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Shule Liu

9PUBLICATIONS

1CO-AUTHORS

Computational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Structure and dynamics of materialsMicrofluidics and nanofluidicsColloid and surface chemistryTransport properties and non-equilibrium processes

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Publications (9)

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|Dec 10, 2025

How Grafting Density Shapes Analyte Adsorption in HILIC Chromatography: Nonmonotonic Trend Revealed by Umbrella Sampling Simulations.

Chengze Li, Shuhao Ge, Ying Zhu

|Nov 21, 2025

Corrosion mechanism of Cr-rich nickel-based alloys in a ternary molten salt: morphology analysis and first-principles study of Cl adsorption.

Wenhao Zhao, Dongkai Ni, Wenjie Qi

|Sep 02, 2025

Interfacial Behavior of PNIPAM Brushes under Shear and Thermal Stimuli: The Role of Grafting Density.

Xiufang Liang, Chengze Li, Ying Zhu

|Feb 26, 2025

Effect of Apolar Chain Grafting Density on Mobile-Phase Transport Properties Revealed by Molecular Simulations.

Shuhao Ge, Shule Liu

|Apr 28, 2022

Molecular dynamics simulations of amino acid adsorption and transport at the acetonitrile-water-silica interface: the role of side chains.

Yong-Peng Wang, Fei Liang, Shule Liu

|Feb 03, 2021

Collective Solvation and Transport at Tetrahydrofuran-Silica Interfaces for Separation of Aromatic Compounds: Insight from Molecular Dynamics Simulations.

Fei Liang, Jing Ding, Shule Liu

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Kezhou Ren

Frequent Collaborators

1 joint publications

Kezhou Ren

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