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Martin Hohenadler

Publications and source records attributed to Martin Hohenadler.

At least 19 recordsLinked to original sources

Phases and Exotic Phase Transitions of a Two-Dimensional Su-Schrieffer-Heeger Model

We study a Su-Schrieffer-Heeger electron-phonon model on a square lattice by means of auxiliary-field quantum Monte Carlo simulations. The addition of a symmetry-allowed interaction permits analytical integration over the phonons at the expense of discrete Hubbard-Stratonovich fields with imaginary-time correlations. Using single-spin-flip and global updates, we investigate the phase diagram at the O(4)-symmetric point as a function of hopping $t$ and phonon frequency $ω_0$. For $t=0$, where electron hopping is boson assisted, the model maps onto an unconstrained $\mathbb{Z}_2$ gauge theory. A key quantity is the emergent effective flux per plaquette, which equals $π$ in the assisted-hopping regime and vanishes for large $t$. Phases in the former regime can be understood in terms of instabilities of emergent Dirac fermions. Our results support a direct and continuous transition between a $(π,0)$ valence bond solid (VBS) and an antiferromagnetic (AFM) phase with increasing $ω_0$. For large $t$ and small $ω_0$, we find finite-temperature signatures, a disordered pseudogap phase, of a previously reported $(π,π)$ VBS ground state related to a nesting instability. With increasing $ω_0$, AFM order again emerges.

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Simulation of Fermionic and Bosonic Critical Points with Emergent SO(5) Symmetry

We introduce a model of Dirac fermions in 2+1 dimensions with a semimetallic, a quantum spin-Hall insulating (QSHI), and an s-wave superconducting (SSC) phase. The phase diagram features a multicritical point at which all three phases meet as well as a QSHI-SSC deconfined critical point. The QSHI and SSC orders correspond to mutually anti-commuting mass terms of the Dirac Hamiltonian. Based on this algebraic property, SO(5) symmetric field theories have been put forward to describe both types of critical points. Using quantum Monte Carlo simulations, we directly study the operator that rotates between QSHI and SSC states. The results suggest that it commutes with the low-energy effective Hamiltonian at criticality but has a gap in the ordered phases. This implies an emergent SO(5) symmetry at both the multicritical and the deconfined critical points.

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Thermodynamic and Dynamical Signatures of a Quantum Spin-Hall Insulator to Superconductor Transition

Thermodynamic and dynamical properties of a model of Dirac fermions with a deconfined quantum critical point (DQCP) separating an interaction-generated quantum spin-Hall insulator from an s-wave superconductor [Nature Comm.~{\bf 10}, 2658 (2019)] are studied by quantum Monte Carlo simulations. Inside the deconfined quantum critical region bound by the single-particle gap, spinons and spinless charge-2e skyrmions emerge. Since the model conserves total spin and charge, and has a single length scale, these excitations lead to a characteristic linear temperature dependence of the uniform spin and charge susceptibilities. At the DQCP, the order parameter dynamic structure factors show remarkable similarities that support emergent Lorentz symmetry. Above a critical temperature, superconductivity is destroyed by the proliferation of spin-1/2 vortices.

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Valence-bond solid to antiferromagnet transition in the two-dimensional Su-Schrieffer-Heeger model by Langevin dynamics

The two-dimensional Su-Schrieffer-Heeger model of electrons coupled to quantum phonons is investigated using Langevin dynamics within the framework of auxiliary-field quantum Monte Carlo. Based on an explicit determination of the density of zeros of the fermion determinant, it is argued that the method is efficient in the challenging adiabatic limit. Large-scale simulations at the O(4)-symmetric point establish that the ground state of the 2D SSH model undergoes a transition from a $(π,π)$ valence bond solid to an antiferromagnet with increasing phonon frequency, yet still in the adiabatic regime. The single-particle spectrum illustrates the renormalization of the electronic band and suggests the existence of a gapped polaronic band, whereas the particle-hole channels show gapless modes associated with long-range bond and magnetic order, respectively. The simulations are supplemented with a mean-field analysis and a self-consistent Born proximation.

