Structural, electronic, and magnetic properties of vanadium atom-adsorbed MoSe<sub>2</sub> monolayer

Structural, electronic, and magnetic properties of vanadium atom-adsorbed MoSe₂ monolayer

Liu Ping, Qin Zhen-Zhen, Yue Yun-Liang, Zuo Xu^†

(color online) Spin-polarized band structures (a), where up (down) arrow indicates majority (minority) spin, the total DOS (b), and PDOS ((c)–(e)) of 4 × 4 MoSe₂ monolayer with the V adatom. DOS is projected onto the V adatom (e), and its nearest-neighbor Mo (c) and Se (d) atoms. The details of panel (e) around the Fermi energy are shown in panel (f). The Fermi energy is aligned to zero.