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arxiv: 2310.19186 · v1 · pith:BVQKZ4HZnew · submitted 2023-10-29 · ❄️ cond-mat.str-el · cond-mat.mtrl-sci

Strain control of band topology and surface states in antiferromagnetic EuCd₂As₂

classification ❄️ cond-mat.str-el cond-mat.mtrl-sci
keywords statessurfacestrainaxionmagneticphaseshearantiferromagnetic
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Topological semimetal antiferromagnets provide a rich source of exotic topological states which can be controlled by manipulating the orientation of the N\'eel vector, or by modulating the lattice parameters through strain. We investigate via ${ab\ initio}$ density functional theory calculations, the effects of shear strain on the bulk and surface states n two antiferromagnetic EuCd$_2$As$_2$ phases with out-of-plane and in-plane spin configurations. When magnetic moments are along the $\textit{c}$-axis, a $3\%$ longitudinal or diagonal shear strain can tune the Dirac semimetal phase to an axion insulator phase, characterized by the parity-based invariant $\eta_{4I} = 2$. For an in-plane magnetic order, the axion insulator phase remains robust under all shear strains. We further find that for both magnetic orders, the bulk gap increases and a surface gap opens on the (001) surface up to 16 meV. Because of a nonzero $\eta_{4I}$ index and gapped states on the (001) surface, hinge modes are expected to happen on the side surface states between those gapped surface states. This result can provide a valuable insight in the realization of the long-sought axion states.

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