Evidence for a direct band gap in the topological insulator Bi sub(2) Se sub(3) from theory and experiment

Using angle-resolved photoelectron spectroscopy and ab initio GW calculations, we unambiguously show that the widely investigated three-dimensional topological insulator Bi sub(2) Se sub(3) has a direct band gap at the [Gamma] point. Experimentally, this is shown by a three-dimensional band mapping...

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Veröffentlicht in:Physical review. B, Condensed matter and materials physics Condensed matter and materials physics, 2013-03, Vol.87 (12)
Hauptverfasser: Nechaev, I A, Hatch, R C, Bianchi, M, Guan, D, Friedrich, C, Aguilera, I, Mi, J L, Iversen, B B, Blugel, S, Hofmann, Ph, Chulkov, E V
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container_issue 12
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container_title Physical review. B, Condensed matter and materials physics
container_volume 87
creator Nechaev, I A
Hatch, R C
Bianchi, M
Guan, D
Friedrich, C
Aguilera, I
Mi, J L
Iversen, B B
Blugel, S
Hofmann, Ph
Chulkov, E V
description Using angle-resolved photoelectron spectroscopy and ab initio GW calculations, we unambiguously show that the widely investigated three-dimensional topological insulator Bi sub(2) Se sub(3) has a direct band gap at the [Gamma] point. Experimentally, this is shown by a three-dimensional band mapping in large fractions of the Brillouin zone. Theoretically, we demonstrate that the valence-band maximum is located at the [Gamma] point only if many-body effects are included in the calculation. Otherwise, it is found in a high-symmetry mirror plane away from the zone center.
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source American Physical Society Journals
subjects Band spectra
Band theory
Condensed matter
Insulators
Mathematical analysis
Planes
Three dimensional
Topology
title Evidence for a direct band gap in the topological insulator Bi sub(2) Se sub(3) from theory and experiment
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