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科研机构
理论物理研究所 [9]
内容类型
期刊论文 [9]
发表日期
2018 [4]
2016 [4]
2015 [1]
学科主题
Chemistry [9]
Physics [2]
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Aggregation behavior of dihexadecylviologen bistriflimide ionic liquid crystal in different solvents: influence of polarity and concentration
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 35, 页码: 22730-22738
作者:
Li, S
;
Saielli, G
;
Wang, YT
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浏览/下载:39/0
  |  
提交时间:2018/12/27
ELECTROCHROMIC DEVICES
DIELECTRIC-CONSTANT
MOLECULAR-SOLVENTS
ORGANIC-MOLECULES
AQUEOUS-SOLUTIONS
DFT CALCULATIONS
FORCE-FIELD
VIOLOGEN
NMR
SIMULATIONS
Metastable State during Melting and Solid-Solid Phase Transition of [C&ITn&ITMim][NO3] (&ITn&IT=4-12) Ionic Liquids by Molecular Dynamics Simulation
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2018, 卷号: 122, 期号: 1, 页码: 229-239
作者:
Cao, WD
;
Wang, YT
;
Saielli, G
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  |  
浏览/下载:34/0
  |  
提交时间:2018/12/27
HEXAFLUOROPHOSPHATE SALTS
CHAIN-LENGTH
FORCE-FIELD
CRYSTALS
BEHAVIOR
DIFFUSION
INSIGHTS
SYSTEMS
Metastable State during Melting and Solid-Solid Phase Transition of [C&ITn&ITMim][NO3] (&ITn&IT=4-12) Ionic Liquids by Molecular Dynamics Simulation
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2018, 卷号: 122, 期号: 1, 页码: 229-239
作者:
Wang, YT
;
Cao, WD
;
Saielli, G
收藏
  |  
浏览/下载:76/0
  |  
提交时间:2018/12/26
HEXAFLUOROPHOSPHATE SALTS
CHAIN-LENGTH
FORCE-FIELD
CRYSTALS
BEHAVIOR
DIFFUSION
INSIGHTS
SYSTEMS
Aggregation behavior of dihexadecylviologen bistriflimide ionic liquid crystal in different solvents: influence of polarity and concentration
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 35, 页码: 22730-22738
作者:
Saielli, G
;
Li, S
;
Wang, YT
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2018/12/26
ELECTROCHROMIC DEVICES
DIELECTRIC-CONSTANT
MOLECULAR-SOLVENTS
ORGANIC-MOLECULES
AQUEOUS-SOLUTIONS
DFT CALCULATIONS
FORCE-FIELD
VIOLOGEN
NMR
SIMULATIONS
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
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
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
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2019/04/08
STIMULUS-RESPONSE BEHAVIOR
TEMPERATURE MOLTEN-SALTS
1-ALKYL-3-METHYLIMIDAZOLIUM CATIONS
CRYSTALLINE VIOLOGEN
COMPUTER-SIMULATION
IMIDAZOLIUM CATION
PHASE-BEHAVIOR
FORCE-FIELD
SOLVENTS
CHLORIDE
Insights on the Isotropic-to-Smectic A Transition in Ionic Liquid Crystals from Coarse-Grained Molecular Dynamics Simulations: The Role of Microphase Segregation
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2015, 卷号: 119, 期号: 9, 页码: 3829-3836
作者:
Saielli, G
;
Bagno, A
;
Wang, YT
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浏览/下载:16/0
  |  
提交时间:2016/11/21
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