Topological Weyl Semimetals Research Articles

Topological Materials: Weyl Semimetals

Topological insulators and topological semimetals are both new classes of quantum materials, which are characterized by surface states induced by the topology of the bulk band structure. Topological Dirac or Weyl semimetals show linear dispersion around nodes, termed the Dirac or Weyl points, as the three-dimensional analog of graphene. We review the basic concepts and compare these topological states of matter from the materials perspective with a special focus on Weyl semimetals. The TaAs family is the ideal materials class to introduce the signatures of Weyl points in a pedagogical way, from Fermi arcs to the chiral magnetotransport properties, followed by hunting for the type-II Weyl semimetals in WTe2, MoTe2, and related compounds. Many materials are members of big families, and topological properties can be tuned. As one example, we introduce the multifunctional topological materials, Heusler compounds, in which both topological insulators and magnetic Weyl semimetals can be found. Instead of a comprehensive review, this article is expected to serve as a helpful introduction and summary by taking a snapshot of the quickly expanding field.

Magnetic susceptibility of topological nodal semimetals

Magnetic susceptibility of the topological Weyl, type-II Weyl, Dirac, and line node semimetals is theoretically investigated. Dependences of this susceptibility on the chemical potential, temperature, direction and magnitude of the magnetic field are found. The obtained results show that magnetic measurements can be very useful in investigating these semimetals. As an example, we calculate magnetic susceptibility of Cd$_3$As$_2$, Na$_3$Bi, and Ca$_3$P$_2$.

Geared Topological Metamaterials with Tunable Mechanical Stability

The classification of materials into insulators and conductors has been shaken up by the discovery of topological insulators that conduct robustly at the edge but not in the bulk. In mechanics, designating a material as insulating or conducting amounts to asking if it is rigid or floppy. Although mechanical structures that display topological floppy modes have been proposed, they are all vulnerable to global collapse. Here, we design and build mechanical metamaterials that are stable and yet capable of harboring protected edge and bulk modes, analogous to those in electronic topological insulators and Weyl semimetals. To do so, we exploit gear assemblies that, unlike point masses connected by springs, incorporate both translational and rotational degrees of freedom. Global structural stability is achieved by eliminating geometrical frustration of collective gear rotations extending through the assembly. The topological robustness of the mechanical modes makes them appealing across scales from engineered macrostructures to networks of toothed microrotors of potential use in micro-machines.

Pressure-Induced New Topological Weyl Semimetal Phase in TaAs.

We report a new pressure-induced phase in TaAs with different Weyl fermions than the ambient structure with the aid of theoretical calculations, experimental transport and synchrotron structure investigations up to 53GPa. We show that TaAs transforms from an ambient I4_{1}md phase (t-TaAs) to a high-pressure hexagonal P-6m2 (h-TaAs) phase at 14GPa, along with changes of the electronic state from containing 24 Weyl nodes distributed at two energy levels to possessing 12 Weyl nodes at an isoenergy level, which substantially reduces the interference between the surface and bulk states. The new pressure-induced phase can be reserved upon releasing pressure to ambient condition, which allows one to study the exotic behavior of a single set of Weyl fermions, such as the interplay between surface states and other properties.

Universal optical conductivity of a disordered Weyl semimetal.

Topological Weyl semimetals, besides manifesting chiral anomaly, can also accommodate a disorder-driven unconventional quantum phase transition into a metallic phase. A fundamentally and practically important question in this regard concerns an experimentally measurable quantity that can clearly distinguish these two phases. We show that the optical conductivity while serving this purpose can also play the role of a bonafide order parameter across such disorder-driven semimetal-metal quantum phase transition by virtue of displaying distinct scaling behavior in the semimetallic and metallic phases, as well as inside the quantum critical fan supporting a non-Fermi liquid. We demonstrate that the correction to the dielectric constant and optical conductivity in a dirty Weyl semimetal due to weak disorder is independent of the actual nature of point-like impurity scatterers. Therefore, optical conductivity can be used as an experimentally measurable quantity to study the critical properties and to pin the universality class of the disorder-driven quantum phase transition in Weyl semimetals.

