734 citations · 1.1k across the 11 of their papers we have counts for
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physics.comp-ph2015★ 160 cited
Atomically thin binary V-V compound semiconductor: a first-principles study
Weiyang Yu, Zhili Zhu, Chun-Yao Niu +2
Searching the novel 2D semiconductor is crucial to develop the next-generation low-dimensional electronic device. Using first-principles calculations, we propose a class of unexplo…
cond-mat.mtrl-sci2015★ 734 cited
Robust Intrinsic Ferromagnetism and Half Semiconductivity in Stable Two-Dimensional Single-Layer Chromium Trihalides
Wei-Bing Zhang, Qian Qu, Peng Zhu +1
Two-dimensional (2D) intrinsic ferromagnetic (FM) semiconductors are crucial to develop low-dimensional spintronic devices. Using density functional theory, we show that single-lay…
cond-mat.mtrl-sci2015★ 136 cited
The electronic structure and elastic property of monolayer and bilayer transition metal dichalcogenides MX (M=Mo,W;X=O,S,Se,Te): A comparative first-principles study
Fan Zeng, Wei-Bing Zhang, Bi-Yu Tang
First-principle calculations with different exchange-correlation functionals, including LDA, PBE and vdW-DF functional in form of optB88-vdW, have been performed to investigate the…