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Large Bandgap Observed on the Surfaces of EuZn2As2 Single Crystals

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arxiv 2408.08858 v1 pith:DHJ3BTTG submitted 2024-08-16 cond-mat.mtrl-sci

Large Bandgap Observed on the Surfaces of EuZn2As2 Single Crystals

classification cond-mat.mtrl-sci
keywords bandgapeuzn2as2calculationscrystalsdensityeum2as2largelocal
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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EuM2As2 (M = Zn, Cd, In, Sn etc.) is an excellent material system for studying topological properties, which can be easily tuned by magnetism involved. Theoretical calculations predict gapped and flat bands in EuZn2As2 but gapless structure in EuCd2As2. In this work, low-temperature (77 K) cleaved EuZn2As2 crystals are studied using scanning tunneling microscopy/spectroscopy (STM/S) and density functional theory (DFT) calculations. Defects-induced local density of states (LDOS) modification with a triangular shape helps identify the surface terminations: Eu versus AsZn surface. While large bandgaps (~1.5 eV at 77 K) are observed on both pristine surfaces, the bandgap width is found to be very sensitive to local heterogeneity, such as defects and step edges, with the tendency of reduction. Combining experimental data with DFT simulations, we conclude that the modified bandgap in the heterogeneous area arises from Zn vacancies and/or substitution by As atoms. Our investigation offers important information for reevaluating the electron topology of the EuM2As2 family.

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