Nianlong Zou

Deep-learning density functional theory Hamiltonian for efficient ab initio electronic-structure calculation

He Li, Zun Wang, Nianlong Zou et al. · Nature Computational Science · 2022 · 199 citations · Full text

Quantum Science, Engineering, Physics +7

General framework for E(3)-equivariant neural network representation of density functional theory Hamiltonian

Xiaoxun Gong, He Li, Nianlong Zou et al. · Nature Communications · 2023 · 98 citations · Full text

Deep-learning electronic-structure calculation of magnetic superstructures

He Li, Zechen Tang, Xiaoxun Gong et al. · Nature Computational Science · 2023 · 49 citations · Full text

Ubiquitous Topological States of Phonons in Solids: Silicon as a Model Material

Yizhou Liu, Nianlong Zou, Sibo Zhao et al. · Nano Letters · 2022 · 48 citations

Engineering, Topological Materials, Topological Quantum State +21

Deep-Learning Density Functional Perturbation Theory

He Li, Zechen Tang, Jingheng Fu et al. · Physical Review Letters · 2024 · 44 citations · Full text