Defect-engineered room-temperature ferromagnetism in quasi-two-dimensional nitrided CoTa2O6

被引:3
|
作者
Ma, Yalin [1 ]
Zhao, Shuang [1 ]
Zhou, Xiao [1 ]
Zeng, Yijie [2 ,3 ]
Song, Haili [1 ]
Wang, Jing [1 ]
Li, Guangqin [1 ]
Frank, Corey E. [4 ]
Ma, Lu [5 ]
Croft, Mark [6 ]
Wang, Yonggang [7 ]
Greenblatt, Martha [4 ]
Yao, Dao-Xin [2 ]
Li, Man-Rong [1 ]
机构
[1] Sun Yat Sen Univ, Sch Chem, Minist Educ, Key Lab Bioinorgan & Synthet Chem, Guangzhou 510275, Peoples R China
[2] Sun Yat Sen Univ, Sch Phys, State Key Lab Optoelect Mat & Technol, Guangzhou 510275, Peoples R China
[3] Hangzhou Dianzi Univ, Coll Sci, Hangzhou 310018, Peoples R China
[4] Rutgers State Univ, Dept Chem & Chem Biol, 123 Bevier Rd, Piscataway, NJ 08854 USA
[5] Brookhaven Natl Lab, Natl Synchrotron Light Source II, Bldg 74,POB 5000, Upton, NY 11973 USA
[6] Rutgers State Univ, Dept Phys & Astron, 136 Frelinghuysen Rd, Piscataway, NJ 08854 USA
[7] Ctr High Pressure Sci & Technol Adv Res HPSTAR, Beijing 100094, Peoples R China
基金
美国国家科学基金会;
关键词
DOUBLE PEROVSKITE; OXIDE; SEMICONDUCTORS; CONDUCTIVITY; OXYNITRIDES; MAGNETISM; CRYSTAL; DENSITY; TA3N5; TAON;
D O I
10.1103/PhysRevB.104.014421
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Thermal ammonolysis of quasi-two-dimensional (quasi-2D) CoTa2O6 yields the O2-/N3- and anionic vacancy-ordered Co2+Ta25+O6-xN2x/3 square(x/3) (x <= 0.15), which exhibits a transition from antiferromagnetism to defect-engineered above-room-temperature ferromagnetism. First-principles calculations reveal that the origin of ferromagnetism is a particular CoO5N configuration with N located at Wyckoff position 8 j, which breaks mirror symmetry about the ab plane. A pressure-induced electronic phase transition is also predicted at similar to 24.5 GPa, accompanied by insulator-to-metal transition and magnetic moment vanishing.
引用
收藏
页数:9
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