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Laura Classen

Publications and source records attributed to Laura Classen.

At least 19 recordsLinked to original sources

Unconventional bond- and current-density waves on hexagonal lattices

Charge-density wave (CDW) orders are conventionally described as modulations of on-site charge at an ordering wave vector $\boldsymbol{Q}$ with symmetry-related wave vectors typically forming a multicomponent order-parameter manifold. Recent developments significantly broadened this phenomenology to bond and loop-current density waves, which possess nontrivial, potentially symmetry-breaking textures within the unit cell in addition to their spatial modulation at $\boldsymbol{Q}$. Such textures arise from particle-hole condensates with nonzero angular momentum, analogous to unconventional superconductivity, and their symmetries are described by the little group $G_{\boldsymbol{Q}}$. In this work, we develop a framework for unconventional CDW phases that simultaneously incorporates the local symmetries described by little group and the presence of multiple symmetry-related ordering wave vectors, also known as the star. The resulting multicomponent order parameter transforms under representations of the full space group induced from irreducible representations of $G_{\boldsymbol{Q}}$. We apply this framework to two-dimensional lattices with sixfold symmetry and ordering wave vectors along high-symmetry lines, and derive the corresponding Landau free energies. As a microscopic example, we demonstrate the emergence of unconventional bond and loop-current orders from electronic interactions on the triangular lattice within the random phase approximation, and determine their ground states by microscopically evaluating the relevant coefficients in the free energy. Our framework provides a systematic route to describing unconventional modulated phases and can be readily extended to more complex lattices.

cond-mat.str-el

Intervalley coherence and flavor polarization in three-valley moir\'e systems

We investigate interaction-induced symmetry breaking in moir\'e superlattices created by twisting two identical materials where the electronic low-energy degrees of freedom reside in the vicinity of the $M$ points. Based on general symmetry arguments, we identify and classify the possible candidate instabilities that, besides flavor polarized states, also involve a variety of intervalley-coherent (IVC) orders. This complexity is related primarily to the presence of three valleys, instead of the well-studied scenario of two, e.g., in graphene: IVC states can couple all three valleys identically, with a non-trivial sign structure, or even with different magnitudes. We study the energetics using an analytical strong-coupling framework and unrestricted Hartree-Fock applied to the full continuum model, with very good agreement between the two approaches. Interestingly, depending on stacking, IVC instabilities not only appear due to superexchange at moderate bandwidths, but also deep in the strong-coupling regime as a result of deviations from the flat-metric condition. Our work demonstrates that twisted $M$-point materials provide a rich playground for complex correlated physics and highlights differences and similarities to twisted multilayer graphene.

cond-mat.str-el

Strain-Tuned Incommensurate Kekul\'e Spiral Order in Twisted Bilayer Graphene: a Quantum Many-Body Study

The physics of twisted bilayer graphene away from the exactly solvable chiral limit and the quantum Monte Carlo sign-problem-free charge neutrality point is elusive due to the exponential increase in the computational complexity, which has rendered explanations of experimentally observed insulating and superconducting phases restricted largely to the perturbative level. Here we focus on the filling factor $\nu=\pm2$ and address the question of the strain dependence of the interacting ground state by approximate quantum Monte Carlo (AQMC), state-of-the-art exact diagonalization (ED) and Hartree-Fock (HF) mean field, in order to investigate the strain-tuned transition from the Kramers intervalley coherent (KIVC) state to the incommensurate Kekul\'e spiral (IKS) state. While all three methods capture the KIVC order, only ED and HF detect the weaker IKS order that AQMC does not capture adequately. As the AQMC is still capable of capturing stronger orders like the KIVC, our combined protocol may open the door for further understanding of the rich phases of twisted bilayer graphene and other strongly-correlated systems.

cond-mat.str-el

Tuning correlated states of twisted mono-bilayer graphene with proximity-induced spin-orbit coupling

