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The structuring effect of the alkyl domains on the polar network of ionic liquid mixtures: a molecular dynamics study
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 31, 页码: 18783-18792
作者:
Mazzilli, Valerio
;
Wang, Yanting
;
Saielli, Giacomo
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  |  
浏览/下载:8/0
  |  
提交时间:2023/01/16
SPATIAL HETEROGENEITY
AGGREGATION
SIMULATIONS
CATIONS
Synthesis and biological activity of new bisbenzofuran-imidazolium salts
期刊论文
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2020
作者:
Wang, Xue-Quan
;
Ye, Ping-Ting
;
Bai, Meng-Jiao
;
Miu, Wei-Hang
;
Yang, Zhi-Xin
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  |  
浏览/下载:24/0
  |  
提交时间:2021/01/05
Synthesis and Cytotoxic Activity of Novel Hybrid Compounds between Piperonyl and Imidazolium Salts
期刊论文
CHINESE JOURNAL OF ORGANIC CHEMISTRY, 2020
作者:
Liu Zhengfen
;
Zi Yujin
;
Zhang Linlin
;
Fang Yongsheng
;
Shen Yanzhen
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  |  
浏览/下载:11/0
  |  
提交时间:2021/01/05
Surface structure of ionic liquids under an external electric field
期刊论文
MOLECULAR SIMULATION, 2017, 卷号: 43, 期号: 13-16, 页码: 1295-1299
作者:
Shi, R
;
Wang, YT
;
Shi, R (reprint author), Univ Tokyo, Inst Ind Sci, Dept Fundamental Engn, Tokyo, Japan.
;
Shi, R (reprint author), Chinese Acad Sci, Inst Theoret Phys, CAS Key Lab Theoret Phys, Beijing, Peoples R China.
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  |  
浏览/下载:19/0
  |  
提交时间:2017/12/21
Ionic Liquids
Surface
Molecular Dynamics Simulation
Electric Field
Surface structure of ionic liquids under an external electric field
期刊论文
MOLECULAR SIMULATION, 2017, 卷号: 43, 期号: 13-16, 页码: 1295-1299
作者:
Wang, YT
;
Shi, R
;
Shi, R (reprint author), Univ Tokyo, Inst Ind Sci, Dept Fundamental Engn, Tokyo, Japan.
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  |  
浏览/下载:11/0
  |  
提交时间:2018/01/29
Ionic Liquids
Surface
Molecular Dynamics Simulation
Electric Field
Imidazolium-bis(salicylato) borate Ionic Liquids as Lubricant Additives: the Effect of Alkyl Chain Lengths on the Tribological Performance
期刊论文
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE, 2017, 卷号: 38, 期号: 12, 页码: 2198-2205
作者:
Liu Dan
;
Sun Liwen
;
Zhang Yunxiao
;
Cai Tao
;
Shang Wangji
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  |  
浏览/下载:43/0
  |  
提交时间:2018/12/04
Halogen-free
Schiff-bases
Ester
Oil
Behavior
Friction
Saps
Zddp
Effect of Ion Rigidity on Physical Properties of Ionic Liquids Studied by Molecular Dynamics Simulation
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2016, 卷号: 120, 期号: 25, 页码: 5678-5690
作者:
Ramirez-Gonzalez, PE
;
Ren, G
;
Saielli, G
;
Wang, YT
;
Wang, YT (reprint author), Chinese Acad Sci, Inst Theoret Phys, CAS Key Lab Theoret Phys, 55 East Zhongguancun Rd,POB 2735, Beijing 100190, Peoples R China.
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浏览/下载:19/0
  |  
提交时间:2017/10/13
Role of the Electrostatic Interactions in the Stabilization of Ionic Liquid Crystals: Insights from Coarse-Grained MD Simulations of an Imidazolium Model
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2016, 卷号: 120, 期号: 34, 页码: 9152-9160
作者:
Saielli, G
;
Wang, YT
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  |  
浏览/下载:19/0
  |  
提交时间:2019/04/08
MOLECULAR-DYNAMICS SIMULATIONS
FORCE-FIELD
SPATIAL HETEROGENEITY
ATOMISTIC SIMULATIONS
DICYANAMIDE ANIONS
TAIL AGGREGATION
SOLAR-CELLS
PHASE
MESOMORPHISM
TRANSITION
Effect of Ion Rigidity on Physical Properties of Ionic Liquids Studied by Molecular Dynamics Simulation
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2016, 卷号: 120, 期号: 25, 页码: 5678-5690
作者:
Wang, YT
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  |  
浏览/下载:13/0
  |  
提交时间:2017/02/27
Role of the Electrostatic Interactions in the Stabilization of Ionic Liquid Crystals: Insights from Coarse-Grained MD Simulations of an Imidazolium Model
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2016, 卷号: 120, 期号: 34, 页码: 9152-9160
作者:
Saielli, G
;
Wang, YT
;
Saielli, G (reprint author), Univ Padua, Unit Padova, CNR Inst Membrane Technol, Via Marzolo, I-35131 Padua, Italy.
;
Saielli, G (reprint author), Univ Padua, Dept Chem Sci, Via Marzolo, I-35131 Padua, Italy.
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  |  
浏览/下载:16/0
  |  
提交时间:2017/10/13
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