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Influence of the ion size on the stability of the smectic phase of ionic liquid crystals 期刊论文
SOFT MATTER, 2020, 卷号: 16, 期号: 2, 页码: 411-420
Authors:  Cao, Wudi;  Senthilkumar, Beeran;  Causin, Valerio;  Swamy, Vincent P.;  Wang, Yanting;  Saielli, Giacomo
Favorite  |  View/Download:57/0  |  Submit date:2020/06/16
MOLECULAR-DYNAMICS SIMULATIONS  SPATIAL HETEROGENEITY  THERMAL-BEHAVIOR  CHAIN-LENGTH  GUANIDINIUM  TRANSITION  AGGREGATION  TRANSPORT  INSIGHTS  STATE  
Multiscale computational prediction of beta-sheet peptide self-assembly morphology 期刊论文
MOLECULAR SIMULATION, 2020, 页码: 暂无
Authors:  Deng, Li;  Wang, Yanting
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MOLECULAR-DYNAMICS METHOD  INTERMOLECULAR FORCES  PROTEIN AGGREGATION  NANOMECHANICS  POLYMORPHISM  SIMULATIONS  TRANSITIONS  NANOTUBES  FIBRILS  SOLVENT  
Percolation Phase Transition from Ionic Liquids to Ionic Liquid Crystals 期刊论文
SCIENTIFIC REPORTS, 2019, 卷号: 9, 页码: 13169
Authors:  Li, Shen;  Wang, Yanting
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NANOSTRUCTURAL ORGANIZATION  SPATIAL HETEROGENEITY  DYNAMICS  
Phase Behaviors of Ionic Liquids Heating from Different Crystal Polymorphs toward the Same Smectic-A Ionic Liquid Crystal by Molecular Dynamics Simulation 期刊论文
CRYSTALS, 2019, 卷号: 9, 期号: 1, 页码: 26
Authors:  Cao, WD;  Wang, YT
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SPATIAL HETEROGENEITY  ATOMIC CHARGES  CHAIN-LENGTH  TRANSITION  INSIGHTS  DIFFUSION  STATE  
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
Authors:  Cao, WD;  Wang, YT;  Saielli, G
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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
Authors:  Li, S;  Saielli, G;  Wang, YT
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ELECTROCHROMIC DEVICES  DIELECTRIC-CONSTANT  MOLECULAR-SOLVENTS  ORGANIC-MOLECULES  AQUEOUS-SOLUTIONS  DFT CALCULATIONS  FORCE-FIELD  VIOLOGEN  NMR  SIMULATIONS  
Atomic origins of water-vapour-promoted alloy oxidation 期刊论文
NATURE MATERIALS, 2018, 卷号: 17, 期号: 6, 页码: 514
Authors:  Luo, LL;  Su, M;  Yan, PF;  Zou, LF;  Schreiber, DK;  Baer, DR;  Zhu, ZH;  Zhou, GW;  Wang, YT;  Bruemmer, SM;  Xu, ZJ;  Wang, CM
Adobe PDF(2366Kb)  |  Favorite  |  View/Download:116/0  |  Submit date:2018/12/27
TRANSMISSION ELECTRON-MICROSCOPY  OXIDE-GROWTH  DYNAMICS  VISUALIZATION  ADHERENCE  SCALES  CR  ATMOSPHERES  INTERFACE  CATALYSIS  
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
Authors:  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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Ionic Liquids  Surface  Molecular Dynamics Simulation  Electric Field  
Moderate point: Balanced entropy and enthalpy contributions in soft matter 期刊论文
CHINESE PHYSICS B, 2017, 卷号: 26, 期号: 3, 页码: 30506
Authors:  He, BJ;  Wang, YT;  Wang, YT (reprint author), Chinese Acad Sci, Inst Theoret Phys, CAS Key Lab Theoret Phys, Beijing 100190, Peoples R China.
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Moderate Point  Balanced Entropy  Enthalpy Contribution  
Dual Ionic and Organic Nature of Ionic Liquids 期刊论文
SCIENTIFIC REPORTS, 2016, 卷号: 6, 页码: 19644
Authors:  Shi, R;  Wang, YT;  Wang, YT (reprint author), Chinese Acad Sci, Inst Theoret Phys, State Key Lab Theoret Phys, 55 East Zhongguancun Rd,POB 2735, Beijing 100190, Peoples R China.
Adobe PDF(1219Kb)  |  Favorite  |  View/Download:94/5  |  Submit date:2017/10/13