Fully Spin-Polarized Nodal Loop Semimetals in Alkaline Metal Monochalcogenide Monolayers

被引:33
作者
Zhou, Xiaodong [1 ,2 ]
Zhang, Run-Wu [1 ,2 ]
Zhang, Zeying [1 ,2 ]
Ma, Da-Shuai [1 ,2 ]
Feng, Wanxiang [1 ,2 ,3 ,4 ,5 ]
Molcrousov, Yuriy [3 ,4 ,5 ,6 ]
Yao, Yugui [1 ,2 ]
机构
[1] Beijing Inst Technol, Beijing Key Lab Nanophoton Ultrafine Optoelect Sy, Key Lab Adv Optoelect Quantum Architecture & Meas, Beijing 100081, Peoples R China
[2] Beijing Inst Technol, Sch Phys, Beijing 100081, Peoples R China
[3] Forschungszentrum Julich, Peter Grunberg Inst, D-52425 Julich, Germany
[4] Forschungszentrum Julich, Inst Adv Simulat, D-52425 Julich, Germany
[5] JARA, D-52425 Julich, Germany
[6] Johannes Gutenberg Univ Mainz, Inst Phys, D-55099 Mainz, Germany
基金
国家重点研发计划; 中国国家自然科学基金;
关键词
SURFACE HALF-METALLICITY; ROCK-SALT; INTRINSIC FERROMAGNETISM; 1ST-PRINCIPLES; SPINTRONICS; BULK; PREDICTION; COMPOUND; FARADAY; STATE;
D O I
10.1021/acs.jpclett.9b00906
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Topological semimetals in ferromagnetic materials have attracted an enormous amount of attention due to potential applications in spintronics. Using first-principles density functional theory together with an effective lattice model, here we present a new family of topological semimetals with a fully spin-polarized nodal loop in alkaline metal monochalcogenide MX (M = Li, Na, K, Rb, or Cs; X = S, Se, or Te) monolayers. The half-metallic ferromagnetism can be established in MX monolayers, in which one nodal loop formed by two crossing bands with the same spin components is found at the Fermi energy. This nodal loop half-metal survives even when considering the spin-orbit coupling owing to the symmetry protection provided by the M-z mirror plane. The quantum anomalous Hall state and Weyl-like semimetal in this system can be also achieved by rotating the spin from the out-of-plane to the in-plane direction. The MX monolayers hosting rich topological phases thus offer an excellent platform for realizing advanced spintronic concepts.
引用
收藏
页码:3101 / 3108
页数:15
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