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cond-mat.mtrl-sci2019
Insulator -- half metallic transition by the tetragonal distortion: A first-principles study of strain-induced perovskite RbMnF
N. Tsogbadrakh, N. Tuvjargal, Chun Feng +2
From the spin polarized density functional total energy calculations, we shown that the ground state of cubic perovskite RbMnF is an antiferromagnetic (AFM) insulator due to th…
cond-mat.mtrl-sci2018
Tunable Magnetism of Transition Metal Nanostructures by Hydrogenated Graphene
T. Tsevelmaa, Chunfeng, D. Odkhuu +2
Controlling magnetism of transition metal atoms by pairing with electronic states of graphene is intriguing. Herein, through first - principle computation we explore the possib…