46 citations · 132 across the 11 of their papers we have counts for
11 papers
Theoretical investigation on the ferromagnetic two-dimensional scandium monochloride sheet that has a high Curie temperature and could be exfoliated from a known material
Guo Wang, Xinyu Wang, Yi Liao
A two-dimensional scandium monochloride sheet was investigated by using density functional theory. It could be exfoliated from a known bulk material with a cleavage energy slightly…
Theoretical prediction of two-dimensional CrOF sheet as a ferromagnetic semiconductor or a half-metal
Tiantian Xiao, Guo Wang, Yi Liao
Two-dimensional chromium oxide fluoride CrOF sheet was studied based on density functional theory. The investigation indicates that the CrOF sheet is an intrinsic ferromagnetic sem…
Theoretical prediction of a two-dimensional intrinsic double-metal ferromagnetic semiconductor MnCoO4
Tiantian Xiao, Guo Wang, Yi Liao
A two-dimensional double-metal oxide MnCoO4 was predicted to be an intrinsic ferromagnetic semiconductor by using density functional theory. The low cleavage energy 0.36 Jm-2, whic…
Theoretical Prediction of the Robust Intrinsic Half-Metallicity in Ni2N MXene with Different Types of Surface Terminations
Guo Wang, Yi Liao
Bare and surface-passivated Fe2N, Co2N, and Ni2N MXene were investigated by using density functional theory. Fe2N(OH)2, Fe2NO2, Co2NO2, Ni2NF2, Ni2N(OH)2, and Ni2NO2 are intrinsic…
Theoretical prediction of the half-metallicity in one-dimensional Cr2NO2 nanoribbons
Guo Wang, Yi Liao
One-dimensional Cr2NO2 nanoribbons cutting from the oxygen-passivated Cr2NO2 MXene are investigated by using density functional theory. The wide nanoribbons have ferromagnetic grou…
A Theoretical Prediction on the Intrinsic Half-Metallicity in the Surface-Oxygen-Passivated Cr2N MXene
Guo Wang
Two-dimensional Cr2N MXene as well as the surface-passivated Cr2NF2, Cr2N(OH)2 and Cr2NO2 are investigated by using density functional theory. The Cr2N is an anti-ferromagnetic met…