Calculation of electronic structure and many-body interactions in quantum materials
Moiré materials, 2D materials, Fe-based superconductors

Design of functional nanomaterials and nanostructures for next-generation quantum devices
One-dimensional single-chain materials, molecular nanomachines, pseudospin tunneling junctions

Development of electronic-structure methods using high-performance computing
Density functional theory, large-scale tight-binding calculations, many-body perturbation theory