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We demonstrate that periodically driven quantum rotors provide a promising and broadly applicable platform to implement multi-gap topological phases, where groups of bands can acquire topological invariants due to non-Abelian braiding of band degeneracies. By adiabatically varying the periodic kicks to the rotor we find nodal-line braiding, which causes sign flips of topological charges of band nodes and can prevent them from annihilating, indicated by non-zero values of the %non-Abelian patch Euler class. In particular, we report on the emergence of an anomalous Dirac string phase arising in the strongly driven regime, a truly out-of-equilibrium phase of the quantum rotor. This phase emanates from braiding processes involving all (quasienergy) gaps and manifests itself with edge states at zero angular momentum. Our results reveal direct applications in state-of-the-art experiments of quantum rotors, such as linear molecules driven by periodic far-off-resonant laser pulses or artificial quantum rotors in optical lattices, whose extensive versatility offers precise modification and observation of novel non-Abelian topological properties.

We report on a class of gapped projected entangled pair states (PEPS) with non-trivial Euler topology motivated by recent progress in band geometry. In the non-interacting limit, these systems have optimal conditions relating to saturation of quantum geometrical bounds, allowing for parent Hamiltonians whose lowest bands are completely flat and which have the PEPS as unique ground states. Protected by crystalline symmetries, these states evade restrictions on capturing tenfold-way topological features with gapped PEPS. These PEPS thus form the first tensor network representative of a non-interacting, gapped two-dimensional topological phase, similar to the Kitaev chain in one dimension. Using unitary circuits, we then formulate interacting variants of these PEPS and corresponding gapped parent Hamiltonians. We reveal characteristic entanglement features shared between the free-fermionc and interacting states with Euler topology. Our results hence provide a rich platform of PEPS models that have, unexpectedly, a finite topological invariant, providing a platform for new spin liquids, quantum Hall physics, and quantum information pursuits., Comment: 5+6 pages, 4+1 figures

We discuss a class of three-band non-Abelian topological insulators in three dimensions that carry a single bulk Hopf index protected by spatiotemporal ($\mathcal{PT}$) inversion symmetry. These phases may also host subdimensional topological invariants given by the Euler characteristic class, resulting in real Hopf-Euler insulators. Such systems naturally realize helical nodal structures in the three-dimensional Brillouin zone, providing a physical manifestation of the linking number described by the Hopf invariant. We show that, by opening a gap between the valence bands of these systems, one finds a fully-gapped ``flag'' phase, which displays a three-band multi-gap Pontryagin invariant. Unlike the previously reported $\mathcal{PT}$-symmetric four-band real Hopf insulator, which hosts a $\mathbb{Z} \oplus \mathbb{Z}$ invariant, these phases are not unitarily equivalent to two copies of a complex two-band Hopf insulator. We show that such uncharted phases can be obtained through dimensional extension of two-dimensional Euler insulators, and that they support (i) an optical bulk integrated circular shift effect quantized by the Hopf invariant, (ii) quantum-geometric breathing in the real space Wannier functions, and (iii) surface Euler topology on boundaries. Consequently, our findings pave the way for novel experimental realizations of real-space quantum-geometry, as these systems may be directly simulated by utilizing synthetic dimensions in metamaterials or ultracold atoms., Comment: 16+11 pages, 5+6 figures

We analyze quantum-geometric bounds on optical weights in topological phases with pairs of bands hosting non-trivial Euler class, a multi-gap invariant characterizing non-Abelian band topology. We show how the bounds constrain the combined optical weights of the Euler bands at different dopings and further restrict the size of the adjacent band gaps. In this process, we also consider the associated interband contributions to DC conductivities in the flat-band limit. We physically validate these results by recasting the bound in terms of transition rates associated with the optical absorption of light, and demonstrate how the Euler connections and curvatures can be determined through the use of momentum and frequency-resolved optical measurements, allowing for a direct measurement of this multi-band invariant. Additionally, we prove that the bound holds beyond the degenerate limit of Euler bands, resulting in nodal topology captured by the patch Euler class. In this context, we deduce optical manifestations of Euler topology within $\vec{k} \cdot \vec{p}$ models, which include quantized optical conductivity, and third-order jerk photoconductivities. We showcase our findings with numerical validation in lattice-regularized models that benchmark effective theories for real materials and are realizable in metamaterials and optical lattices., Comment: 7+11 pages, 3 figures

We comment on the recent paper ``Floquet non-Abelian topological insulator and multifold bulk-edge correspondence" by Tianyu Li and Haiping Hu, Nat. Comm. {\bf 14}, 6418 (2023). Apart from the fact that the authors unjustly imply to study multi-gap topology in Floquet systems for the first time, only known homotopic relations are presented. While such insights are used to present interesting Floquet phenomena and phases, which is an attractive result in itself, they cannot be used to deduce the total bulk characterization in the dynamical context without further proof. In fact, the authors essentially rephrase a Zak phase description. These results should in particular be contrasted to earlier results, arXiv:2208.12824, in which static-compatible Zak phases {\it and} dynamical Dirac strings were shown to be able to {\it distinguish} rather similar non-Abelian Floquet phases in $2+1$ dimensional systems. As a result, the claim of a sharp multifold bulk-edge correspondence cannot be concluded from the given arguments.

