298 citations · 1.3k across the 46 of their papers we have counts for
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Bridging Crystal Structure and Material Properties via Bond-Centric Descriptors
Jian-Feng Zhang, Ze-Feng Gao, Xiao-Qi Han +7
Although chemical bonding is the fundamental mechanistic bridge connecting atomic structure to macroscopic material properties, current data-driven materials science largely treats…
Prediction of two-dimensional ferromagnetic VO layers in the hexagonal and tetragonal phases
Lihui Han, Lujia Tian, Bing-Xin Liu +4
Ferromagnetism in the two-dimensional materials is of great significance and has become an emerging topic. The ferromagnetic VS and VSe monolayers have been experimentally…
Two-dimensional Kagome-in-Honeycomb materials (MN)C (M=Pt or Mn)
Jingping Dong, Miao Gao, Xun-Wang Yan +2
We propose two novel two-dimensional (2D) topological materials, (PtN)C and (MnN)C, with a special geometry that we named as kagome-in-honeycomb (KIH)…
High-temperature ferromagnetism and strong -conjugation feature in two-dimensional manganese tetranitride
Ming Yan, Z. Y. Xie, Miao Gao
Two-dimensional (2D) magnetic materials have attracted tremendous research interest because of the promising application in the next-generation microelectronic devices. Here, by th…
Two-dimensional anisotropic Dirac materials PtN4C2 and Pt2N8C6 with quantum spin and valley Hall effects
Jingping Dong, Chuhan Wang, Xinlei Zhao +4
We propose two novel two-dimensional topological Dirac materials, planar PtN4C2 and Pt2N8C6, which exhibit graphene-like electronic structures with linearly dispersive Dirac-cone s…
Two-dimensional binary transition metal nitride N ( = V, Cr, Mn, Fe, Co) with a graphene-like structure and strong magnetic properties
Shuo Zhang, Panjun Feng, Dapeng Liu +5
Binary transition metal nitride with a graphene-like structure and strong magnetic properties is rare. Based on the first-principles calculations, we design two kinds of N (…