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Chinese Academy of Sciences Institutional Repositories Grid
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过程工程研究所 [48]
金属研究所 [43]
合肥物质科学研究院 [37]
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期刊论文 [229]
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2022 [229]
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Physics [5]
Density Fu... [2]
Hydrogen B... [1]
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发表日期:2022
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Ultra-stable high voltage lithium metal batteries enabled by solid garnet electrolyte surface-engineered with a grafted aromatics layer
期刊论文
OAI收割
CHEMICAL ENGINEERING JOURNAL, 2022, 卷号: 450, 页码: 10
作者:
Li, Jin
;
Zhang, Haitao
;
Cui, Yingyue
;
Da, Haoran
;
Cai, Yingjun
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2023/02/24
Solid-state electrolytes
Surface engineering
Azo compound
Free radical
Conversion chemistry
Experimental and theoretical study on the extraction of keratin from human hair using protic ionic liquids
期刊论文
OAI收割
JOURNAL OF MOLECULAR LIQUIDS, 2022, 卷号: 368, 页码: 9
作者:
Wang, Junlei
;
Gao, Hongshuai
;
Qin, Congwen
;
Zhao, Zhimin
;
Yuan, Hanmeng
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2023/02/24
Human hair
Protic ionic liquids
Keratin
Interaction
Determining the contribution of Mo single atoms components in MoO2 nanocatalyst in transfer hydrogenation
期刊论文
OAI收割
NANO RESEARCH, 2022, 页码: 9
作者:
Hu, Ze-Nan
;
Ai, Yongjian
;
Zhao, Yan
;
Wang, Yiming
;
Ding, Kelong
  |  
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2023/05/09
synergistic effect
Mo single atoms
MoO2 nanocatalyst
transfer hydrogenation
nitroarenes
Density Functional Theory Calculations of Equilibrium Mo Isotope Fractionation Factors among MoOxS4-x2- Species in the Aqueous Phase by the ONIOM Method
期刊论文
OAI收割
ACS EARTH AND SPACE CHEMISTRY, 2022, 页码: 14
作者:
He YY(何雨旸)
;
Gao,Caihong
;
Wei,Wei
;
Liu,Yun
  |  
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2023/02/03
paleoredox proxy
ab initio molecular dynamics
implicit solvent model
dispersion correction
water-droplet
periodical boundary condition
Density Functional Theory Calculations of Equilibrium Mo Isotope Fractionation Factors among MoOxS4-x2- Species in the Aqueous Phase by the ONIOM Method
期刊论文
OAI收割
ACS EARTH AND SPACE CHEMISTRY, 2022, 页码: 14
作者:
He, Yuyang
;
Gao, Caihong
;
Wei, Wei
;
Liu, Yun
  |  
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2023/03/31
paleoredox proxy
ab initio molecular dynamics
implicit solvent model
dispersion correction
water-droplet
periodical boundary condition
A spectroscopic approach to identifying the out-of-plane conformations of Ni(II) meso-tetraphenylporphyrin in solution
期刊论文
OAI收割
JOURNAL OF MOLECULAR STRUCTURE, 2022, 卷号: 1269
作者:
Wang, Shenhao
;
Huang, Qing
  |  
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2022/12/23
NiTPP
Out-of-plane deformations
DFT
Molecular dynamics
Raman spectroscopy
1 H-NMR
Cl-induced passivity breakdown in alpha-Fe2O3 (0001), alpha-Cr2O3 (0001), and their interface: A DFT study
期刊论文
OAI收割
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2022, 卷号: 129, 页码: 70-78
作者:
Yin, Xiaoran
;
Wang, Haitao
;
Han, En-Hou
  |  
收藏
  |  
浏览/下载:39/0
  |  
提交时间:2022/07/14
Hematite
Chromia
DFT plus U
Interface
Cl-induced depassivation
In Situ Raman Spectroscopy and DFT Studies of the Phase Transition from Zircon to Reidite at High P-T Conditions
期刊论文
OAI收割
MINERALS, 2022, 卷号: 12, 期号: 12, 页码: 11
作者:
Gao, Yue
;
Zheng, Zhi
;
Zhao, Xia
;
Liu, Yuegao
;
Chen, Jiangzhi
  |  
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2023/01/30
zircon
reidite
phase transition
high P-T experiment
diamond anvil cell
in situ Raman spectroscopy
density functional theory
Boosting nitrogen electrocatalytic fixation by three-dimensional TiO2-delta N delta nanowire arrays
期刊论文
OAI收割
JOURNAL OF ENERGY CHEMISTRY, 2022, 卷号: 75, 页码: 293-300
作者:
Mu, Jianjia
;
Gao, Xuan-Wen
;
Liu, Zhaomeng
;
Luo, Wen-Bin
;
Sun, Zhenhua
  |  
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2023/05/09
Nanowires
TiO2-delta N delta
Electrocatalysis
NRR
DFT
Boosting nitrogen electrocatalytic fixation by three-dimensional TiO2-delta N delta nanowire arrays
期刊论文
OAI收割
JOURNAL OF ENERGY CHEMISTRY, 2022, 卷号: 75, 页码: 293-300
作者:
Mu, Jianjia
;
Gao, Xuan-Wen
;
Liu, Zhaomeng
;
Luo, Wen-Bin
;
Sun, Zhenhua
  |  
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2023/05/09
Nanowires
TiO2-delta N delta
Electrocatalysis
NRR
DFT