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Qin-Yu Zhu

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Open access Sep 2026

Local Structure and Dynamics in Melts and Glasses of Polyzwitterions

Polyzwitterions are a class of polyampholytes containing equal numbers of positive and negative charges bonded together within each repeating monomer. The electrostatic interactions and the chain connectivity are believed to be the most important factors in affecting local ordering and dynamics in the melts and glass...

Qin-Yu Zhu, Rajeev Kumar · 0 citations
Open access Sep 2026

Molecular dynamics based study on the effects of cation size on the local structure and diffusion in polymerized ionic liquids.

We have used coarse-grained molecular dynamics simulations to understand the effect of cation size on ion diffusion in polymerized ionic liquids at temperatures well above the glass transition temperature of the polymers. We investigated dependencies of the diffusion constant on the cation radius and static dielectric...

Colin S. Gillespie, Qin-Yu Zhu, Robert A. Riggleman et al. · 0 citations

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