Orbital magnetization in periodic insulators

被引:310
作者
Thonhauser, T [1 ]
Ceresoli, D
Vanderbilt, D
Resta, R
机构
[1] Rutgers State Univ, Dept Phys & Astron, Piscataway, NJ 08854 USA
[2] SISSA, ISAS, Int Sch Adv Studies, I-34014 Trieste, Italy
[3] INFM, DEMICRITOS, I-34014 Trieste, Italy
[4] Univ Trieste, Dipartimento Fis Teor, I-34014 Trieste, Italy
关键词
D O I
10.1103/PhysRevLett.95.137205
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Working in the Wannier representation, we derive an expression for the orbital magnetization of a periodic insulator. The magnetization is shown to be comprised of two contributions, an obvious one associated with the internal circulation of bulklike Wannier functions in the interior, and an unexpected one arising from net currents carried by Wannier functions near the surface. Each contribution can be expressed as a bulk property in terms of Bloch functions in a gauge-invariant way. Our expression is verified by comparing numerical tight-binding calculations for finite and periodic samples.
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页数:4
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