57 citations · 154 across the 5 of their papers we have counts for
5 papers
Chemically induced graphene to diamond transition: a DFT study
Changcheng Ke, Dong Fan, Chengke Chen +4
The conversion of graphene into diamond is a new way for preparing ultrathin diamond film without pressure. Herein, we investigated the transformation mechanism of surface-hydrogen…
Two-dimensional Boron Monosulfides: Semiconducting and Metallic Polymorphs
Dong Fan, Chuncheng Yang, Shaohua Lu +1
The typical two-dimensional semiconductors, group \uppercase\expandafter{\romannumeral3A} chalcogenides, have garnered tremendous interest for their outstanding electronic, mechani…
Two-dimensional Iron Monocarbide with Planar Hypercoordinate Iron and Carbon
Dong Fan, Shaohua Lu, Xiaojun Hu
We report on the theoretical discovery of Iron monocarbide binary sheets stabilized at two-dimensional confined space, which we call tetragonal-FeC (t-FeC) and orthorhombic-FeC (o-…
D-carbon: A New sp3 Carbon Allotrope
Dong Fan, Shaohua Lu, Xiaojun Hu
We have investigated the structural, mechanical and electronic properties of D-carbon by ab initio calculations, a new phase of crystalline sp3 carbon (pace group D2h5, Pmma-orthor…
Novel bonding patterns and optoelectronic properties of the two-dimensional SiC monolayers
Dong Fan, Shaohua Lu, Yundong Guo +1
The search of new two-dimensional (2D) materials with novel optical and electronic properties is always desirable for material development. Here, we report a comprehensive theoreti…