Article Dans Une Revue Physical Review B Année : 2025

Mexican hat–like valence band dispersion and quantum confinement in rhombohedral ferroelectric α−In2Se3

Geoffroy Kremer
François Bertran

Résumé

Two-dimensional ferroelectric materials offer a large variety of electronic properties depending on chemical composition, number of layers, and stacking order. Among them, α-In 2 Se 3 has attracted much attention due to the promise of outstanding electronic properties, attractive quantum physics, in-and out-of-plane ferroelectricity, and high photoresponse. Precise experimental determination of the electronic structure of rhombohedral (3R) α-In 2 Se 3 is needed for a better understanding of potential properties and device applications. Here, combining angle-resolved photoemission spectroscopy and density-functional theory calculations, we demonstrate that 3R α-In 2 Se 3 phase exhibits a robust inversion of the valence band parabolicity at the point forming a bow-shaped dispersion with a depth of 140 ± 10 meV between the valence band maximum along the K direction of the Brillouin zone. Moreover, we find an indirect band gap of about 1.25 eV, as well as a highly electron doping of approximately 5×10 12 electrons per cm 2 at the surface. This leads to surface band bending and the formation of a prominent electron accumulation layer. These findings allow a deeper understanding of the rhombohedral α-In 2 Se 3 electronic properties underlying the potential of III-VI semiconductors for electronic and photonic technologies.

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hal-05318490 , version 1 (16-10-2025)

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Geoffroy Kremer, Aymen Mahmoudi, Meryem Bouaziz, Mehrdad Rahimi, François Bertran, et al.. Mexican hat–like valence band dispersion and quantum confinement in rhombohedral ferroelectric α−In2Se3. Physical Review B, 2025, 112, pp.155418. ⟨10.1103/n2l9-7vjl⟩. ⟨hal-05318490⟩
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