We study the correlated ground states of twisted mono-bilayer graphene with and without proximity-induced spin-orbit coupling (SOC) from a transition-metal dichalcogenide layer placed on top. We perform self-consistent Hartree-Fock calculations that allow the variational space to include multi-$Q$ translational symmetry broken states for all integer and half-integer fillings of the conduction bands, where signatures of correlated, topological states have been reported experimentally. We find interaction-induced insulators that retain moir\'e translational symmetry at integer fillings, but that break this symmetry at half-integer fillings. We argue that translational symmetry breaking arises from half-filled polarized bands, even when SOC is present. Yet, we find that small SOC can already crucially affect the spin nature of correlated states. Generally, Ising SOC favors out-of-plane spin polarization and spin-valley locking, while Rashba SOC favors in-plane spin order. If only one of these two terms is present, we find that, depending on the type of SOC, it drives a transition from a tetrahedal antiferromagnet to either a coplanar, non-coplanar, or collinear spin-density wave state for half-integer fillings. The frustration associated with the simultaneous presence of both types of SOC can induce chiral, non-coplanar order in parameter ranges where the ground state in the absence of SOC is collinear.

cond-mat.mes-hall

Quantum Geometric Origin of the Intrinsic Nonlinear Hall Effect

We decompose the intrinsic second-order nonlinear Hall effect (NLHE) of a generic multiband system into its quantum-geometric contributions within a fully quantum-mechanical, projector-based formalism. By expanding the nonlinear conductivity in powers of the quasiparticle lifetime $\tau$, we recover the established Berry curvature dipole at order $\tau$ and clarify discrepancies in previous literature concerning the (interband) quantum metric dipole (or Berry curvature polarizability) contribution at order $\tau^0\textrm{.}$ Crucially, our method reveals an additional contribution at order $\tau^0$, determined by the {\it intraband} quantum metric dipole (intraQMD), arising from additional virtual interband transitions captured within the fully quantum-mechanical treatment. The intraQMD contribution is generically nonzero in systems with broken time-reversal symmetry and can be distinguished from other geometric contributions by symmetry. Analytical results for low-energy models of topological band crossings, which are hotspots of quantum geometry, demonstrate how band topology influences each contribution. In particular, the intraQMD contribution is especially large in gapped Dirac cones in antiferromagnets. Through a comprehensive symmetry classification of all magnetic space groups, we identify several candidate materials that are expected to exhibit large intrinsic NLHE, including the topological antiferromagnets Yb$_3$Pt$_4$, CuMnAs, and CoNb$_3$S$_6$, as well as the nodal-plane material MnNb$_3$S$_6$.

cond-mat.mes-hall

Van-Hove singularities and competing instabilities in an altermagnetic metal

Van-Hove (VH) singularities in the single-particle band spectrum are important for interaction-driven quantum phases. Whereas VH points are usually spin-degenerate, in newly proposed altermagnets VH singularities can become spin-dependent, due to momentum-dependent spin polarization of the Fermi surfaces arising from combined rotation and time-reversal symmetry. We consider two altermagnetic models ($d_{x^2-y^2}$- and $d_{xy}$-wave) on a square lattice with spin-polarized VH points, and study their stable fixed-point solutions indicating interaction-induced instabilities using parquet renormalization group. For both models, we find new stable fixed-point solutions of the renormalization group equations which are not connected to the solution in the spin-degenerate limit. This implies that on the square lattice, the system with VH singularities is unstable with respect to altermagnetic perturbations. The leading instability for the $d_{x^2-y^2}$-model is real transverse spin density wave. For the $d_{xy}$-wave model, it is found to be real transverse spin density wave at large altermagnetic splitting. At small altermagnetic splitting both imaginary charge density wave and real longitudinal spin density waves are dominant.

cond-mat.str-el

Relativistic Mott transitions and finite-temperature effects of quantum criticality in Dirac semimetals

