About

From artificial intelligence to molecular science.

I am a fourth-year undergraduate majoring in Artificial Intelligence in the Artificial Intelligence Experimental Class at Xi'an Jiaotong University. I am also a research assistant in Prof. Tengfei Luo's group in the Department of Aerospace and Mechanical Engineering at the University of Notre Dame.

I enrolled at Xi'an Jiaotong University in 2023 and expect to graduate in 2027. I have been a research assistant at Notre Dame since October 2025. I was a visiting student at Notre Dame from August to December 2025 and returned for summer research through iSURE from July to September 2026.

My research interests include JEPA-style representation learning for molecular dynamics and coarse-grained modeling. I am particularly interested in optimizing machine learning interatomic potentials for high-performance computing: understanding computational redundancy, reducing GPU memory requirements, and making molecular simulation more efficient.

Education

Xi'an Jiaotong University

Fourth-year undergraduate · Artificial Intelligence

Artificial Intelligence Experimental Class

Level
Undergraduate
Dates
2023 - 2027 (expected)

Academic experience

Research Assistant

October 2025 - Present

University of Notre Dame

Prof. Tengfei Luo's group · Department of Aerospace and Mechanical Engineering

Research in AI for materials and molecular simulation.

Summer Research Participant (iSURE)

July - September 2026

University of Notre Dame

International Summer Undergraduate Research Experience (iSURE).

Visiting Student

August - December 2025

University of Notre Dame

Semester visiting student.

Research interests

Skills

Molecular simulation & MLIPs
Experience with UMA/FAIR-Chem and MACE for molecular simulation.
High-performance computing
Experience using Notre Dame's Center for Research Computing (CRC) for research computing.
Systems & networking
Independent setup and configuration of a VPN.

Programming languages: C++, Python

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