Floquet semimetal with Floquet-band holonomy

Exotic topological states of matter such as Floquet topological insulator or Floquet Weyl semimetal can be induced by periodic driving. This work proposes a Floquet semimetal with Floquet-band holonomy. That is, the system is gapless, but as a periodic parameter viewed as quasimomentum of a synthetic dimension completes an adiabatic cycle, each Floquet band as a whole exchanges with other Floquet bands. The dynamical manifestations of such Floquet-band holonomy are studied. Under open boundary conditions, we discover anomalous chiral edge modes localized only at one edge, winding around the entire quasienergy Brillouin zone, well separated from bulk states, and possessing holonomy different from bulk states. These remarkable properties are further exploited to realize quantized or half-quantized edge state pumping.

Wigner transformation, momentum space topology, and anomalous transport

Using derivative expansion applied to the Wigner transform of the two- point Green function we analyse the anomalous quantum Hall effect (AQHE), and the chiral magnetic effect (CME). The corresponding currents are proportional to the momentum space topological invariants. We reproduce the conventional expression for the Hall conductivity in 2+1 D. In 3+1 D our analysis allows to explain systematically the AQHE in topological insulators and Weyl semimetals. At the same time using this method it may be proved, that the equilibrium CME is absent in the wide class of solids, as well as in the properly regularized relativistic quantum field theory.

Spectroscopic evidence for a type II Weyl semimetallic state in MoTe2.

In a type I Dirac or Weyl semimetal, the low-energy states are squeezed to a single point in momentum space when the chemical potential μ is tuned precisely to the Dirac/Weyl point. Recently, a type II Weyl semimetal was predicted to exist, where the Weyl states connect hole and electron bands, separated by an indirect gap. This leads to unusual energy states, where hole and electron pockets touch at the Weyl point. Here we present the discovery of a type II topological Weyl semimetal state in pure MoTe2, where two sets of Weyl points (, ) exist at the touching points of electron and hole pockets and are located at different binding energies above EF. Using angle-resolved photoemission spectroscopy, modelling, density functional theory and calculations of Berry curvature, we identify the Weyl points and demonstrate that they are connected by different sets of Fermi arcs for each of the two surface terminations. We also find new surface 'track states' that form closed loops and are unique to type II Weyl semimetals. This material provides an exciting, new platform to study the properties of Weyl fermions.

Chiral wave-packet scattering in Weyl semimetals

In quantum mechanics, a particle is best described by the wave packet instead of the plane wave. Here, we study the wave-packet scattering problem in Weyl semimetals with the low-energy Weyl fermions of different chiralities. Our results show that the wave packet acquires a chirality-protected shift in the single impurity scattering process. More importantly, the chirality-protected shift can lead to an anomalous scattering probability, thus, affects the transport properties in Weyl semimetals. We find that the ratio between the transport lifetime and the quantum lifetime increases sharply when the Fermi energy approaches to the Weyl nodes, providing an explanation on the experimentally observed the ultrahigh mobility in topological (Weyl or Dirac) semimetals.

Topological Floquet Phases in Driven Coupled Rashba Nanowires.

We consider periodically driven arrays of weakly coupled wires with conduction and valence bands of Rashba type and study the resulting Floquet states. This nonequilibrium system can be tuned into nontrivial phases such as topological insulators, Weyl semimetals, and dispersionless zero-energy edge mode regimes. In the presence of strong electron-electron interactions, we generalize these regimes to the fractional case, where elementary excitations have fractional charges e/m with m being an odd integer.

Detecting the Chern number of topological Weyl semimetals in 3D optical lattices

We propose a realistic scheme to directly probe the Chern number of topological Weyl semimetals in optical lattices. The Weyl semimetal states can be realized with ultracold fermionic atoms trapped in three-dimensional optical lattices, and are topologically characterized by kz-dependent Chern number, where kz is the out-of-plane quasimomentum. We demonstrate with numerical simulations that this characteristic topological invariant can be extracted from the shift of the hybrid Wannier center in the optical lattice, based on the particle pumping approach. Through in situ measurement of atomic density, the topological properties of the Weyl semimetal states are then directly revealed.