Gross-Neveu-Yukawa-type models such as the chiral Ising, chiral XY, and chiral Heisenberg models, serve as effective descriptions of two-dimensional Dirac semi-metals undergoing quantum phase transitions into various symmetry-broken ordered states. Their relativistic quantum critical points govern the systems' physical behavior in the vicinity of the transition also at finite temperatures, which is strongly influenced by critical order-parameter and chiral fermion fluctuations. Here, we explore the effect of these fluctuations at zero and finite temperature, both in the Dirac phase and in the Mott phases with spontaneously broken symmetry. To that end, we set up a functional renormalization group approach, which allows us to systematically calculate the quantum phase diagrams and scaling behavior at and near quantum criticality. We explicitly estimate quantum critical exponents, calculate the quasiparticle weight of the chiral Dirac excitations, and determine the extent of the quantum critical fan. Furthermore, we expose a semi-metallic precondensation regime where order-parameter fluctuations destroy order at finite temperature and we show the related manifestation of the Coleman-Hohenberg-Mermin-Wagner theorem. For the chiral XY model, we also expose signatures of Berezinskii-Kosterlitz-Thouless physics in a system that includes strong fermion fluctuations. In view of recent experimental developments on correlated phases in highly tunable two-dimensional Dirac materials, our work aims at a more comprehensive theoretical description of relativistic quantum criticality in semi-metals, including non-Dirac-liquid behavior.

cond-mat.str-el

Spin and pair density waves in 2D altermagnetic metals

Altermagnetism, a recently proposed and experimentally confirmed class of magnetic order, features collinear compensated magnetism with unconventional d-, g-, or i-wave spin order. Here, we show that in a metallic 2D d-wave altermagnet with combined two-fold spin and four-fold lattice rotational symmetry $[C_2||C_4]$, secondary instabilities can arise. Using an unbiased functional renormalization group approach, we analyze the weak-coupling instabilities of a 2D Hubbard model with a preexisting altermagnetic order inspired by our ab initio electronic structure calculations of realistic material candidates from V$_2$X$_2$O (X = Te, Se) family. We identify two distinct spin density wave (SDW) states that break the underlying altermagnetic $[C_2||C_4]$ symmetry. Additionally, we find spin-fluctuation-induced instabilities leading to a singlet d-wave superconducting state and an unconventional commensurate pair density wave (PDW) state with extended s-wave and spin-triplet symmetry. We establish a general criterion for the unusual exchange statistics for these pair density waves and characterize their excitation spectrum, which exhibits Bogoliubov Fermi surfaces or nodal points depending on the gap size.

cond-mat.str-el

Mean-field analysis of a Hubbard interaction on Bernal Bilayer Graphene

We perform unrestricted Hartree-Fock calculations on the 2D Hubbard model on a honeycomb and bilayer honeycomb lattice at both zero and finite temperatures. Finite size real space calculations are supplemented with RPA calculations in the thermodynamic limit. Our motivation comes from high doping levels achieved in graphene and Bernal bilayer graphene by interacalation. We present phase diagrams in doping and temperature for a moderate Hubbard interaction. The magnetic states we find are classified systematically based on the dominant Fourier components of their spin patterns, their average magnetization and spin incommensurabilities. The dominant spin patterns are N\'eel order and various types of stripes. Around Van Hove filling, we resolve the competition between stripe and chiral spin density waves in the symmetry-broken regime. We also investigate the effect of an applied external displacement field on the spin patterns of BBG.

cond-mat.str-el

Angle-Tuned Gross-Neveu Quantum Criticality in Twisted Bilayer Graphene: A Quantum Monte Carlo Study

The fascinating quantum many-body states in twisted bilayber graphene (TBG) at magic angle, due to the interplay of Coulomb interactions and the quantum metrics of flat bands, have been well understood both experimentally and theoretically. However, the phase diagram and excitations as functions of twist angle and permittivity are still largely unknown. Here, via a newly developed momentum-space continuous-field quantum Monte Carlo method fully taking into account long-ranged Coulomb interactions and flat bands' quantum metrics with system sizes that were not accessible before, we show that charge-neutral TBG realizes an angle-tuned quantum phase transition from a gapped Kramers intervalley coherence (KIVC) state to a Dirac semimetal with critical angles around 1.2$\deg$. In single-particle spectra we demonstrate the evolution of a minimum gap at $\Gamma$ at the magic angle and towards touching points at Brillouin zone corners as the angle increases. The free energy and KIVC order parameter show that the transition belongs to fermionic Gross-Neveu criticality, and is robust upon varying the permittivity or the interlayer hopping.