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Doping-induced quantum spin Hall insulator to superconductor transition

A unique property of a dynamically generated quantum spin Hall state are Goldstone modes that correspond to the long-wavelength fluctuations of the spin-orbit coupling order parameter whose topological Skyrmion excitations carry charge 2$e$. Within the model considered here, upon varying the chemical potential, we observe two transitions: An s-wave superconducting order parameter develops at a critical chemical potential $μ_{c1}$, corresponding to the excitation gap of pairs of fermions, and at $μ_{c2}$ the SO(3) order parameter of the quantum spin Hall state vanishes. Using negative-sign-free, large-scale quantum Monte Carlo simulations, we show that $μ_{c1}=μ_{c2}$ within our accuracy -- we can resolve dopings away from half filling down to $δ= 0.0017$. The length scale associated with the fluctuations of the quantum spin Hall order parameter grows down to our lowest doping, suggesting either a continuous or a weakly first-order transition. Contrary to mean-field expectations, the doping versus chemical potential curve is not linear, indicating a dynamical critical exponent $z > 2$ if the transition is continuous.

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Topological terms on topological defects: a quantum Monte Carlo study

Dirac fermions in $2+1$ dimensions with dynamically generated anticommuting SO(3) antiferromagnetic (AFM) and Z$_2$ Kekulé valence-bond solid (KVBS) masses map onto a field theory with a topological $θ$-term. This term provides a mechanism for continuous phase transitions between different symmetry-broken states: topological defects of one phase carry the charge of the other and proliferate at the transition. The $θ$-term implies that a domain wall of the Z$_2$ KVBS order parameter harbors a spin-$1/2$ Heisenberg chain, as described by a $1+1$ dimensional SO(3) non-linear sigma model with $θ$-term at $θ= π$. Using pinning fields to stabilize the domain wall, we show that our auxiliary-field quantum Monte Carlo simulations indeed support the emergence of a spin-$1/2$ chain at the Z$_2$ topological defect. This concept can be generalized to higher dimensions where $2+1$ dimensional SO(4) or SO(5) theories with topological terms are realized at a domain wall.

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Competing Orders and Unconventional Criticality in the Su-Schrieffer-Heeger Model

The phase diagram of the one-dimensional Su-Schrieffer-Heeger model of spinless fermions coupled to quantum phonons is determined by quantum Monte Carlo simulations. It differs significantly from previous work. In addition to Luttinger liquid and bond-order-wave (BOW) phases, we find an extended charge-density-wave (CDW) phase. Because of different broken symmetries, BOW and CDW phases are connected by a retardation-driven phase transition. Our results are consistent with the theory of the frustrated $XXZ$ chain, including unconventional power-law exponents at criticality, and an interpretation in terms of deconfined quantum criticality via proliferation of solitons.

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Orthogonal metal in the Hubbard model with liberated slave spins

A two-dimensional Falicov-Kimball model, equivalent to the Hubbard model in an unconstrained slave-spin representation, is studied by quantum Monte Carlo simulations. The focus is on a fractionalized metallic phase that is characterized in terms of spectral, thermodynamic, and transport properties, including a comparison to the half-filled Hubbard model. The properties of this phase, most notably a single-particle gap but gapless spin and charge excitations, can in principle be understood in the framework of orthogonal metals. However, important and interesting differences arise in the present setting compared to single-particle mean-field theories and other models. We also discuss the role of the local constraints from the slave-spin representation within an extended phase diagram that includes the spatial dimension as a parameter, thereby making contact with previous work in infinite dimensions. Finally, we highlight the absence of $π$-flux configurations in the slave-spin formulation, in particular in the context of topologically ordered fractional phases predicted at the mean-field level.

