417 citations · 6.2k across the 94 of their papers we have counts for
96 papers
Atomistic Origin of Diverse Charge Density Wave States in CsVSb
Binhua Zhang, Hengxin Tan, Binghai Yan +2
Kagome metals AV3Sb5 (A=K,Rb,or Cs) exhibit intriguing charge density wave (CDW) instabilities, which interplay with superconductivity and band topology. However, despite firm obse…
Electronically phase separated nano-network in antiferromagnetic insulating LaMnO3/PrMnO3/CaMnO3 tricolor superlattice
Qiang Li, Tian Miao, Huimin Zhang +15
Strongly correlated materials often exhibit an electronic phase separation (EPS) phenomena whose domain pattern is random in nature. The ability to control the spatial arrangement…
Moiré Magnetic Exchange Interactions in Twisted Magnets
Baishun Yang, Yang Li, Hongjun Xiang +2
Besides moiré superlattice, twisting can also generate moiré magnetic exchange interactions (MMEIs) in van der Waals magnets. However, due to the extreme complexity and twist-angle…
Realistic Spin Model for Multiferroic NiI
Xuanyi Li, Changsong Xu, Boyu Liu +3
A realistic first-principle-based spin Hamiltonian is constructed for the type-II multiferroic NiI, using a symmetry-adapted cluster expansion method. Besides single ion anisot…
Transferable E(3) equivariant parameterization for Hamiltonian of molecules and solids
Yang Zhong, Hongyu Yu, Mao Su +2
Using the message-passing mechanism in machine learning (ML) instead of self-consistent iterations to directly build the mapping from structures to electronic Hamiltonian matrices…
Flat-band based ferromagnetic semiconducting state in the graphitic CN monolayer
Chaoyu He, Yujie Liao, Tao Ouyang +3
A new set of lattice-models based on the hexagonal super-cells of the well-known honeycomb lattice with single-hole defect (HL-D-1/2N) are proposed to real…