Zheng Yu

6PUBLICATIONS
10CO-AUTHORS
Polymers and plasticsFluid-structure interaction and aeroacousticsComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Electrochemical energy storage and conversionTheoretical quantum chemistry
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Publications (6)

|Aug 05, 2026
Computational exploration of the structure and mechanical behaviour of hybrid epoxy-acrylate dual-cure systems.

|Nov 14, 2025
Infrared spectral signatures of interfacial water at TiO2-electrolyte interfaces from deep potential molecular dynamics.

Chunyi Zhang, Zheng Yu, Roberto Car

|Oct 07, 2025
Pressure-Consistent Iterative Boltzmann Inversion for Coarse-Grained Molecular Dynamics.

Zheng Yu, Ryan J Szukalo, Quinn M Gallagher

|Oct 07, 2024
Chemically Transferable Electronic Coarse Graining for Polythiophenes.

Zheng Yu, Nicholas E Jackson

|Feb 04, 2024
How close are the classical two-body potentials to ab initio calculations? Insights from linear machine learning based force matching.

Zheng Yu, Ajay Annamareddy, Dane Morgan

|Mar 03, 2018
Optical properties of dense lithium in electride phases by first-principles calculations.

Zheng Yu, Hua Y Geng, Y Sun

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Frequent Collaborators

2 joint publications

Nicholas E Jackson

1 joint publications

Ajay Annamareddy

1 joint publications

Dane Morgan

1 joint publications

Bu Wang