The emergence of two-band nodal points (i.e. Weyl nodes) in gapless topological phases only requires translational symmetry, however, their necessary existence in the electronic band structure of materials can be deduced when additional crystalline symmetries are present. In particular, rotation symmetries have been known to be able to protect Weyl nodes of high chirality. In this work, we identify ReO$_3$ as an ideal high-chirality Weyl semimetal in which hexagonal screw symmetry plays a crucial role. To show this, we revisit in detail the algebraic determination of the chirality of Weyl nodes from the spinful irreducible representations of occupied bands, and combine it with the complementary $C_{2}T$-symmetry-protected patch Euler class that indicates the pinning of the Weyl nodes on $C_{2}T$-invariant planes. Supporting our findings with first-principles calculations, we furthermore reveal very clear Fermi arc signatures of the high-chirality Weyl nodes at the Fermi level and for different surface orientations. We finally consider the effect of strain upon which the reconfiguration of Weyl nodes further unveils their Chern (i.e. high chirality) and Euler (i.e. symmetry-plane pinning) topological nature., Comment: 25 pages, 8 figures

We report on a certain class of three-dimensional topological insulators and semimetals protected by spinless $\mathcal{P}\mathcal{T}$ symmetry, hosting an integer-valued bulk invariant. We show using homotopy arguments that these phases host multi-gap topology, providing a realization of a single $\mathbb{Z}$ invariant in three spatial dimensions that is distinct from the Hopf index. We identify this invariant with the Pontryagin index, which describes BPST instantons in particle physics contexts and corresponds to a 3-sphere winding number. We study naturally arising multi-gap linked nodal rings, topologically characterized by split-biquaternion charges, which can be removed by non-Abelian braiding of nodal rings, even without closing a gap. We additionally connect the describing winding number in terms of gauge-invariant combinations of non-Abelian Berry connection elements, indicating relations to Pontryagin characteristic class in four dimensions. These topological configurations are furthermore related to fully non-degenerate multi-gap phases that are characterized by a pair of winding numbers relating to two isoclinic rotations in the case of four bands and can be generalized to an arbitrary number of bands. From a physical perspective, we also analyze the edge states corresponding to this Pontryagin index as well as their dissolution subject to the gap-closing disorder. Finally, we elaborate on the realization of these novel non-Abelian phases, their edge states and linked nodal structures in acoustic metamaterials and trapped-ion experiments., Comment: 16+6 pages, 7+2 figures

We study the effect of disorder in systems having a non-trivial Euler class. As these recently proposed multi-gap topological phases come about by braiding non-Abelian charged band nodes residing between different bands to induce stable pairs within isolated band subspaces, novel properties may be expected. Namely, a~modified stability and critical phases under the unbraiding to metals can arise, when the disorder preserves the underlying $C_2\cal{T}$ or $\cal{P}\cal{T}$ symmetry on average. Employing elaborate numerical computations, we verify the robustness of associated topology by evaluating the changes in the average densities of states and conductivities for different types of disorders. Upon performing a scaling analysis around the corresponding quantum critical points we retrieve a universality for the localization length exponent of $\nu = 1.4 \pm 0.1$ for Euler-protected phases, relating to two-dimensional percolation models. We generically find that quenched disorder drives Euler semimetals into critical metallic phases. Finally, we show that magnetic disorder can also induce topological transitions to quantum anomalous Hall plaquettes with local Chern numbers determined by the initial value of the Euler invariant., Comment: 6+11 pages, 4+9 figures

The past few years have seen a revived interest in quantum geometrical characterizations of band structures due to the rapid development of topological insulators and semi-metals. Although the metric tensor has been connected to many geometrical concepts for single bands, the exploration of these concepts to a multi-band paradigm still promises a new field of interest. Formally, multi-band systems, featuring in particular degeneracies, have been related to projective spaces, explaining also the success of relating quantum geometrical aspects of flat band systems, albeit usually in the single band picture. Here, we propose a different route involving Pl\"ucker embeddings to represent arbitrary classifying spaces, being the essential objects that encode $all$ the relevant topology.This paradigm allows for the quantification of geometrical quantities directly in readily manageable vector spaces that a priori do not involve projectors or the need of flat band conditions. As a result, our findings are shown to pave the way for identifying new geometrical objects and defining metrics in arbitrary multi-band systems, especially beyond the single flatband limit, promising a versatile tool that can be applied in contexts that range from response theories to finding quantum volumes and bounds on superfluid densities as well as possible quantum computations., Comment: 28+6 pages; 1 figure

Many previous studies of Andreev reflection have demonstrated that unusual effects can occur in media which have a nontrivial bulk topology. Following this line of investigation, we study Andreev reflection in topological Euler materials by analysing a simple model of a bulk node with a generic winding number $n\geq 0$. We find that the magnitudes of the resultant reflection coefficients depend strongly on whether the winding is even or odd. Moreover this parity dependence is reflected in the differential conductance curves, which are highly suppressed for $n$ even but not $n$ odd. This gives a possible route through which the recently discovered Euler topology could be probed experimentally., Comment: 6+4 pages; 3 figures

