Magnetic impurity affected by spin-orbit coupling: Behavior near a topological phase transition

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© 2013 American Physical Society (APS). This is the accepted version of the following article: Hu, F. M. & Wehling, T. O. & Gubernatis, J. E. & Frauenheim, Thomas & Nieminen, Risto M. 2013. Magnetic impurity affected by spin-orbit coupling: Behavior near a topological phase transition. Physical Review B. Volume 88, Issue 4. 045106/1-6. 1550-235X (electronic). DOI: 10.1103/physrevb.88.045106, which has been published in final form at http://journals.aps.org/prb/abstract/10.1103/PhysRevB.88.045106.
Final published version

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Journal Title

Journal ISSN

Volume Title

School of Science | A1 Alkuperäisartikkeli tieteellisessä aikakauslehdessä

Date

2013

Major/Subject

Mcode

Degree programme

Language

en

Pages

045106/1-6

Series

Physical Review B, Volume 88, Issue 4

Abstract

We investigate the effect of spin-orbit coupling on the behavior of a magnetic impurity at the edge of a zigzag graphene ribbon by means of quantum Monte Carlo simulations. A peculiar interplay of Kane-Mele type spin-orbit and impurity-host coupling is found to greatly affect properties for the local moment. The local characters of the impurity are mainly dominated by the local density of states at the edge, such as double occupancy, magnetic moment, and spin susceptibilities. The special helical nature of the topological insulator on the boundary is found to affect nonlocal quantities, such as the two-particle and spin-spin correlation functions linking electrons on the impurity with those in the conduction band; in particular, due to the spin-orbit coupling, the symmetry of the spin rotation in the Kondo cloud around the impurity is partly broken.

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Keywords

spin-orbit coupling, magnetic impurity, Monte Carlo simulations

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Citation

Hu, F. M. & Wehling, T. O. & Gubernatis, J. E. & Frauenheim, Thomas & Nieminen, Risto M. 2013. Magnetic impurity affected by spin-orbit coupling: Behavior near a topological phase transition. Physical Review B. Volume 88, Issue 4. 045106/1-6. 1550-235X (electronic). DOI: 10.1103/physrevb.88.045106.