北京中关村学院导师
个人主页链接:https://weixinran.github.io
研究方向
1. 面向大规模体系的高效人工智能模型, 主要包括机器学习力场、电子结构预测以及基于模型的科学计算加速方法等。
2. 高性能科学计算方法与软件,主要包括基于大模型的高性能代码生成与优化、基于硬件的并行和稀疏加速方法等。
代表性学术论文
Luo, E.*, Wei, X.*. Efficient and Scalable Density Functional Theory Hamiltonian Prediction through Adaptive Sparsity. ICML, 2025.
Ju, F. *, Wei, X. *, Huang, L. *, Jenkins, A. J., Xia, L. Zhang, J. Acceleration without disruption: DFT software as a service. J. Chem. Theory Comput., 2024.
Shi, W., Wei, X., Zhang, J., Ni, X., Jiang, A., Bian, J. Cooperative policy learning with pre-trained heterogeneous observation representations. AAMAS, 2021.
Li, Y., Huang, L., Ding, Z., Wei, X., Wang, C.. E2Former: A Linear-time Efficient and Equivariant Transformer for Scalable Molecular Modeling. NeurIPS, 2026.
Yamaguchi, A. J., Sato, T., Tobase, T., Wei, X., Huang, L., Zhang, J. Multiscale numerical simulation of CO2 hydrate storage using machine learning. Fuel, 2023.