Two-dimensional Euler insulators are novel kind of systems that host multi-gap topological phases, quantified by a quantised first Euler number in their bulk. Recently, these phases have been experimentally realised in suitable two-dimensional synthetic matter setups. Here we introduce the second Euler invariant, a familiar invariant in both differential topology (Chern-Gauss-Bonnet theorem) and in four-dimensional Euclidean gravity, whose existence has not been explored in condensed matter systems. Specifically, we firstly define two specific novel models in four dimensions that support a non-zero second Euler number in the bulk together with peculiar gapless boundary states. Secondly, we discuss its robustness in general spacetime-inversion invariant phases and its role in the classification of topological degenerate real bands through real Grassmannians. In particular, we derive from homotopy arguments the minimal Bloch Hamiltonian form from which the tight-binding models of any second Euler phase can be generated. Considering more concretely the gapped Euler phase associated with the tangent bundle of the four-sphere, we show that the bulk band structure of the nontrivial 4D Euler phase necessarily exhibits triplets of linked nodal surfaces (where the three types of nodal surfaces are formed by the crossing of the three successive pairs of bands within one four-band subspace). Finally, we show how to engineer these new topological phases in a four-dimensional ultracold atom setup. Our results naturally generalize the second Chern and spin Chern numbers to the case of four-dimensional phases that are characterised by real Hamiltonians and open doors for implementing such unexplored higher-dimensional phases in artificial engineered systems, ranging from ultracold atoms to photonics and electric circuits., Comment: 15 pages, 5 figures

We study the relationship between projected momentum-space spin textures and Wilson loop winding, proving a map between band topology of and spin topology in certain restricted symmetry settings, relevant to fragile topology. Our results suggest that the spin gap may act as a smoking gun bulk indicator for fragile topology within specific scenarios., Comment: 7+5 pages, 1+3 figures

Topological phases of matter span a wide area of research shaping fundamental pursuits and offering promise for future applications. While a significant fraction of topological materials has been characterized using symmetry requirements of wave functions, the past two years have witnessed the rise of novel multi-gap dependent topological states, the properties of which go beyond these approaches and are yet to be fully explored. Thriving upon these insights, we report on uncharted anomalous phases and properties that can only arise in out-of-equilibrium Floquet settings. In particular, we identify Floquet-induced non-Abelian braiding mechanisms, which in turn lead to a phase characterized by an anomalous Euler class, the prime example of a multi-gap topological invariant. Most strikingly, we also retrieve the first example of an `anomalous Dirac string phase'. This gapped out-of-equilibrium phase features an unconventional Dirac string configuration that physically manifests itself via anomalous edge states on the boundary. Our results therefore not only provide a stepping stone for the exploration of intrinsically dynamical and experimentally viable multi-gap topological phases, but also demonstrate a powerful way to observe these non-Abelian processes notably in quantum simulators., Comment: 4+7 pages, 3+5 figures

Topological band theory has conventionally been concerned with the topology of bands around a single gap. Only recently non-Abelian {topologies that thrive on involving multiple gaps} were studied, unveiling a new horizon {in topological physics} beyond the conventional paradigm. Here, we report on the first experimental realization of a topological Euler insulator phase with unique meronic characterization in an acoustic metamaterial. We demonstrate that this topological phase has several nontrivial features: First, the system cannot be {described} by conventional topological band theory, but has a nontrivial Euler class that captures the unconventional geometry {of the Bloch} bands {in the Brillouin zone}. Second, we uncover in theory and probe in experiments a meronic configuration of the bulk Bloch states for the first time. Third, using a detailed symmetry {analysis}, we show that the topological Euler insulator evolves from {a non-Abelian topological semimetal phase via the annihilation of Dirac points in pairs in one of the band gaps}. With these nontrivial properties, we establish concretely an unconventional bulk-edge correspondence which is confirmed by directly measuring the edge states via {pump-probe techniques}. Our work thus unveils a nontrivial topological Euler insulator phase with {a unique} meronic {pattern} and paves the way as a platform for {non-Abelian topological} phenomena., Comment: 7+34 pages, 2+13 figures

Although a large class of topological materials have uniformly been identified using symmetry properties of wave functions, the past two years have seen the rise of multi-gap topologies beyond this paradigm. Given recent reports of unexplored features of such phases, platforms that are readily implementable to realize them are therefore desirable. Here, we demonstrate that multi-gap topological phase transitions of non-Abelian charged nodal lines arise in classical phonon waves. By adopting a simple spring-mass system, we construct nodal lines of a three-band system. The braiding process of the nodal lines is readily performed by adjusting the spring constants. The generation and annihilation of the nodal lines are then analyzed using Euler class. Finally, we retrieve topological transitions from trivial nodal lines to a nodal link. Our work provides a simple platform that can offer diverse insights to not only theoretical but also experimental studies on multi-gap topology., Comment: 18 pages, 12 figures

The past few years have seen rapid progress in characterizing topological band structures using symmetry eigenvalue indicated methods. Recently, however, there has been increasing theoretical and experimental interest in multi-gap dependent topological phases that cannot be captured by this paradigm. These topologies arise by braiding band degeneracies that reside between different bands and carry non-Abelian charges due to the presence of either $C_2T$ or $PT$ symmetry, culminating in different invariants such as $\mathbb{Z}$-valued Euler class. Here, we present a universal formulation for Euler phases motivated by their homotopy classification that is related to the Skyrmion-profile of a single unit-vector in three-level systems, and that of two unit-vectors in four-level systems. In addition, upon employing the strategy of systematically building 3D models from a pair of sub-dimensional Euler phases, we show that phase transitions between any two inequivalent Euler phases are mediated by the presence of adjacent (in-gap) nodal rings linked with sub-gap nodal lines, forming trajectories corresponding to the braiding or debraiding of nodal points. The stability of the linked adjacent nodal rings is furthermore demonstrated to be indicated by an Euler class monopole charge matching with its $\mathbb{Z}$-valued linking numbers. We finally also systematically address the conversion of Euler phases into descendant Chern phases upon breaking the $C_2T$ or $PT$ symmetry. All the topological phases discussed in this work are corroborated with explicit minimal lattice models. These models can themselves directly serve as an extra impetus for experimental searches or be employed for theoretical studies, thereby underpinning the upcoming of this nascent pursuit., Comment: 31 pages, 13 figures; v2: Fig.7 corrected and other minor corrections

