collaborators
Showing cond-mat.mtrl-sciShow all

5 papers · 1 filter

cond-mat.mtrl-sci2026

Accelerating grain boundary modelling and simulation by automated pre-evaluation of the irreducible macroscopic representation

Wei Wan

A major challenge in the modelling and simulation of grain boundaries (GBs) is the conflict between the system size and computation capability, which inherently restricts the compu…

cond-mat.mtrl-sci2025

Decomposition of low-angle grain boundaries

Wei Wan, Changxin Tang, Eric R Homer

Grain boundaries (GBs) merge and grains disappear during microstructure evolution. However, the Peach-Koehler model predicts that particular stress states may reverse such a proces…

cond-mat.mtrl-sci2025

Decomposition of general grain boundaries

Wei Wan, Junwen Deng, Changxin Tang

As a central part of microstructure evolution, grain boundary (GB) migration is believed to be both monolithic and unidirectional. But here, we introduce the concept of GB decompos…

cond-mat.mtrl-sci2024

Energy function for grain boundary plane orientation fundamental zone

Wei Wan

The success of grain boundary (GB) plane orientation fundamental zone (FZ) has connected GB structures across multiple crystallographic characters with their properties in a unique…

cond-mat.mtrl-sci2024

Can we predict mixed grain boundaries from their tilt and twist components?

Wei Wan, Changxin Tang, Eric R. Homer

One of the major challenges towards understanding and further utilizing the properties and functional behaviors of grain boundaries (GB) is the complexity of general GBs with mixed…