cond-mat.str-el

Competing phases in kagome magnet FeGe from functional renormalization

The discovery of a charge density wave in FeGe extends the discussion of the nature of charge order in kagome metals to a magnetic compound. Motivated by this observation, we combine density functional theory (DFT) and functional-renormalization-group calculations to study interaction-induced Fermi-surface instabilities of the magnetic state of FeGe. We argue that the leading intra-band contribution to electronic correlations are approximately 2D and come from Van Hove points at the projected $M$~points. By varying parameters around DFT values, we determine a phase diagram for the quasi-2D scenario as function of on-site and nearest-neighbor interactions. We discuss universal aspects in the electronic mechanisms for the resulting phases, as well as the role of SU(2) symmetry breaking. We find FeGe to be in a regime of strong competition between $p$-wave charge density wave, $f$-wave pairing, and $d$-wave spin Pomeranchuk instabilities. This interplay can be influenced in favor of superconducting pairing for slightly increased nearest-neighbor interaction, suggesting a potential to induce superconductivity in FeGe.

cond-mat.str-el

Kohn-Luttinger-like mechanism for unconventional charge density waves

Interaction-induced charge orders with electronic origin occur as states of spontaneously broken symmetry in several materials platforms. An electronic mechanism for charge order requires an attractive component in the effective charge vertex. We put forward such a mechanism for the formation of unconventional charge density waves in a metal. These states result from the condensation of particle-hole pairs with finite wave vector and non-zero angular momentum and correspond to bond or loop current order on a lattice. The mechanism we describe can be viewed as Kohn Luttinger analysis in the particle-hole channel with finite transferred momentum. It incorporates one-loop spin and pairing correctionsn, which are then used as an input for a summation in the charge channel triggering an instability. We extend our analysis to a spin-fluctuation approach, where the effective charge interaction is dressed by the particle-hole ladder with exchanged momentum. We argue that this mechanism works for weakly-interacting metals with nested Fermi surface and a large number of fermion flavors. We apply the Kohn-Luttinger-like approach to square- and triangular-lattice Hubbard models with SU($N_f$) flavour symmetry and show that it leads to different types of $p$-wave charge density waves. We also study effects beyond weak coupling at and away from Van Hove filling in terms of a phenomenological model with additional exchange interaction. In the vicinity of Van Hove filling, we obtain $d$-wave charge density waves with wave vectors determined by nesting as leading instabilities. In addition, we find another charge density wave with wave vector $K/4$ on the triangular lattice on both sides of Van Hove filling. We demonstrate that this $K/4$ instability can win the competition against pairing for $N_f=4$ via an unbiased functional renormalisation group calculation.

cond-mat.str-el

High-order Van Hove singularities and their connection to flat bands

The flattening of single-particle band structures plays an important role in the quest for novel quantum states of matter due to the crucial role of interactions. Recent advances in theory and experiment made it possible to construct and tune systems with nearly flat bands, ranging from graphene multilayers and moire' materials to kagome' metals and ruthenates. While theoretical models predict exactly flat bands under certain ideal conditions, evidence was provided that these systems host high-order Van Hove points, i.e., points of high local band flatness and power-law divergence in energy of the density of states. In this review, we examine recent developments in engineering and realising such weakly dispersive bands. We focus on high-order Van Hove singularities and explore their connection to exactly flat bands. We provide classification schemes and discuss interaction effects. We also review experimental evidence for high-order Van Hove singularities and point out future research directions.

cond-mat.str-el

Field-control of symmetry-broken and quantum disordered phases in frustrated moir\'e bilayers with population imbalance

We determine the ground states and excitation spectra of the paradigmatic four-flavour Heisenberg model with nearest- and next-nearest-neighbor exchange couplings on the triangular lattice in a field controlling the population imbalance of flavor pairs. Such a system arises in the strongly correlated limit of moir\'e bilayers of transition metal dichalcogenides in an electric displacement field or in-plane magnetic field, and can be simulated via ultracold alkaline-earth atoms. We argue that the field tunes between effective SU(4) and SU(2) symmetries in the balanced and fully polarised limits and employ a combination of mean-field calculations, flavour-wave theory, and exact diagonalisation to analyse the intermediate, imbalanced regime. We find different symmetry-broken phases with simultaneous spin and excitonic order depending on the field and next-nearest-neighbor coupling. Furthermore, we demonstrate that there is a strongly fluctuating regime without long-range order that connects candidate spin liquids of the SU(2) and SU(4) limit. The strong fluctuations are facilitated by an extensive classical degeneracy of the model, and we argue that they are also responsible for a strong polarisability at 1/3 polarisation that survives from the mean-field level to the exact spectrum.