Non-Abelian states of matter, in which the final state depends on the order of the interchanges of two quasiparticles, can encode information immune from environmental noise with the potential to provide a robust platform for topological quantum computation. We demonstrate that phonons can carry non-Abelian frame charges at the band crossing points of their frequency spectrum, and that external stimuli can drive their braiding. We present a general framework to understand the topological configurations of phonons from first principles calculations using a topological invariant called Euler class, and provide a complete analysis of phonon braiding by combining different topological configurations. Taking a well-known dielectric material, Al$_2$O$_3$, as a representative example, we demonstrate that electrostatic doping gives rise to phonon band inversions that can induce redistribution of the frame charges, leading to non-Abelian braiding of phonons. Our work provides a new quasiparticle platform for realizable non-Abelian braiding in reciprocal space, and expands the toolset for studying braiding processes., Comment: 18 pages, 12 figures

We analyze the band topology of acoustic phonons in 2D materials by considering the interplay of spatial and internal symmetries with additional constraints that arise from the physical context. These supplemental constraints trace back to the Nambu-Goldstone theorem and the requirements of structural stability. We show that this interplay can give rise to previously unaddressed non-trivial nodal charges that are associated with the crossing of the acoustic phonon branches at the center ($\Gamma$-point) of the phononic Brillouin zone. We moreover apply our perspective to the concrete context of graphene, where we demonstrate that the phonon spectrum harbors these kinds of non-trivial nodal charges. Apart from its fundamental appeal, this analysis is physically consequential and dictates how the phonon dispersion is affected when graphene is grown on a substrate. Given the generality of our framework, we anticipate that our strategy that thrives on combining physical context with insights from topology should be widely applicable in characterizing systems beyond electronic band theory., Comment: 9+6 pages, 3 figures

Two-dimensional systems with $C_{2}\mathcal{T}$ ($P\mathcal{T}$) symmetry exhibit the Euler class topology $E\in\mathbb{Z}$ in each two-band subspace realizing a fragile topology beyond the symmetry indicators. By systematically studying the energy levels of Euler insulating phases in the presence of an external magnetic field, we reveal the robust gaplessness of the Hofstadter butterfly spectrum in the flat-band limit, while for the dispersive bands the gapping of the Landau levels is controlled by a hidden symmetry. We also find that the Euler class $E$ of a two-band subspace gives a lower bound for the Chern numbers of the magnetic subgaps. Our study provides new fundamental insights into the fragile topology of flat-band systems going beyond the special case of $E=1$ as e.g.~in twisted bilayer graphene, thus opening the way to a very rich, still mainly unexplored, topological landscape with higher Euler classes.

Weyl semimetals are arguably the most paradigmatic form of a gapless topological phase. While the stability of Weyl nodes, as quantified by their topological charge, has been extensively investigated, recent interest has shifted to the manipulation of the location of these Weyl nodes for non-Abelian braiding. To accomplish this braiding it is necessary to drive significant Weyl node motion using realistic experimental parameter changes. We show that a family of phase transitions characterized by certain symmetry constraints impose that the Weyl nodes have to reorganise by a large amount, shifting from one high symmetry plane to another. Additionally, for a subset of pairs of nodes with nontrivial Euler class topology, this reorganization can only occur through a braiding process with adjacent nodes. As a result, the Weyl nodes are forced to move a large distance across the Brillouin zone and to braid, all driven by small temperature changes, a process we illustrate with Cd$_2$Re$_2$O$_7$. Our work opens up routes to readily manipulate Weyl nodes using only slight external parameter changes, paving the way for the practical realization of reciprocal space braiding., Comment: 7+4 pages; 3+4 figures

Due to their topological charge, or chirality, the Weyl cones present in topological semimetals are considered robust against arbitrary perturbations. One well-understood exception to this robustness is the pairwise creation or annihilation of Weyl cones, which involves the overlap of two oppositely charged nodes in energy and momentum. Here we show that their topological charge can in fact change sign, in a process that involves the merging of not two, but three Weyl nodes. This is facilitated by the presence of rotation and time-reversal symmetries, which constrain the relative positions of Weyl cones in momentum space. We analyze the chirality flip process, showing that transport properties distinguish it from the conventional, double Weyl merging. Moreover, we predict that the chirality flip occurs in MoTe$_2$, where experimentally accessible strain leads to the merging of three Weyl cones close to the Fermi level. Our work sets the stage to further investigate and observe such chirality flipping processes in different topological materials.

Topological phases of matter have revolutionised the fundamental understanding of band theory and hold great promise for next-generation technologies such as low-power electronics or quantum computers. Single-gap topologies have been extensively explored, and a large number of materials have been theoretically proposed and experimentally observed. These ideas have recently been extended to multi-gap topologies with band nodes that carry non-Abelian charges, characterised by invariants that arise by the momentum space braiding of such nodes. However, the constraints placed by the Fermi-Dirac distribution to electronic systems have so far prevented the experimental observation of multi-gap topologies in real materials. Here, we show that multi-gap topologies and the accompanying phase transitions driven by braiding processes can be readily observed in the bosonic phonon spectra of known monolayer silicates. The associated braiding process can be controlled by means of an electric field and epitaxial strain, and involves, for the first time, more than three bands. Finally, we propose that the band inversion processes at the $\Gamma$ point can be tracked by following the evolution of the Raman spectrum, providing a clear signature for the experimental verification of the band inversion accompanied by the braiding process., Comment: 26 pages, 8 figures

