Theme 01
Alloy Thermodynamics and Phase Diagrams
CALPHAD modeling, phase stability calculations, and phase diagram prediction for complex alloys using machine-learning interatomic potentials and high-throughput workflows.
Related publicationsResearch
Work Areas
This page is set up as a scaffold for more detailed project descriptions, figures, datasets, and software links.
Theme 02
Defects, Interstitials, and High-entropy Alloys
Structure search and low-energy configuration discovery in defective high-entropy alloys using Monte Carlo sampling, atomistic simulation, and machine-learning potentials.
PAIPAI softwareTheme 03
Metallic Glasses and Amorphous Structures
Special Glass Structures, density fluctuations, shear band formation, and structure-property relationships in bulk metallic glasses.
MAST softwareComing next
Project Narratives
Add fuller descriptions here later: research questions, representative figures, methods, collaborators, selected papers, and reproducible code.