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  • Letter

Optical classification of excitonic phases in molecular functionalized atomically-thin semiconductors

Dominik Christiansen1, Malte Selig1, Mariana Rossi2,3, and Andreas Knorr1

  • 1Institut für Theoretische Physik, Nichtlineare Optik und Quantenelektronik, Technische Universität Berlin, 10623 Berlin, Germany
  • 2Max Planck Institute for the Structure and Dynamics of Matter, 22761 Hamburg, Germany
  • 3Fritz Haber Institute of the Max Planck Society, 14195 Berlin, Germany

Phys. Rev. B 107, L041401 – Published 9 January, 2023

DOI: https://doi.org/10.1103/PhysRevB.107.L041401

Abstract

The excitonic insulator is an elusive electronic phase exhibiting a correlated excitonic ground state. Materials with such a phase are expected to have intriguing properties such as excitonic high-temperature superconductivity. However, compelling evidence on the experimental realization is still missing. Here, we theoretically propose hybrids of two-dimensional semiconductors functionalized by organic molecules as prototypes of excitonic insulators, with the exemplary candidate WS2-F6TCNNQ. This material system exhibits an excitonic insulating phase at room temperature with a ground state formed by a condensate of interlayer excitons. To address an experimentally relevant situation, we calculate the corresponding phase diagram for the important parameters: temperature, gap energy, and dielectric environment. Further, to guide future experimental detection, we show how to optically characterize the different excitonic phases via far-infrared to terahertz spectroscopy valid also for monolayer materials.

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