activity
20092023
most citedChallenges in Design of Kitaev Materials: Magnetic Interactions from Competing Energy Scales

516 citations · 988 across the 22 of their papers we have counts for

collaborators

22 papers

cond-mat.mtrl-sci2023★ 9 cited

Topological superconductor candidates PdBiTe and PdBiTe from a generic ab initio strategy

Aiyun Luo, Ying Li, Yi Qin +3

Superconducting topological metals (SCTMs) have recently emerged as a promising platform of topological superconductivity (TSC) and Majorana zero modes(MZMs) for quantum computatio…

cond-mat.mtrl-sci2022★ 1 cited

Electronic structures and stability investigation of the new class of large band gap topological insulators MTlTe (M = Cd, Hg)

Ying Li, Gang Xu

By means of ternary chemical potential phase diagram and phonon spectrum calculations, we propose that TlTe ( = Cd, Hg), the derivatives of TlTe, are thermody…

cond-mat.str-el2022★ 55 cited

Ab initio guided minimal model for the "Kitaev" material BaCo(AsO): Importance of direct hopping, third-neighbor exchange and quantum fluctuations

Pavel A. Maksimov, Alexey V. Ushakov, Zlata V. Pchelkina +3

By considering two {\it ab initio}-based complementary approaches, we analyze the electronic structure and extract effective spin models of BaCo(AsO), a honeycomb mater…

cond-mat.mtrl-sci2021★ 4 cited

Topological Luttinger semimetallic phase accompanied with surface states realized in silicon

Ying Li, Chi-Ho Cheung, Gang Xu

By means of systematically first-principles calculations and model analysis, a complete phase diagram of the body-centered silicon(BC8-Si) via lattice constant a and internal atomi…

cond-mat.str-el2021★ 35 cited

Modified Curie-Weiss Law for Magnets

Ying Li, Stephen M. Winter, David A. S. Kaib +2

In spin-orbit-coupled magnetic materials, the usually applied Curie-Weiss law can break down. This is due to potentially sharp temperature-dependence of the local magnetic moments.…

cond-mat.str-el2020★ 10 cited

Soft and anisotropic local moments in 4 and 5 mixed-valence MO dimers

Ying Li, Alexander A. Tsirlin, Tusharkanti Dey +3

We investigate via exact diagonalization of finite clusters the electronic structure and magnetism of MO dimers in the mixed-valence hexagonal perovskites AB'MO…