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Charge-Density-Wave Transitions of Dirac Fermions Coupled to Phonons

The spontaneous generation of charge-density-wave order in a Dirac fermion system via the natural mechanism of electron-phonon coupling is studied in the framework of the Holstein model on the honeycomb lattice. Using two independent and unbiased quantum Monte Carlo methods, the phase diagram as a function of temperature and coupling strength is determined. It features a quantum critical point as well as a line of thermal critical points. Finite-size scaling appears consistent with fermionic Gross-Neveu-Ising universality for the quantum phase transition, and bosonic Ising universality for the thermal phase transition. The critical temperature has a maximum at intermediate couplings. Our findings motivate experimental efforts to identify or engineer Dirac systems with sufficiently strong and tunable electron-phonon coupling.

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Superconductivity from the Condensation of Topological Defects in a Quantum Spin-Hall Insulator

The discovery that spin-orbit coupling can generate a new state of matter in the form of quantum spin-Hall (QSH) insulators has brought topology to the forefront of condensed matter physics. While QSH states from spin-orbit coupling can be fully understood in terms of band theory, fascinating many-body effects are expected if the state instead results from interaction-generated symmetry breaking. In particular, topological defects of the corresponding order parameter provide a route to exotic quantum phase transitions. Here, we introduce a model in which the condensation of skyrmion defects in an interaction-generated QSH insulator produces a superconducting (SC) phase. Because vortex excitations of the latter carry a spin-$1/2$ degree of freedom numbers, the SC order may be understood as emerging from a gapless spin liquid normal state. The QSH-SC transition is an example of a deconfined quantum critical point (DQCP), for which we provide an improved model with only a single length scale that is accessible to large-scale quantum Monte Carlo simulations.

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Fractionalized Metal in a Falicov-Kimball Model

Quantum Monte Carlo simulations reveal an exotic metallic phase with a single-particle gap but gapless spin and charge excitations and a nonsaturating resistivity in a two-dimensional SU(2) Falicov-Kimball model. An exact duality between this model and an unconstrained slave-spin theory leads to a classification of the phase as a fractionalized or orthogonal metal whose low-energy excitations have different quantum numbers than the original electrons. Whereas the fractionalized metal corresponds to the regime of disordered slave spins, the regime of ordered slave spins is a Fermi liquid. At a critical temperature, an Ising phase transition to a spontaneously generated constrained slave-spin theory of the Hubbard model is observed.

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Thermal and quantum lattice fluctuations in Peierls chains

The thermodynamic and spectral properties of electrons coupled to quantum phonons are studied within the spinless Holstein model. Using quantum Monte Carlo simulations, we obtain accurate results for the specific heat and the compressibility, covering the entire range of electron-phonon couplings and phonon frequencies. To this end, we derive an efficient estimator for the specific heat using the properties of the perturbation expansion. This allows us to quantitatively test the predictions of Tomonaga-Luttinger liquid theory as well as the widely used adiabatic approximation for low phonon frequencies. A comparison with the spectral functions of electrons and phonons reveals that the formation of polaron excitations as well as the renormalization of the phonon mode across the Peierls transition have a pronounced effect on the specific heat in the adiabatic regime.

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Two-dimensional Holstein-Hubbard model: Critical temperature, Ising universality, and bipolaron liquid

The two-dimensional Holstein-Hubbard model is studied by means of continuous-time quantum Monte Carlo simulations. Using renormalization-group-invariant correlation ratios and finite-size extrapolation, the critical temperature of the charge-density-wave transition is determined as a function of coupling strength, phonon frequency, and Hubbard repulsion. The phase transition is demonstrated to be in the universality class of the two-dimensional Ising model and detectable via the fidelity susceptibility. The structure of the ground-state phase diagram and the possibility of a bipolaronic metal with a single-particle gap above $T_c$ are explored.

