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Nonsymmoprhic symmetries, such as screw rotations or glide reflections, can enforce band crossings within high-symmetry lines or planes of the Brillouin zone. When these band degeneracies are close to the Fermi energy, they can give rise to a number of unusual phenomena: e.g., anomalous magnetoelectric responses, transverse Hall currents, and exotic surface states. In this paper, we present a comprehensive classification of such nonsymmorphic band crossings in trigonal materials with strong spin-orbit coupling. We find that in trigonal systems there are two different types of nonsymmorphic band degeneracies: (i) Weyl points protected by screw rotations with an accordion-like dispersion, and (ii) Weyl nodal lines protected by glide reflections. We report a number of existing materials, where these band crossings are realized near the Fermi energy. This includes Cu2SrSnS4 and elemental tellurium (Te), which exhibit accordion Weyl points; and the tellurium-silicon clathrate Te16Si38, which shows Weyl nodal lines. The ab-initio band structures and surface states of these materials are studied in detail, and implications for experiments are briefly discussed., Comment: 13 pages, 11 figures, 4 tables

Topological semimetals exhibit band crossings near the Fermi energy, which are protected by the nontrivial topological character of the wave functions. In many cases, these topological band degeneracies give rise to exotic surface states and unusual magneto-transport properties. In this paper, we present a complete classification of all possible nonsymmorphic band degeneracies in hexagonal materials with strong spin-orbit coupling. This includes (i) band crossings protected by conventional nonsymmorphic symmetries, whose partial translation is within the invariant space of the mirror/rotation symmetry; and (ii) band crossings protected by off-centered mirror/rotation symmetries, whose partial translation is orthogonal to the invariant space. Our analysis is based on (i) the algebraic relations obeyed by the symmetry operators and (ii) the compatibility relations between irreducible representations at different high-symmetry points of the Brillouin zone. We identify a number of existing materials where these nonsymmorphic nodal lines are realized. Based on these example materials, we examine the surface states that are associated with the topological band crossings. Implications for experiments and device applications are briefly discussed., Comment: 16 pages, 15 figures, 4 tables

In an ordinary three-dimensional metal the Fermi surface forms a two-dimensional closed sheet separating the filled from the empty states. Topological semimetals, on the other hand, can exhibit protected one-dimensional Fermi lines or zero-dimensional Fermi points, which arise due to an intricate interplay between symmetry and topology of the electronic wavefunctions. Here, we study how reflection symmetry, time-reversal symmetry, SU(2) spin-rotation symmetry, and inversion symmetry lead to the topological protection of line nodes in three-dimensional semi-metals. We obtain the crystalline invariants that guarantee the stability of the line nodes in the bulk and show that a quantized Berry phase leads to the appearance of protected surfaces states with a nearly flat dispersion. By deriving a relation between the crystalline invariants and the Berry phase, we establish a direct connection between the stability of the line nodes and the topological surface states. As a representative example of a topological semimetal with line nodes, we consider Ca$_3$P$_2$ and discuss the topological properties of its Fermi line in terms of a low-energy effective theory and a tight-binding model, derived from ab initio DFT calculations. Due to the bulk-boundary correspondence, Ca$_3$P$_2$ displays nearly dispersionless surface states, which take the shape of a drumhead. These surface states could potentially give rise to novel topological response phenomena and provide an avenue for exotic correlation physics at the surface., Comment: 16 pages, 8 figure. v2 references updated

We investigate states on the surface of strong and weak topological insulators and superconductors that have been gapped by a symmetry breaking term. The surface of a strong 3D topological insulator gapped by a magnetic material is well known to possess a half quantum Hall effect. Furthermore, it has been known that the surface of a weak 3D topological insulator gapped by a charge density wave exhibits a half quantum spin Hall effect. To generalize these results to all Altland-Zirnbauer symmetry classes of topological insulators and superconductors, we reproduce the classification table for the ten symmetry classes by using the representation theory of Clifford algebras and construct minimal-size Dirac Hamiltonians. We find that if the surface dimension and symmetry class possesses a $\mathbb{Z}$ or $\mathbb{Z}_2$ topological invariant, then the resulting surface state with a gapped symmetry breaking term may have a nontrivial topological phase., Comment: 19 pages

While the topological classification of insulators, semimetals, and superconductors in terms of nonspatial symmetries is well understood, less is known about topological states protected by crystalline symmetries, such as mirror reflections and rotations. In this work, we systematically classify topological semimetals and nodal superconductors that are protected, not only by nonspatial (i.e., global) symmetries, but also by a crystal reflection symmetry. We find that the classification crucially depends on (i) the codimension of the Fermi surface (nodal line or point) of the semimetal (superconductor), (ii) whether the mirror symmetry commutes or anticommutes with the nonspatial symmetries and (iii) how the Fermi surfaces (nodal lines or points) transform under the mirror reflection and nonspatial symmetries. The classification is derived by examining all possible symmetry-allowed mass terms that can be added to the Bloch or Bogoliubov-de Gennes Hamiltonian in a given symmetry class and by explicitly deriving topological invariants. We discuss several examples of reflection symmetry protected topological semimetals and nodal superconductors, including topological crystalline semimetals with mirror $\mathbb{Z}_2$ numbers and topological crystalline nodal superconductors with mirror winding numbers., Comment: 27 pages, 6 figures, 5 tables. Introduction video: http://www.youtube.com/watch?v=9_0TBJ7pYpw