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arxiv: 1803.05622 · v3 · pith:5NCBGMX5new · submitted 2018-03-15 · ❄️ cond-mat.str-el · cond-mat.mtrl-sci

Strong Coupling Nature of the Excitonic Insulator State in Ta₂NiSe₅

classification ❄️ cond-mat.str-el cond-mat.mtrl-sci
keywords statebandcalculationexcitonsinsulatornisepreformedrather
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We analyze the measured optical conductivity spectra using the density-functional-theory-based electronic structure calculation and density-matrix renormalization group calculation of an effective model. We show that, in contrast to a conventional description, the Bose-Einstein condensation of preformed excitons occurs in Ta$_2$NiSe$_5$, despite the fact that a noninteracting band structure is a band-overlap semimetal rather than a small band-gap semiconductor. The system above the transition temperature is therefore not a semimetal, but rather a state of preformed excitons with a finite band gap. A novel insulator state caused by the strong electron-hole attraction is thus established in a real material.

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