie, Jing
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2019/12/17
Carboxymethyl chitosan
Polyethylenimine functionalization
Hg(II) removal
High efficiency
Selectivity
DFT calculation
Design, synthesis, bioactivity, and DFT calculation of 2-thiazolyl-hydrazone derivatives as influenza neuraminidase inhibitors
期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2019, 卷号: Vol.28 No.7, 页码: 938-947
作者:
Cui, MY
;
Nie, JX
;
Yan, ZZ
;
Xiao, MW
;
Lin, D
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2019/12/17
Thiazolylhydrazones
Neuraminidase (NA) inhibitors
Molecular docking
DFT calculation
DFT Calculations of the Structural, Mechanical, and Electronic Properties of TiV Alloy Under High Pressure
期刊论文
SYMMETRY-BASEL, 2019, 卷号: Vol.11 No.8
作者:
Yu, F
;
Liu, Y
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  |  
浏览/下载:4/0
  |  
提交时间:2019/12/17
TiV alloy
Symmetric structure
DFT calculation
mechanical property
elastic constant
electronic structure
applied pressure
Nature of Bimetallic Oxide SbMoO/rGO Anode for High-Performance Potassium-Ion Batteries.
期刊论文
Advanced science (Weinheim, Baden-Wurttemberg, Germany), 2019, 卷号: Vol.6 No.17, 页码: 1900904
作者:
Jue Wang
;
Bin Wang
;
Zhaomeng Liu
;
Ling Fan
;
Qingfeng Zhang
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2019/12/17
anodes
bimetallic oxide
density functional theory (DFT) calculation
operando X‐ray diffraction
potassium‐ion batteries
Rationally design of monometallic NiO-NiS/NF heteronanosheets as bifunctional electrocatalysts for overall water splitting
期刊论文
Journal of Catalysis, 2019, 卷号: Vol.369, 页码: 345-351
作者:
Lishan Peng
;
Jingjun Shen
;
Xingqun Zheng
;
Rui Xiang
;
Mingming Deng
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/13
Monometallic
heterostructure
Bifunctional
electrocatalyst
NiO-Ni3S2
heteronanosheets
Interface
effect
DFT
calculation
Water
electrolysis
Desulfination versus decarboxylation as a means of generating three- and five-coordinate organopalladium complexes [Pd] to study their fundamental bimolecular reactivity
期刊论文
Journal of Organometallic Chemistry, 2019, 卷号: Vol.882, 页码: 42-49
作者:
Zilin Wang
;
Yang Yang
;
Paul S. Donnelly
;
Allan J. Canty
;
Richard A.J. O'Hair
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/13
Decarboxylation
Desulfination
Organopalladium
Electrospray
ionization
Mechanism
DFT
calculation
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