Topological phases of matter lie at the heart of physics, connecting elegant mathematical principles to real materials that are believed to shape future electronic and quantum computing technologies. To date, studies in this discipline have almost exclusively been restricted to single-gap band topology because of the Fermi-Dirac filling effect. Here, we theoretically analyze and experimentally confirm a novel class of multi-gap topological phases, which we will refer to as non-Abelian topological semimetals, on kagome geometries. These unprecedented forms of matter depend on the notion of Euler class and frame charges which arise due to non-Abelian charge conversion processes when band nodes of different gaps are braided along each other in momentum space. We identify such exotic phenomena in acoustic metamaterials and uncover a rich topological phase diagram induced by the creation, braiding and recombination of band nodes. Using pump-probe measurements, we verify the non-Abelian charge conversion processes where topological charges of nodes are transferred from one gap to another. Moreover, in such processes, we discover symmetry-enforced intermediate phases featuring triply-degenerate band nodes with unique dispersions that are directly linked to the multi-gap topological invariants. Furthermore, we confirm that edge states can faithfully characterize the multi-gap topological phase diagram. Our study unveils a new regime of topological phases where multi-gap topology and non-Abelian charges of band nodes play a crucial role in understanding semimetals with inter-connected multiple bands., Comment: 22 + 19 pages, 5+11 figures. With regard to references, please note that this concerns a version submitted to the journal in February 2021

The study of topological band structures have sparked prominent research interest the past decade, culminating in the recent formulation of rather prolific classification schemes that encapsulate a large fraction of phases and features. Within this context we recently reported on a class of unexplored topological structures that thrive on the concept of {\it sub-dimensional topology}. Although such phases have trivial indicators and band representations when evaluated over the complete Brillouin zone, they have stable or fragile topologies within sub-dimensional spaces, such as planes or lines. This perspective does not just refine classification pursuits, but can result in observable features in the full dimensional sense. In three spatial dimensions (3D), for example, sub-dimensional topologies can be characterized by non-trivial planes, having general topological invariants, that are compensated by Weyl nodes away from these planes. As a result, such phases have 3D stable characteristics such as Weyl nodes, Fermi arcs and edge states that can be systematically predicted by sub-dimensional analysis. Within this work we further elaborate on these concepts. We present refined representation counting schemes and address distinctive bulk-boundary effects, that include momentum depended (higher order) edge states that have a signature dependence on the perpendicular momentum. As such, we hope that these insights might spur on new activities to further deepen the understanding of these unexplored phases., Comment: 11+4pages; 8+3 figures

The past years have seen rapid progress in the classification of topological materials. These diagnostical methods are increasingly getting explored in the pertinent context of magnetic structures. We report on a general class of electronic configurations within a set of anti-ferromagnetic-compatible space groups that are necessarily topological. Interestingly, we find a systematic correspondence between these anti-ferromagnetic phases to necessarily nontrivial topological ferro/ferrimagnetic counterparts that are readily obtained through physically motivated perturbations. Addressing the exhaustive list of magnetic space groups in which this mechanism occurs, we also verify its presence on planes in 3D systems that were deemed trivial in existing classification schemes. This leads to the formulation of the concept of subdimensional topologies, featuring non-triviality within part of the system that coexists with stable Weyl points away from these planes, thereby uncovering novel topological materials in the full 3D sense that have readily observable features in their bulk and surface spectrum., Comment: 16+8 pages, 11+2 figures;new version comprises extensive updates upon combining previous manuscript with a follow-up study

Using evolutionary algorithm for crystal structure prediction, we present a new stable two-dimensional (2D) carbon allotrope composed of polymerized as-indacenes (PAI) in a zigzag pattern, namely PAI-graphene whose energy is lower than most of the reported 2D allotropes of graphene. Crucially, the crystal structure realizes a nonsymmorphic layer group that enforces a nontrivial global topology of the band structure with two Dirac cones lying perfectly at the Fermi level. The absence of electron/hole pockets makes PAI-graphene a pristine crystalline topological semimetal having anisotropic Fermi velocities with a high value of $7.0 \times 10^{5}$ m/s. We show that while the semimetallic property of the allotrope is robust against the application of strain, the positions of the Dirac cone and the Fermi velocities can be modified significantly with strain. Moreover, by combining strain along both the x- and y-directions, two band inversions take place at $\Gamma$ leading to the annihilation of the Dirac nodes demonstrating the possibility of strain-controlled conversion of a topological semimetal into a semiconductor. Finally we formulate the bulk-boundary correspondence of the topological nodal phase in the form of a generalized Zak-phase argument finding a perfect agreement with the topological edge states computed for different edge-terminations.

