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1. Spin-resolved topology and partial axion angles in three-dimensional insulators

   https://doi.org/10.1038/s41467-024-44762-w  

   Lin, Kuan-Sen ; Palumbo, Giandomenico ; Guo, Zhaopeng ; Hwang, Yoonseok ; Blackburn, Jeremy ; Shoemaker, Daniel P. ; Mahmood, Fahad ; Wang, Zhijun ; Fiete, Gregory A. ; Wieder, Benjamin J. ; et al ( January 2024 , Nature Communications)

   Symmetry-protected topological crystalline insulators (TCIs) have primarily been characterized by their gapless boundary states. However, in time-reversal- ($${{{{{{{\mathcal{T}}}}}}}}$$$T$-) invariant (helical) 3D TCIs—termed higher-order TCIs (HOTIs)—the boundary signatures can manifest as a sample-dependent network of 1D hinge states. We here introduce nested spin-resolved Wilson loops and layer constructions as tools to characterize the intrinsic bulk topological properties of spinful 3D insulators. We discover that helical HOTIs realize one of three spin-resolved phases with distinct responses that are quantitatively robust to large deformations of the bulk spin-orbital texture: 3D quantum spin Hall insulators (QSHIs), “spin-Weyl” semimetals, and$${{{{{{{\mathcal{T}}}}}}}}$$$T$-doubled axion insulator (T-DAXI) states with nontrivial partial axion angles indicative of a 3D spin-magnetoelectric bulk response and half-quantized 2D TI surface states originating from a partial parity anomaly. Using ab-initio calculations, we demonstrate thatβ-MoTe₂realizes a spin-Weyl state and thatα-BiBr hosts both 3D QSHI and T-DAXI regimes.

    

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2. Electrically and magnetically switchable nonlinear photocurrent in РТ-symmetric magnetic topological quantum materials

   https://doi.org/10.1038/s41524-020-00462-9  

   Wang, Hua ; Qian, Xiaofeng ( December 2020 , npj Computational Materials)

   Nonlinear photocurrent in time-reversal invariant noncentrosymmetric systems such as ferroelectric semimetals sparked tremendous interest of utilizing nonlinear optics to characterize condensed matter with exotic phases. Here we provide a microscopic theory of two types of second-order nonlinear direct photocurrents, magnetic shift photocurrent (MSC) and magnetic injection photocurrent (MIC), as the counterparts of normal shift current (NSC) and normal injection current (NIC) in time-reversal symmetry and inversion symmetry broken systems. We show that MSC is mainly governed by shift vector and interband Berry curvature, and MIC is dominated by absorption strength and asymmetry of the group velocity difference at time-reversed ±kpoints. Taking$${\cal{P}}{\cal{T}}$$$PT$-symmetric magnetic topological quantum material bilayer antiferromagnetic (AFM) MnBi₂Te₄as an example, we predict the presence of large MIC in the terahertz (THz) frequency regime which can be switched between two AFM states with time-reversed spin orderings upon magnetic transition. In addition, external electric field breaks$${\cal{P}}{\cal{T}}$$$PT$symmetry and enables large NSC response in bilayer AFM MnBi₂Te₄, which can be switched by external electric field. Remarkably, both MIC and NSC are highly tunable under varying electric field due to the field-induced large Rashba and Zeeman splitting, resulting in large nonlinear photocurrent response down to a few THz regime, suggesting bilayer AFM-zMnBi₂Te₄as a tunable platform with rich THz and magneto-optoelectronic applications. Our results reveal that nonlinear photocurrent responses governed by NSC, NIC, MSC, and MIC provide a powerful tool for deciphering magnetic structures and interactions which could be particularly fruitful for probing and understanding magnetic topological quantum materials.