Detecting monopole charge in Weyl semimetals via quantum interference transport

Topological Weyl semimetals can host Weyl nodes with monopole charges in momentum space. How to detect the signature of the monopole charges in quantum transport remains a challenging topic. Here, we reveal the connection between the parity of monopole charge in topological semimetals and the quantum interference corrections to the conductivity. We show that the parity of monopole charge determines the sign of the quantum interference correction, with odd and even parity yielding the weak anti-localization and weak localization effects, respectively. This is attributed to the Berry phase difference between time-reversed trajectories circulating the Fermi sphere that encloses the monopole charges. From standard Feynman diagram calculations, we further show that the weak-field magnetoconductivity at low temperatures is proportional to $+\sqrt{B}$ in double-Weyl semimetals and $-\sqrt{B}$ in Weyl semimetals, respectively, which could be verified experimentally.

Helicity-protected ultrahigh mobility Weyl fermions in NbP

Non-centrosymmetric transition metal monopnictides, including TaAs, TaP, NbAs, and NbP, are emergent topological Weyl semimetals (WSMs) hosting exotic relativistic Weyl fermions. In this letter, we elucidate the physical origin of the unprecedented charge carrier mobility of NbP, which can reach $1\times10^{7}$ cm $^{2}$V$^{-1}$s$^{-1}$ at 1.5 K. Angle- and temperature-dependent quantum oscillations, supported by density function theory calculations, reveal that NbP has the coexistence of p- and n-type WSM pockets in the $k_{z}$=1.16$\pi$/c plane (W1-WSM) and in the $k_{z}$=0 plane near the high symmetry points $\Sigma$ (W2-WSM), respectively. Uniquely, each W2-WSM pocket forms a large dumbbell-shaped Fermi surface (FS) enclosing two neighboring Weyl nodes with the opposite chirality. The magneto-transport in NbP is dominated by these highly anisotropic W2-WSM pockets, in which Weyl fermions are well protected from defect backscattering by real spin conservation associated to the chiral nodes. However, with a minimal doping of $\sim$1\% Cr, the mobility of NbP is degraded by more than two order of magnitude, due to the invalid of helicity protection to magnetic impurities. Helicity protected Weyl fermion transport is also manifested in chiral anomaly induced negative magnetoresistance, controlled by the W1-WSM states. In the quantum regime below 10 K, the intervalley scattering time by impurities becomes a large constant, producing the sharp and nearly identical conductivity enhancement at low magnetic field.

Visualizing the chiral anomaly in Dirac and Weyl semimetals with photoemission spectroscopy

Quantum anomalies are the breaking of a classical symmetry by quantum fluctuations. They dictate how physical systems of diverse nature, ranging from fundamental particles to crystalline materials, respond topologically to external perturbations, insensitive to local details. The anomaly paradigm was triggered by the discovery of the chiral anomaly that contributes to the decay of pions into photons and influences the motion of superfluid vortices in $^3$He-A. In the solid state, it also fundamentally affects the properties of topological Weyl and Dirac semimetals, recently realized experimentally in TaAs, Na$_3$Bi, Cd$_3$As$_2$, and ZrTe$_{5}$. In this work we propose that the most identifying consequence of the chiral anomaly, the charge density imbalance between fermions of different chirality induced by non-orthogonal electric and magnetic fields, can be directly observed in these materials with the existing technology of photoemission spectroscopy. With angle resolution, the chiral anomaly is identified by a characteristic note-shaped pattern of the emission spectra, originating from the imbalanced occupation of the bulk states and a previously unreported momentum dependent energy shift of the surface state Fermi arcs. We further demonstrate that the chiral anomaly likewise leaves an imprint in angle averaged emission spectra, facilitating its experimental detection. Thereby, our work provides essential theoretical input to foster the direct visualization of the chiral anomaly in condensed matter.

Vector optical activity in the Weyl semimetal TaAs

It is shown that the Weyl semimetal TaAs can have a significant polar vector contribution to its optical activity. This is quantified by ab initio calculations of the resonant x-ray diffraction at the Ta $L1$ edge. For the Bragg vector (400), this polar vector contribution to the circular intensity differential between left and right polarized x rays is predicted to be comparable to that arising from linear dichroism, which could be tested by future experiments. Implications this result has in regards to optical effects predicted for topological Weyl semimetals are discussed.

