1. Surface-vacancy-induced metallicity and layer-dependent magnetic anisotropy energy in Cr2Ge2Te6
- Author
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Jiaqi Pan, Xiaoping Wu, Xin Liu, Tingyu Zhao, Changsheng Song, Jiqing Wang, Jingjing Wang, and Chaorong Li
- Subjects
010302 applied physics ,Materials science ,Spintronics ,Condensed matter physics ,Band gap ,Magnetism ,General Physics and Astronomy ,02 engineering and technology ,021001 nanoscience & nanotechnology ,01 natural sciences ,symbols.namesake ,Magnetization ,Magnetic anisotropy ,Ferromagnetism ,Vacancy defect ,0103 physical sciences ,symbols ,van der Waals force ,0210 nano-technology - Abstract
Two-dimensional van der Waals materials have attracted considerable attention because of their promising applications in spintronic devices. This paper reports on first-principles calculations of the electronic structure and ferromagnetism of Cr 2 Ge 2 Te 6 with surface Ge vacancies. These vacancies are found to remove the bandgap and induce metallicity in Cr 2 Ge 2 Te 6 that persists with decreasing Ge-vacancy concentration. Meanwhile, the Ge vacancies cause an unexpected sharp increase in the magnetic anisotropy energy compared to that of perfect Cr 2 Ge 2 Te 6. More importantly, how thickness affects the magnetic anisotropy energy is studied to show that the latter oscillates upon increasing the number of layers, thereby switching between the out-of-plane and in-plane magnetization directions. The present findings regarding a surface-vacancy-tuned bandgap and magnetism controlled by the layer thickness in a two-dimensional van der Waals magnet could lead to potential applications in next-generation magnetic memory storage, sensors, and spintronics.Two-dimensional van der Waals materials have attracted considerable attention because of their promising applications in spintronic devices. This paper reports on first-principles calculations of the electronic structure and ferromagnetism of Cr 2 Ge 2 Te 6 with surface Ge vacancies. These vacancies are found to remove the bandgap and induce metallicity in Cr 2 Ge 2 Te 6 that persists with decreasing Ge-vacancy concentration. Meanwhile, the Ge vacancies cause an unexpected sharp increase in the magnetic anisotropy energy compared to that of perfect Cr 2 Ge 2 Te 6. More importantly, how thickness affects the magnetic anisotropy energy is studied to show that the latter oscillates upon increasing the number of layers, thereby switching between the out-of-plane and in-plane magnetization directions. The present findings regarding a surface-vacancy-tuned bandgap and magnetism controlled by the layer thickness in a two-dimensional van der Waals magnet could lead to potential application...
- Published
- 2019