Giant linearly-polarized photogalvanic effect and second harmonic generation in two-dimensional axion insulators (2003.01576v1)

Abstract: The second-order nonlinear optical (NLO) processes, such as the photogalvanic effect and second-order harmonic generation (SHG), play crucial roles in probing and controlling light-matter interactions for energy and device applications. To date, most studies of second-order NLO processes focus on materials with broken spatial inversion symmetry, such as proper ferroelectrics and noncentrosymmetric Weyl semimetals. Nevertheless, inversion symmetry of Shubnikov groups can be broken via spin-ordering in centrosymmetric crystals. Unfortunately, these materials are less common, and their NLO responses are usually weak. Combining quantum perturbation theory and first-principles simulations, we predict a giant injection-current photogalvanic effect and SHG in a family of emerging axion insulators, the even septuple layers of MnBi2Te4 (MBT) materials that exhibit the zero-plateau quantum anomalous Hall (QAH) effect. Their amplitudes of injection current and SHG are about two orders of magnitude larger than those of widely used ferroelectrics, such as BiFeO3 and LiNbO3. Moreover, unlike the usual injection current observed under circularly-polarized light, the injection photocurrent of MBTs only emerges under linearly polarized light, making it convenient for device applications. These unique characters are from a combination effect of parity-time symmetry, three-fold rotation symmetry, and significant spin-orbit coupling. These enhanced NLO effects are valuable for characterizing subtle topological orders in QAH systems and also shed light on novel infrared photo-detector and photovoltaic applications based on magnetic topological materials.