Transforming Computational Materials Science with AI and Machine Learning

Welcome to my website! I am currently an Associate Professor of Materials Science and Chemical Engineering Practice at University of Southern California. My research focuses on atomistic simulations using AI, Machine Learning, and High-performance computing, and educate next generation cyber-workforce at the nexus of exascale computing, artificial intelligence (AI) and quantum computing.

Recent Projects:
Equivariant Foundation Model for Exascale Molecular Dynamics Simulations

keywords: mlip, molecular dynamics, hpc

Autonomous Event Miner using Deep Reinforcement Learning

keywords: deep reinforcement learning, long time dynamics, molecular diffusion