Evolution of the Fermi surface of Weyl semimetals in the transition metal pnictide family.

Topological Weyl semimetals (TWSs) represent a novel state of topological quantum matter which not only possesses Weyl fermions (massless chiral particles that can be viewed as magnetic monopoles in momentum space) in the bulk and unique Fermi arcs generated by topological surface states, but also exhibits appealing physical properties such as extremely large magnetoresistance and ultra-high carrier mobility. Here, by performing angle-resolved photoemission spectroscopy (ARPES) on NbP and TaP, we directly observed their band structures with characteristic Fermi arcs of TWSs. Furthermore, by systematically investigating NbP, TaP and TaAs from the same transition metal monopnictide family, we discovered their Fermiology evolution with spin-orbit coupling (SOC) strength. Our experimental findings not only reveal the mechanism to realize and fine-tune the electronic structures of TWSs, but also provide a rich material base for exploring many exotic physical phenomena (for example, chiral magnetic effects, negative magnetoresistance, and the quantum anomalous Hall effect) and novel future applications.

Weyl semimetal phase in the non-centrosymmetric compound TaAs

Experiments show that TaAs is a three-dimensional topological Weyl semimetal. Three-dimensional (3D) topologicalWeyl semimetals (TWSs) represent a state of quantum matter with unusual electronic structures that resemble both a ‘3D graphene’ and a topological insulator. Their electronic structure displays pairs of Weyl points (through which the electronic bands disperse linearly along all three momentum directions) connected by topological surface states, forming a unique arc-like Fermi surface (FS). Each Weyl point is chiral and contains half the degrees of freedom of a Dirac point, and can be viewed as a magnetic monopole in momentum space. By performing angle-resolved photoemission spectroscopy on the non-centrosymmetric compound TaAs, here we report its complete band structure, including the unique Fermi-arc FS and linear bulk band dispersion across the Weyl points, in agreement with the theoretical calculations1,2. This discovery not only confirms TaAs as a 3DTWS, but also provides an ideal platform for realizing exotic physical phenomena (for example, negative magnetoresistance, chiral magnetic effects and the quantum anomalous Hall effect) which may also lead to novel future applications.

Helical Spin Order from Topological Dirac and Weyl Semimetals.

We study dynamical mass generation and the resultant helical spin orders in topological Dirac and Weyl semimetals, including the edge states of quantum spin Hall insulators, the surface states of weak topological insulators, and the bulk materials of Weyl semimetals. In particular, the helical spin textures of Weyl semimetals manifest the spin-momentum locking of Weyl fermions in a visible manner. The spin-wave fluctuations of the helical order carry electric charge density; therefore, the spin textures can be electrically controlled in a simple and predictable manner.

Theory of Kerr and Faraday rotations and linear dichroism in Topological Weyl Semimetals.

We consider the electromagnetic response of a topological Weyl semimetal (TWS) with a pair of Weyl nodes in the bulk and corresponding Fermi arcs in the surface Brillouin zone. We compute the frequency-dependent complex conductivities σαβ(ω) and also take into account the modification of Maxwell equations by the topological θ-term to obtain the Kerr and Faraday rotations in a variety of geometries. For TWS films thinner than the wavelength, the Kerr and Faraday rotations, determined by the separation between Weyl nodes, are significantly larger than in topological insulators. In thicker films, the Kerr and Faraday angles can be enhanced by choice of film thickness and substrate refractive index. We show that, for radiation incident on a surface with Fermi arcs, there is no Kerr or Faraday rotation but the electric field develops a longitudinal component inside the TWS, and there is linear dichroism signal. Our results have implications for probing the TWS phase in various experimental systems.

Thermoelectric properties of materials with nontrivial electronic topology

Small band gap topological insulators and Weyl semimetals show excellent TE properties. We identify two mechanisms (i) asymmetry in the electronic density of states caused by band inversion at an electronic topological transition and (ii) band convergence as the key to good TE behavior of these materials.