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Recently, two-dimensional materials and nanoparticles with robustferromagnetism are even of great interest to explore basic physics in nanoscalespintronics. More importantly, room-temperature magnetic semiconductingmaterials with high Curie temperature is essential for developingnext-generation spintronic and quantum computing devices. Here, we develop atheoretical model on the basis of density functional theory calculations andthe Ruderman-Kittel-Kasuya-Yoshida theory to predict the thermal stability oftwo-dimensional magnetic materials. Compared with other rare-earth (dysprosium(Dy) and erbium (Er)) and 3d (copper (Cu)) impurities, holmium-doped (Ho-doped)single-layer 1H-MoS2 is proposed as promising semiconductor with robustmagnetism. The calculations at the level of hybrid HSE06 functional predict aCurie temperature much higher than room temperature. Ho-doped MoS2 sheetpossesses fully spin-polarized valence and conduction bands, which is aprerequisite for flexible spintronic applications.

A Primary Exploration to Quasi-Two-Dimensional Rare-Earth Ferromagnetic  Particles: Holmium-Doped MoS2 Sheet as Room-Temperature Magnetic  Semiconductor