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arxiv: 1306.2238 · v3 · pith:FSWUPNI4new · submitted 2013-06-10 · ❄️ cond-mat.str-el · cond-mat.mes-hall

Ab initio study of Z₂ topological phases in perovskite (111) (SrTiO₃)₇/(SrIrO₃)₂ and (KTaO₃)₇/(KPtO₃)₂ multilayers

classification ❄️ cond-mat.str-el cond-mat.mes-hall
keywords texttopologicalkptoktaosrirosrtioinitiomultilayers
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Honeycomb structures formed by the growth of perovskite 5d transition metal oxide heteroestructures along the (111) direction in $t_{2g}^5$ configuration can give rise to topological ground states characterized by a topological index $\nu$=1. Using a combination of a tight binding model and ab initio calculations we study the multilayers $(\text{SrTiO}_3)_7/(\text{SrIrO}_3)_2$ and $(\text{KTaO}_3)_7/(\text{KPtO}_3)_2$ as a function of parity asymmetry, on-site interaction and uniaxial strain and determine the nature and evolution of the gap. $(\text{SrTiO}_3)_7/(\text{SrIrO}_3)_2$ is found to be a topological semimetal. $(\text{KTaO}_3)_7/(\text{KPtO}_3)_2$ is a topological Mott insulator that can be driven to a trivial insulating phase by an external electric field.

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