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Dirac Fermions with Competing Orders: Non-Landau Transition with Emergent Symmetry

We consider a model of Dirac fermions in $2+1$ dimensions with dynamically generated, anticommuting SO(3) Néel and Z$_2$ Kekulé mass terms that permits sign-free quantum Monte Carlo simulations. The phase diagram is obtained from finite-size scaling and includes a direct and continuous transition between the Néel and Kekulé phases. The fermions remain gapped across the transition, and our data support an emergent SO(4) symmetry unifying the two order parameters. While the bare symmetries of our model do not allow for spinon-carrying Z$_3$ vortices in the Kekulé mass, the emergent SO(4) invariance permits an interpretation of the transition in terms of deconfined quantum criticality. The phase diagram also features a tricritical point at which Néel, Kekulé, and semimetallic phases meet. The present, sign-free approach can be generalized to a variety of other mass terms and thereby provides a new framework to study exotic critical phenomena.

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Directed-Loop Quantum Monte Carlo Method for Retarded Interactions

The directed-loop quantum Monte Carlo method is generalized to the case of retarded interactions. Using the path integral, fermion-boson or spin-boson models are mapped to actions with retarded interactions by analytically integrating out the bosons. This yields an exact algorithm that combines the highly-efficient loop updates available in the stochastic series expansion representation with the advantages of avoiding a direct sampling of the bosons. The application to electron-phonon models reveals that the method overcomes the previously detrimental issues of long autocorrelation times and exponentially decreasing acceptance rates. For example, the resulting dramatic speedup allows us to investigate the Peierls quantum phase transition on chains of up to $1282$ sites.

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Density waves in strongly correlated quantum chains

We review exact numerical results for one-dimensional quantum systems with half-filled bands. The topics covered include Peierls transitions in Holstein, Fröhlich, Su-Schrieffer-Heeger, and Heisenberg models with quantum phonons, competing fermion-boson and fermion-fermion interactions, as well as symmetry-protected topological states in fermion and anyon models.

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Correlated atomic wires on substrates. I. Mapping to quasi-one-dimensional models

We present a theoretical study of correlated atomic wires deposited on substrates in two parts. In this first part, we propose lattice models for a one-dimensional quantum wire on a three-dimensional substrate and map them onto effective two-dimensional lattices using the Lanczos algorithm. We then discuss the approximation of these two-dimensional lattices by narrow ladder models that can be investigated with well-established methods for one-dimensional correlated quantum systems, such as the density-matrix renormalization group or bosonization. The validity of this approach is studied first for noninteracting electrons and then for a correlated wire with a Hubbard electron-electron repulsion using quantum Monte Carlo simulations. While narrow ladders cannot be used to represent wires on metallic substrates, they capture the physics of wires on insulating substrates if at least three legs are used. In the second part [arXiv:1704.07359], we use this approach for a detailed numerical investigation of a wire with a Hubbard-type interaction on an insulating substrate.

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Correlated atomic wires on substrates. II. Application to Hubbard wires

In the first part of our theoretical study of correlated atomic wires on substrates, we introduced lattice models for a one-dimensional quantum wire on a three-dimensional substrate and their approximation by quasi-one-dimensional effective ladder models [arXiv:1704.07350]. In this second part, we apply this approach to the case of a correlated wire with a Hubbard-type electron-electron repulsion deposited on an insulating substrate. The ground-state and spectral properties are investigated numerically using the density-matrix renormalization group method and quantum Monte Carlo simulations. As a function of the model parameters, we observe various phases with quasi-one-dimensional low-energy excitations localized in the wire, namely paramagnetic Mott insulators, Luttinger liquids, and spin-$1/2$ Heisenberg chains. The validity of the effective ladder models is assessed by studying the convergence with the number of legs and comparing to the full three-dimensional model. We find that narrow ladder models accurately reproduce the quasi-one-dimensional excitations of the full three-dimensional model but predict only qualitatively whether excitations are localized around the wire or delocalized in the three-dimensional substrate.

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