The last years have witnessed rapid progress in the topological characterization of out-of-equilibrium systems. We report on robust signatures of a new type of topology -- the Euler class -- in such a dynamical setting. The enigmatic invariant $(\xi)$ falls outside conventional symmetry-eigenvalue indicated phases and, in simplest incarnation, is described by triples of bands that comprise a gapless pair, featuring $2\xi$ stable band nodes, and a gapped band. These nodes host non-Abelian charges and can be further undone by converting their charge upon intricate braiding mechanisms, revealing that Euler class is a fragile topology. We theoretically demonstrate that quenching with non-trivial Euler Hamiltonian results in stable monopole-antimonopole pairs, which in turn induce a linking of momentum-time trajectories under the first Hopf map, making the invariant experimentally observable. Detailing explicit tomography protocols in a variety of cold-atom setups, our results provide a basis for exploring new topologies and their interplay with crystalline symmetries in optical lattices beyond paradigmatic Chern insulators., Comment: 6+7 pages, 3+3 figures; new version features improved exposition and new appendix describing simplified models

We present a framework to systematically address topological phases when finer partitionings of bands are taken into account, rather than only considering the two subspaces spanned by valence and conduction bands. Focusing on $C_2\mathcal{T}$-symmetric systems that have gained recent attention, for example in the context of layered van-der-Waals graphene heterostructures, we relate these insights to homotopy groups of Grassmannians and flag varieties, which in turn correspond to cohomology classes and Wilson-flow approaches. We furthermore make use of a geometric construction, the so-called Pl\"ucker embedding, to induce windings in the band structure necessary to facilitate non-trivial topology. Specifically, this directly relates to the parametrization of the Grassmannian, which describes partitioning of an arbitrary band structure and is embedded in a better manageable exterior product space. From a physical perspective, our construction encapsulates and elucidates the concepts of fragile topological phases beyond symmetry indicators as well as non-Abelian reciprocal braiding of band nodes that arises when the multiple gaps are taken into account. The adopted geometric viewpoint most importantly culminates in a direct and easily implementable method to construct model Hamiltonians to study such phases, constituting a versatile theoretical tool., Comment: 22 pages, 9 figures, 9 pages of appendix; new version has updated discussion

We study two-dimensional spinful insulating phases of matter that are protected by time-reversal and crystalline symmetries. To characterize these phases we employ the concept of corner charge fractionalization: Corners can carry charges that are fractions of even multiples of the electric charge. The charges are quantized and topologically stable as long as all symmetries are preserved. We classify the different corner charge configurations for all point groups, and match them with the corresponding bulk topology. For this we employ symmetry indicators and (nested) Wilson loop invariants. We provide formulas that allow for a convenient calculation of the corner charge from Bloch wavefunctions and illustrate our results using the example of arsenic and antimony monolayers. Depending on the degree of structural buckling, these materials can exhibit two distinct obstructed atomic limits. We present density functional theory calculations for open flakes to support our findings., Comment: 25 pages, 5 figures, accepted manuscript

Weyl semimetals in three-dimensional crystals provide the paradigm example of topologically protected band nodes. It is usually taken for granted that a pair of colliding Weyl points annihilate whenever they carry opposite chiral charge. In a stark contrast, here we report that Weyl points in systems symmetric under the composition of time-reversal with a $\pi$-rotation are characterized by a non-Abelian topological invariant. The topological charges of the Weyl points are transformed via braid phase factors which arise upon exchange inside symmetric planes of the reciprocal momentum space. We elucidate this process with an elementary two-dimensional tight-binding model implementable in cold-atoms setups and in photonic systems. In three dimensions, interplay of the non-Abelian topology with point-group symmetry is shown to enable topological phase transitions in which pairs of Weyl points may scatter or convert into nodal-line rings. By combining our theoretical arguments with first-principles calculations, we predict that Weyl points occurring near the Fermi level of zirconium telluride ($\textrm{ZrTe}$) carry non-trivial values of the non-Abelian charge, and that uniaxial compression strain drives a non-trivial conversion of the Weyl points into nodal lines., Comment: Main text (7 pages, 6 figures + bibliography); Methods (3 pages); Extended Data (7 figures); Supplementary material (15 pages, 8 figures + bibliography)

The two-dimensional (2D) metal PtCoO$_2$ is renowned for the lowest room temperature resistivity among all oxides, close to that of the top two materials Ag and Cu. In addition, we theoretically predict a strong intrinsic spin Hall effect. This originates from six strongly-tilted Dirac cones that we find in the electronic structure near the Fermi surface, where a gap is opened by large spin-orbit coupling (SOC). This is underpinned by rich topological properties; in particular, the phenomenology of a mirror Chern metal is realized not exactly, but very accurately, on account of an approximate crystalline symmetry. We expect that such 'vicinity topology' to be a feature of relevance well beyond this material. Our Wilson loop analysis indicates further elaborate features such as fragile topology. These findings highlight PtCoO$_2$ as a promising material for spintronic applications as well as a platform to study the interplay of symmetry and topology., Comment: 9 pages, 7 figures

We present a general methodology towards the systematic characterization of crystalline topological insulating phases with time reversal symmetry (TRS).~In particular, taking the two-dimensional spinful hexagonal lattice as a proof of principle we study windings of Wilson loop spectra over cuts in the Brillouin zone that are dictated by the underlying lattice symmetries.~Our approach finds a prominent use in elucidating and quantifying the recently proposed ``topological quantum chemistry" (TQC) concept.~Namely, we prove that the split of an elementary band representation (EBR) by a band gap must lead to a topological phase.~For this we first show that in addition to the Fu-Kane-Mele $\mathbb{Z}_2$ classification, there is $C_2\mathcal{T}$-symmetry protected $\mathbb{Z}$ classification of two-band subspaces that is obstructed by the other crystalline symmetries, i.e.~forbidding the trivial phase. This accounts for all nontrivial Wilson loop windings of split EBRs \textit{that are independent of the parameterization of the flow of Wilson loops}.~Then, we show that while Wilson loop winding of split EBRs can unwind when embedded in higher-dimensional band space, two-band subspaces that remain separated by a band gap from the other bands conserve their Wilson loop winding, hence revealing that split EBRs are at least "stably trivial", i.e. necessarily non-trivial in the non-stable (few-band) limit but possibly trivial in the stable (many-band) limit.~This clarifies the nature of \textit{fragile} topology that has appeared very recently.~We then argue that in the many-band limit the stable Wilson loop winding is only determined by the Fu-Kane-Mele $\mathbb{Z}_2$ invariant implying that further stable topological phases must belong to the class of higher-order topological insulators., Comment: 27 pages, 13 figures, v2: minor corrections, new references included, v3: metastable topology of split EBRs emphasized, v4: prepared for publication

