activity
19962024
most citedDesign of Lead-Free Inorganic Halide Perovskites for Solar Cells via Cation-Transmutation

1k citations · 6.9k across the 68 of their papers we have counts for

collaborators

68 papers

cond-mat.mtrl-sci2024★ 20 cited

Is p-type doping in TeO2 feasible?

Zewen Xiao, Chen Qiu, Su-Huai Wei +1

Wide-bandgap two-dimensional (2D) beta-TeO2 has been reported as a high-mobility p-type transparent semiconductor (Nat. Electron. 2021, 4, 277-283), attracting significant attentio…

cond-mat.supr-con2023

Theoretical understanding of correlation between magnetic phase transition and the superconducting dome in high-Tc cuprates

Chen Zhang, Cai-Xin Zhang, Su-Huai Wei +2

Many issues concerning the origin of high-temperature superconductivity (HTS) are still under debate. For example, how the magnetic ordering varies with doping and its relationship…

cond-mat.mtrl-sci2023★ 1 cited

Graph deep learning accelerated efficient crystal structure search and feature extraction

Chuannan Li, Hanpu Liang, Xie Zhang +2

Structural search and feature extraction are a central subject in modern materials design, the efficiency of which is currently limited, but can be potentially boosted by machine l…

physics.comp-ph2022★ 60 cited

Designing Ultra-Flat Bands in Twisted Bilayer Materials at Large Twist Angles without specific degree

Shengdan Tao, Xuanlin Zhang, Jiaojiao Zhu +4

Inter-twisted bilayers of two-dimensional (2D) materials can host low-energy flat bands, which offer opportunity to investigate many intriguing physics associated with strong elect…

cond-mat.mtrl-sci2022★ 67 cited

Effective Lifetime of Non-Equilibrium Carriers in Semiconductors from Non-Adiabatic Molecular Dynamics Simulations

Shanshan Wang, Menglin Huang, Yu-Ning Wu +6

The lifetime of non-equilibrium electrons and holes in semiconductors is crucial for solar cell and optoelectronic applications. Non-adiabatic molecular dynamics (NAMD) simulations…

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…