cond-mat.str-el

Twisted bilayer graphene at charge neutrality: competing orders of SU(4) Dirac fermions

We study possible patterns for spontaneous symmetry breaking in a Dirac fermion model, which is applicable to twisted bilayer graphene at charge neutrality. We show how a chiral SU(4) symmetry emerges and construct the corresponding low-energy model that includes a Fierz-complete set of symmetry-allowed four-fermion interactions. We employ an unbiased renormalization group treatment to identify the critical points that describe transitions into different ordered phases. The resulting phase diagram depends on the number of fermion flavours and we show that the coupling between ordering channels prevents many of the possible mean-field orders from being accessible at relevant, small flavour numbers. We argue that, as a consequence, twisted bilayer graphene is governed by a quantum Hall state or an SU(4) manifold of insulating spin-valley orders with emergent Lorentz symmetry that contains inter-valley coherent, spin Hall, and valley Hall states. We study how SU(4)-breaking perturbations affect the accessibility and can additionally stabilize symmetry-broken (semi-)metallic states.

cond-mat.str-el

Cascade of transitions in twisted and non-twisted graphene layers within the van Hove scenario

Motivated by measurements of compressibility and STM spectra in twisted bilayer graphene, we analyze the pattern of symmetry breaking for itinerant fermions near a van Hove singularity. Making use of an approximate SU(4) symmetry of the Landau functional, we show that the structure of the spin/isospin order parameter changes with increasing filling via a cascade of transitions. We compute the feedback from different spin/isospin orders on fermions and argue that each order splits the initially 4-fold degenerate van Hove peak in a particular fashion, consistent with the STM data and compressibility measurements, providing a unified interpretation of the cascade of transitions in twisted bilayer graphene. Our results follow from a generic analysis of an SU(4)-symmetric Landau functional and are valid beyond a specific underlying fermionic model. We argue that an analogous van Hove scenario explains the cascade of phase transitions in non-twisted Bernal bilayer and rhombohedral trilayer graphene.

cond-mat.mes-hall

Functional renormalization of spinless triangular-lattice fermions: $N$-patch vs. truncated-unity scheme

We study competing orders of spinless fermions in the triangular-lattice Hubbard model with nearest-neighbor interaction. We calculate the effective, momentum-resolved two-particle vertex in an unbiased way in terms of the functional renormalization group method and compare two different schemes for the momentum discretization, one based on dividing the Fermi surface into patches and one based on a channel decomposition. We study attractive and repulsive nearest-neighbor interaction and find a competition of pairing and charge instabilities. In the attractive case, a Pomeranchuk instability occurs at Van Hove filling and $f$-wave and $p$-wave pairing emerge when the filling is reduced. In the repulsive case, we obtain a charge density wave at Van Hove filling and extended $p$-wave pairing with reduced filling. The $p$-wave pairing solution is doubly degenerate and can realize chiral $p+ip$ superconductivity with different Chern numbers in the ground state. We discuss implications for strongly correlated spin-orbit coupled hexagonal electron systems such as moir\'e heterostructures.

cond-mat.str-el

Competition of Density Waves and Superconductivity in Twisted Tungsten Diselenide

Evidence for correlated insulating and superconducting phases around regions of high density of states was reported in the strongly spin-orbit coupled van-der Waals material twisted tungsten diselenide (tWSe$_2$). We investigate their origin and interplay by using a functional renormalization group approach that allows to describe superconducting and spin/charge instabilities in an unbiased way. We map out the phase diagram as function of filling and perpendicular electric field, and find that the moir\'e Hubbard model for tWSe$_2$ features mixed-parity superconducting order parameters with $s/f$-wave and topological $d/p$-wave symmetry next to (incommensurate) density wave states. Our work systematically characterizes competing interaction-driven phases in tWSe$_2$ beyond mean-field approximations and provides guidance for experimental measurements by outlining the fingerprint of correlated states in interacting susceptibilities.

cond-mat.str-el