We establish the topology of the spin-singlet superconducting states in the bare hyperhoneycomb lattice and derive analytically the full phase diagram using only symmetry and topology in combination with simple energy arguments. The phase diagram is dominated by two states preserving time-reversal symmetry. We find that the line-nodal state dominating at low doping levels is topologically nontrivial and exhibits surface Majorana flat bands, which we show perfectly match the bulk-boundary correspondence using Berry phase approach. At higher doping levels we find a fully gapped state with trivial topology. By analytically calculating the topological invariant of the line nodes, we derive the critical point between the line-nodal and fully gapped states as a function of both pairing parameters and doping. We find that the line-nodal state is favored not only at lower doping levels but also if symmetry-allowed deformations of the lattice is present. Adding simple energy arguments we establish that a fully gapped state with broken time-reversal symmetry likely appears covering the actual phase transition. We find this time-reversal symmetry broken state to be topologically trivial, while we find an additional point nodal state at very low doping levels to have nontrivial topology with associated Fermi surface arcs. We eventually address the robustness of the phase diagram to generalized models also including adiabatic spin-orbit coupling, and show how all but the point nodal state are reasonably stable., Comment: 17 pages, 11 figures

In chiral $p$-wave superconductors, magnetic flux patterns may appear spontaneously when translational symmetry is broken such as at surfaces, domain walls, or impurities. However, in the candidate material Sr$_2$RuO$_4$ no direct signs of such magnetic fields have been detected experimentally. In this paper, the flux pattern at the edge of a disk-shaped sample is examined using the phenomenological Ginzburg Landau approach. The detailed shape of the flux pattern, including self-screening, is computed numerically for different surface types by systematically scanning a range of boundary conditions. Moreover, specific features of the electronic structure are included qualitatively through the coefficients in the Ginzburg Landau functional. Both the shape and the magnitude of the flux pattern are found to be highly sensitive to all considered parameters. In conclusion, such spontaneous magnetic flux patterns are not a universal feature of chiral $p$-wave superconductors., Comment: 13 pages, 9 figures; appendix 2 pages; supplemental document 3 pages

We give an exhaustive characterization of the topology of band structures in class AI, using nonsymmorphic space group 33 ($Pna2_1$) as a representative example where a great variety of symmetry protected line-nodal structures can be formed. We start with the topological classification of all line-nodal structures given through the combinatorics of valence irreducible representations (IRREPs) at a few high-symmetry points (HSPs) at a fixed filling. We decompose the total topology of nodal valence band bundles through the local topology of elementary (i.e. inseparable) nodal structures and the global topology that constrains distinct elementary nodal elements over the Brillouin zone (BZ). Generalizing from the cases of simple point nodes and simple nodal lines (NLs), we argue that the local topology of every elementary nodal structure is characterized by a set of poloidal-toroidal charges, one monopole, and one thread charge (when threading the BZ torus), while the global topology only allows pairs of nontrivial monopole and thread charges. We show that all these charges are given in terms of symmetry protected topological invariants, defined through quantized Wilson loop phases over symmetry constrained momentum loops, which we derive entirely algebraically from the valence IRREPs at the HSPs. In particular, we find highly connected line-nodal structures, line-nodal monopole pairs, and line-nodal thread pairs, that are all protected by the unitary crystalline symmetries only. Furthermore, we show symmetry preserving topological Lifshitz transitions through which independent NLs can be connected, disconnected, or linked. Our work constitutes a heuristic approach to the systematic topological classification and characterization of all momentum space line-nodal structures protected by space group symmetries in class AI., Comment: 30 pages, 18 figures

We perform a fully self-consistent study of domain walls between different chiral domains in chiral $d_{x^2-y^2} \pm id_{xy}-wave superconductors with an underlying honeycomb lattice structure. We investigate domain walls along all possible armchair and zigzag directions and with a finite global phase shift across the domain wall, in addition to the change of chirality. For armchair domain walls we find the lowest domain wall energy at zero global phase shift, while the most favorable zigzag domain wall has a finite global phase shift dependent on the doping level. Below the van Hove singularity the armchair domain wall is most favorable, while at even higher doping the zigzag domain wall has the lowest energy. The domain wall causes a local suppression of the superconducting order parameter, with the superconducting recovery length following a universal curve for all domain walls. Moreover, we always find four subgap states crossing zero energy and well localized to the domain wall. However, the details of their energy spectrum vary notably, especially with the global phase shift across the domain wall., Comment: 8 pages, 8 figures

We combine space group representation theory together with scanning of closed subdomains of the Brillouin zone with Wilson loops to algebraically determine global band structure topology. Considering space group #19 as a case study, we show that the energy ordering of the irreducible representations at the high-symmetry points $\{\Gamma,S,T,U\}$ fully determines the global band topology, with all topological classes characterized through their simple and double Dirac-points., Comment: 22 pages, 11 figures, to appear in Phys. Rev. B: Rapid Communications