    

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3. Polar and phase domain walls with conducting interfacial states in a Weyl semimetal MoTe2

   https://doi.org/10.1038/s41467-019-11949-5  

   Huang, Fei-Ting ; Joon Lim, Seong ; Singh, Sobhit ; Kim, Jinwoong ; Zhang, Lunyong ; Kim, Jae-Wook ; Chu, Ming-Wen ; Rabe, Karin M. ; Vanderbilt, David ; Cheong, Sang-Wook ( September 2019 , Nature Communications)

   Much of the dramatic growth in research on topological materials has focused on topologically protected surface states. While the domain walls of topological materials such as Weyl semimetals with broken inversion or time-reversal symmetry can provide a hunting ground for exploring topological interfacial states, such investigations have received little attention to date. Here, utilizing in-situ cryogenic transmission electron microscopy combined with first-principles calculations, we discover intriguing domain-wall structures in MoTe₂, both between polar variants of the low-temperature(T) Weyl phase, and between this and the high-Thigher-order topological phase. We demonstrate how polar domain walls can be manipulated with electron beams and show that phase domain walls tend to form superlattice-like structures along thecaxis. Scanning tunneling microscopy indicates a possible signature of a conducting hinge state at phase domain walls. Our results open avenues for investigating topological interfacial states and unveiling multifunctional aspects of domain walls in topological materials.

    

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4. Chiral and counter-propagating Majorana fermions in a p-wave superconductor

   https://doi.org/10.1088/1367-2630/ab5cad  

   Hu, Haiping ; Satija, Indubala I. ; Zhao, Erhai ( December 2019 , New Journal of Physics)

   Chiral and helical Majorana fermions are two archetypal edge excitations in two-dimensional topological superconductors. They emerge from systems of different Altland–Zirnbauer symmetries and characterized by$\mathbb{Z}$and${\mathbb{Z}}_2$topological invariants respectively. It seems improbable to tune a pair of co-propagating chiral edge modes to counter-propagate in a single system without symmetry breaking. Here, we explore the peculiar behaviors of Majorana edge modes in topological superconductors with an additional ‘mirror’ symmetry which changes the bulk topological invariant to$\mathbb{Z}\oplus \mathbb{Z}$type. A theoretical toy model describing the proximity structure of a Chern insulator and ap_x-wave superconductor is proposed and solved analytically to illustrate a direct transition between two topologically nontrivial phases. The weak pairing phase has two chiral Majorana edge modes, while the strong pairing phase is characterized by mirror-graded Chern number and hosts a pair of counter-propagating Majorana fermions protected by the mirror symmetry. The edge theory is worked out in detail, and implications to braiding of Majorana fermions are discussed.

    

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5. Strong and fragile topological Dirac semimetals with higher-order Fermi arcs

   https://doi.org/10.1038/s41467-020-14443-5  

   Wieder, Benjamin J. ; Wang, Zhijun ; Cano, Jennifer ; Dai, Xi ; Schoop, Leslie M. ; Bradlyn, Barry ; Bernevig, B. Andrei ( January 2020 , Nature Communications)

   Dirac and Weyl semimetals both exhibit arc-like surface states. However, whereas the surface Fermi arcs in Weyl semimetals are topological consequences of the Weyl points themselves, the surface Fermi arcs in Dirac semimetals are not directly related to the bulk Dirac points, raising the question of whether there exists a topological bulk-boundary correspondence for Dirac semimetals. In this work, we discover that strong and fragile topological Dirac semimetals exhibit one-dimensional (1D) higher-order hinge Fermi arcs (HOFAs) as universal, direct consequences of their bulk 3D Dirac points. To predict HOFAs coexisting with topological surface states in solid-state Dirac semimetals, we introduce and layer a spinful model of ans–d-hybridized quadrupole insulator (QI). We develop a rigorous nested Jackiw–Rebbi formulation of QIs and HOFA states. Employing ab initio calculations, we demonstrate HOFAs in both the room- (α) and intermediate-temperature (α″) phases of Cd₃As₂, KMgBi, and rutile-structure ($$ \beta ^{\prime} $$${\beta }^{\prime }$-) PtO₂.

    

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