Xia, Zaishuo

3 publications

ICML 2025 Efficient and Scalable Density Functional Theory Hamiltonian Prediction Through Adaptive Sparsity Erpai Luo, Xinran Wei, Lin Huang, Yunyang Li, Han Yang, Zaishuo Xia, Zun Wang, Chang Liu, Bin Shao, Jia Zhang

ICLR 2025 Enhancing the Scalability and Applicability of Kohn-Sham Hamiltonians for Molecular Systems Yunyang Li, Zaishuo Xia, Lin Huang, Xinran Wei, Samuel Harshe, Han Yang, Erpai Luo, Zun Wang, Jia Zhang, Chang Liu, Bin Shao, Mark Gerstein

ICLR 2024 GNNCert: Deterministic Certification of Graph Neural Networks Against Adversarial Perturbations Zaishuo Xia, Han Yang, Binghui Wang, Jinyuan Jia