4 papers
Topological Origin of Intrinsic High Chern Numbers in Two-Dimensional MX Materials
Zujian Dai, Xudong Zhu, Lixin He
Despite sharing a common lattice structure, monolayer MX compounds realize quantum anomalous Hall phases with distinct Chern numbers, a striking phenomenon that has not bee…
Advancing Universal Deep Learning for Electronic-Structure Hamiltonian Prediction of Materials
Shi Yin, Zujian Dai, Xinyang Pan +1
Deep learning methods for electronic-structure Hamiltonian prediction has offered significant computational efficiency advantages over traditional DFT methods, yet the diversity of…
Interplay between the magnetic structures and the surface states in MnBiTe from first-principles studies
Zujian Dai, Gan Jin, Lixin He
The antiferromagnetic (AFM) topological insulator MnBiTe was believed to have a topological surface state (TSS) with large band gap due to the ferromagnetic (FM) order…
First-principles calculations of the surface states of doped and alloyed topological materials via band unfolding method
Zujian Dai, Gan Jin, Lixin He
One of the most remarkable characteristics of topological materials is that they have special surface states, which are determined by the topological properties of their bulk mater…