We combined the group theory and data mining approach within the Organic Materials Database that leads to the prediction of stable Dirac-point nodes within the electronic band structure of 3-dimensional organic crystals. We find a particular space group $P2_12_12_1$ ($\#19$) that is conducive to the Dirac nodes formation. We prove that nodes are a consequence of the orthorhombic crystal structure. Within the electronic band structure, two different kinds of nodes can be distinguished: 8-fold degenerate Dirac nodes protected by the crystalline symmetry and 4-fold degenerate Dirac nodes protected by band topology. Mining the Organic Materials Database, we present band structure calculations and symmetry analysis for 6 previously synthesized organic materials. In all these materials, the Dirac nodes are well separated within the energy and located near the Fermi surface, which opens up a possibility for their direct experimental observation., Comment: 8 pages, 4 figures, 2 Tables

A data mining study of electronic Kohn-Sham band structures was performed to identify Dirac materials within the Organic Materials Database (OMDB). Out of that, the 3-dimensional organic crystal 5,6-bis(trifluoromethyl)-2-methoxy-1$H$-1,3-diazepine was found to host different Dirac line-nodes within the band structure. From a group theoretical analysis, it is possible to distinguish between Dirac line-nodes occurring due to 2-fold degenerate energy levels protected by the monoclinic crystalline symmetry and 2-fold degenerate accidental crossings protected by the topology of the electronic band structure. The obtained results can be generalized to all materials having the space group $P2_1/c$ (No. 14, $C^5_{2h}$) by introducing three distinct topological classes., Comment: 6 pages, 2 figures, 2 tables. arXiv admin note: text overlap with arXiv:1611.04316

Motivated by the recent realization of the three-dimensional hyperhoneycomb and stripyhoneycomb lattices in lithium iridate (Li$_2$IrO$_3$), we study the possible spin-singlet superconducting states on the whole series of harmonic honeycomb lattices. Beginning with an isolated out-of-plane twist making the honeycomb lattice three-dimensional, we find that the chiral d$\pm$id state, well-known from the honeycomb lattice, is realized in the largest members of the series at low to intermediate doping. Along the twist, four chiral edge states form a two-dimensional dispersive band. Reducing the distance between the twists to form the smaller members of the harmonic honeycomb lattices, the degeneracy between the d-wave states is lifted, which finally destroys the chiral state. By analyzing the hyper- and stripyhoneycomb lattices and generalizing using the $D_{2h}$ point group of all the harmonic honeycomb lattices, we show that the superconducting state often belongs to the trivial irreducible representation. This state has nodal lines at low to intermediate doping, which is possible because the full lattice symmetry allows sign changes between different sets of bonds. We also find time-reversal symmetry broken states, which are either fully gapped or feature nodal points, in certain parts of the phase diagram. Finally, we draw a comparison between the states classified in terms of the $D_{2h}$ symmetries and those observed on the $D_{6h}$ honeycomb lattice.

By means of first-principles density functional calculations, we study the maximally localized Wannier functions for the 2D transition metal dichalcogenides MX2 (M=Mo,W X=S,Se,Te). We found a M^+4-like ionic charge and a single occupied d-band. The center of the d-like maximally localized Wannier function associated with this band is distributed among three M sites. Part of the energy gap is opened by the crystal field splitting induced by the X^-2-like atoms. We extract the hopping parameters for the Wannier functions and provide a perspective on tight-binding model. From the analysis of the tight binding model, we have found an inversion of the band character between the Gamma and the K points of the Brillouin zone due to the M-M hybridization. The consequence of this inversion is the closure of the gap. The M-X hybridization is the only one that tends to open the gap at every k-point, the change in the M-X and M-M hybridization is the main responsible for the difference in the gap between the different dichalcogenide materials. The inversion of the bands gives rise to different spin-orbit splitting at Gamma and K point in the valence band. The different character of the gap at Gamma and K point offers the chance to manipulate the semiconductive properties of these compounds. For a bilayer system, the hybridizations between the out of plane orbitals and the hybridizations between the in plane orbitals split the valence band respectively at the Gamma and K point. The splitting in the valence band is opened also without spin-orbit coupling and comes from the M-M and X-X hybridization between the two monolayers.

Motivated by Sr$_2$RuO$_4$, edge quasiparticle states are analyzed based on the self-consistent solution of the Bogolyubov-de Gennes equations for a topological chiral $p$-wave superconductor. Using a tight-binding model of a square lattice for the dominant $\gamma$-band we explore the non-trivial geometry and band structure dependence of the edge states and currents. As a peculiar finding we show that for high band fillings currents flow in reversed direction comparing straight and zigzag edges. We give a simple explanation in terms of the positions of the zero-energy bound states using a quasi-classical picture. We also show that a Ginzburg-Landau approach can reproduce these results. Moreover, the band filling dependence of the most stable domain wall structure is discussed., Comment: 5 pages, 4 figures

A detailed theoretical interpretation of the Josephson interference experiment between Sr$_2$RuO$_4$ and Pb reported by Kidwingira \textit{et al} is given. Assuming chiral p-wave pairing symmetry a Ginzburg-Landau theory is derived in order to investigate the structure of domain walls between chiral domains. It turns out that anisotropy effects of the Fermi surface and the orientation of the domain walls are essential for their internal structure. Introducing a simple model for a Josephson junction the effect of domain walls intersecting the interface between Sr$_2$RuO$_4$ and Pb is discussed. It is shown that characteristic deviations of the Fraunhofer interference pattern for the critical Josephson current as a function of the magnetic field occurs in qualitative agreement with the experimental finding. Moreover the model is able also to account for peculiar hysteresis effects observed in the experiment., Comment: 16 pages, 18 figures