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Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
地质与地球物理研究所 [2]
力学研究所 [1]
南海海洋研究所 [1]
金属研究所 [1]
上海药物研究所 [1]
过程工程研究所 [1]
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OAI收割 [8]
内容类型
期刊论文 [7]
会议论文 [1]
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2024 [1]
2023 [1]
2019 [1]
2008 [2]
2002 [1]
1997 [1]
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学科主题
Cellulose [1]
Engineerin... [1]
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Reconfiguring the Coordination Structure in Deep Eutectic Electrolytes for Enabling Stable Operation of Zinc-Ion Batteries
期刊论文
OAI收割
NANO LETTERS, 2024
作者:
Guo, Qiang
;
Mo WX(莫伟兴)
;
Huang, Jianhang
;
Liu F(刘峰)
  |  
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2024/12/02
deep eutectic electrolyte
solvation structure
inorganic-rich interphase
Zn anode
2D Solid-Electrolyte Interphase Built by High-Concentration Polymer Electrolyte for Highly Reversible Silicon Anodes
期刊论文
OAI收割
ADVANCED ENERGY MATERIALS, 2023, 页码: 8
作者:
Wang, Yuxiao
;
Li, Tianyu
;
Yang, Xiaofei
;
Yin, Qianwen
;
Wang, Shaogang
  |  
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2024/01/07
2D SEI
high-concentration electrolyte
silicon anodes
solid-state electrolytes
solvation structure
Concentration-dependent structure of mixed NH4Cl and (NH4)(2)SO4 aqueous solutions from the X-ray diffraction, Raman spectroscopy and molecular dynamics simulations
期刊论文
OAI收割
JOURNAL OF MOLECULAR STRUCTURE, 2019, 卷号: 1185, 期号: -, 页码: 469—477
作者:
Wang, JH
;
Lin, H
;
Li, F
;
Li, SY
;
An, SS
  |  
收藏
  |  
浏览/下载:59/0
  |  
提交时间:2019/12/30
AB-INITIO
WATER-STRUCTURE
HYDRATION
AMMONIUM
HYDROGEN
ION
SCATTERING
K+
TEMPERATURE
SOLVATION
The structure, dynamics and solvation mechanisms of ions in water from long time molecular dynamics simulations: a case study of CaCl2 (aq) aqueous solutions
期刊论文
OAI收割
MOLECULAR PHYSICS, 2008, 卷号: 106, 期号: 24, 页码: 2685-2697
作者:
Li, Mingyan
;
Duan, Zhenhao
;
Zhang, Zhigang
;
Zhang, Chi
;
Weare, John
  |  
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2018/09/26
molecular dynamics
CaCl2 aqueous solution
liquid structure
ion pairing
solvation
The structure, dynamics and solvation mechanisms of ions in water from long time molecular dynamics simulations: a case study of CaCl2 (aq) aqueous solutions
期刊论文
OAI收割
MOLECULAR PHYSICS, 2008, 卷号: 106, 期号: 24, 页码: 2685-2697
作者:
Li, Mingyan
;
Duan, Zhenhao
;
Zhang, Zhigang
;
Zhang, Chi
;
Weare, John
  |  
收藏
  |  
浏览/下载:23/0
  |  
提交时间:2018/09/26
molecular dynamics
CaCl2 aqueous solution
liquid structure
ion pairing
solvation
Evaluation of three models for predicting newly determined octanol-water partition coefficients and mechanisms for substituted aromatic compounds
期刊论文
OAI收割
WATER ENVIRONMENT RESEARCH, 2002, 卷号: 74, 期号: 3, 页码: 242-247
Wu, CD
;
Wei, DB
;
Liu, XH
;
Lin, ZF
;
Wang, LS
收藏
  |  
浏览/下载:33/0
  |  
提交时间:2011/07/03
n-octanol-water partition coefficient
substituted aromatic compounds
quantitative structure-activity relationships
theoretical linear solvation energy relationship
molecular connectivity index
Structure-activity relationship of channel binding affinity of quaternary ammonium ions
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 1997, 卷号: 18, 期号: 6, 页码: 497-500
作者:
Zhao, SR
;
Jiang, HL
;
Rong, SB
;
Chen, KX
;
Ji, RY
  |  
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2019/01/08
potassium channels
ammonium compounds
structure-activity relationship
solvation energy
least-squares analysis
computer-aided design
Insights into cellulose dissolving in ionic liquids by molecular simulation
会议论文
OAI收割
Salt Lake City, UT, United states, November 8, 2015 - November 13, 2015
作者:
Liu, Xiaomin
;
Li, Yao
;
Zhao, Yuling
;
Wang, Jianji
;
Zhang, Suojiang
  |  
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2023/06/16
Association reactions - Negative ions - Molecular structure - Dissolution - Ionic liquids - Molecular dynamics - Electronegativity - Positive ions - Hydrogen bonds - Solvation