activity
20072022
most citedQuantum Manifestations of Graphene Edge Stress and Edge Instability: A First-Principles Study

270 citations · 1.6k across the 39 of their papers we have counts for

collaborators

39 papers

cond-mat.mtrl-sci2022★ 27 cited

Temperature Effect on Charge-state Transition Levels of Defects in Semiconductors

Shuang Qiao, Yu-Ning Wu, Xiaolan Yan +3

Defects are crucial in determining the overall physical properties of semiconductors. Generally, the charge-state transition level (TEL), one of the key physical quantities that de…

physics.comp-ph2021★ 23 cited

Role of Interlayer Coupling in the Second Harmonic Generation of Bilayer Transition-metal Dichalcogenides

Xiao Jiang, Lei Kang, Bing Huang

Little is known about the role of weak interlayer coupling in the second harmonic generation (SHG) effects of two-dimensional van der Waals (vdW) systems. In this article, taking h…

cond-mat.str-el2021★ 24 cited

Dirac Nodal Lines and Nodal Loops in a Topological Kagome Superconductor CsVSb

Zhanyang Hao, Yongqing Cai, Yixuan Liu +21

The intertwining of charge order, superconductivity and band topology has promoted the AVSb (A=K, Rb, Cs) family of materials to the center of attention in condensed matter…

cond-mat.str-el2021★ 10 cited

Emergence of Quantum Confinement in Topological Kagome Superconductor CsVSb family

Yongqing Cai, Yuan Wang, Zhanyang Hao +19

Quantum confinement is a restriction on the motion of electrons in a material to specific region, resulting in discrete energy levels rather than continuous energy bands. In certai…

cond-mat.mes-hall2021★ 41 cited

Mott insulator tuning via structural distortion in monolayer 1T-NbSe2

Zhen-Yu Liu, Shuang Qiao, Qiao-Yin Tang +8

Mott state in 1T-TaS2 is predicted to host quantum spin liquids (QSL). However, its insulating mechanism is controversial due to complications from interlayer coupling. Here, we st…

cond-mat.mtrl-sci2020★ 29 cited

Predicting Berborite as Potential Deep-Ultraviolet Nonlinear Optical Crystal from First Principles

Lei Kang, Pifu Gong, Zheshuai Lin +1

Following our ab initio nonlinear optical (NLO) materials design guidelines, in this Letter, we discovered a novel type of structure to realize potential deep-ultraviolet (DUV) NLO…