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Interplay between electron correlations and quantum orders in the Hubbard model

William Witczak‐Krempa

Published Aug 8, 2013• 0 citations
OpenAlex

Abstract

We discuss the appearance of quantum orders in the Hubbard model for interacting electrons, at half-filling. Such phases do not have local order parameters and need to be characterized by the quantum mechanical properties of their ground state. On one hand, we study the Mott transition from a metal to a spin liquid insulator in two dimensions, of potential relevance to some layered organic compounds. The correlation-driven transition occurs at fixed filling and involves fractionalization of the electron: upon entering the insulator, a Fermi surface of neutral spinons coupled to an internal gauge field emerges. We focus on the transport properties near the quantum critical point and find that the emergent gauge fluctuations play a key role in determining the universal scaling. Second, motivated by a class of three-dimensional transition metal oxides, the pyrochlore iridates, we study the interplay of non-trivial band topology and correlations. Building on the strong spin orbit coupling in these compounds, we construct a general microscopic Hubbard model and determine its mean-field phase diagram, which contains topological insulators, Weyl semimetals, axion insulators and various antiferromagnets. We also discuss the effects many-body correlations on theses phases. We close by examining a fractionalized topological insulator that combines the two main themes of the thesis: fractionalization and non-trivial band topology. Specifically, we study how the two-dimensional protected surface states of a topological Mott insulator interact with a three-dimensional emergent gauge field. Various correlation effects on observables are identified.

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Scaling theory for Mott–Hubbard transitions: I. T = 0 phase diagram of the 1/2-filled Hubbard model

Anirban Mukherjee, Siddhartha Lal

Abstract We present a T = 0 K renormalization group (RG) phase diagram for the electronic Hubbard model in two dimensions on the square lattice at half filling. The RG procedure treats quantum fluctuations in the single particle occupation number nonperturbatively via the unitarily decoupling of one electronic state at every RG step. The resulting phase diagram thus possesses the quantum fluctuation energy scale (ω) as one of its axes. A relation is derived between ω and the effective temperature scale upto which gapless, as well as emergent gapped phases can be obtained. We find that the normal and insulating phases of the half-filled Hubbard model correspond, for any on-site repulsion, to a marginal Fermi liquid normal phase and a topologically-ordered gapped Mott insulating liquid respectively. The marginal Fermi liquid is found to arise from singular forward scattering in directions normal to the nested Fermi surface, while singular backscattering events lead to Mott liquid state. The transition between these two phases involves passage through a pseudogapped phase bookended by Fermi surface topology-changing Lifshitz transitions. The pseudogap phase is observed to arise from the electronic differentiation encoded within the nested Fermi surface, and involves the gradual gapping of the Fermi surface from antinodes to nodes via charge and spin excitations that are mutually entangled. We obtain effective Hamiltonians for various phases, as well as wavefunctions for the low-energy many-body eigenstates of the Mott liquid. Benchmarking of the ground-state energy per particle and the double-occupancy fraction for the Mott liquid against existing numerical results yields excellent agreement. Presence of a Néel ordering symmetry-breaking perturbation in the RG leads to an antiferromagnetic spin-ordered charge insulating Mott state. Our results thus offer novel insights on a variety of aspects of the Mott–Hubbard problem, and can be extended to the doped system.

New Journal of Physics•Apr 9, 2020•17 citations

Emergent Phases of Quantum Matter In Strongly Correlated Mott Insulators

Jason Iaconis

Strongly correlated electron systems have the potential to host very exoticphases of matter. In order to have relevance to real materials, this exoticphysics often must emerge from relatively simple models. The quantumwavefunctions which describe such phases may bear little resemblance to theoriginal microscopic models. In these cases a variety of complex analytictools often must be supplemented with controlled numerical calculations tofully understand the essential behavior of these models. In this dissertation,we study such quantum phases of matter and their relationship to real materials.We focus on three main problems. First, we explore the relationship betweenstrong spin-orbit coupling and spin liquid physics by studying a very generalmodel on the triangular lattice where spin-orbit coupling leads to the presenceof highly anisotropic interactions. We use variational Monte Carlo to study bothU(1) quantum spin liquid states and ordered ones, via the Gutzwiller projectedfermion construction. We thereby obtain the ground state phase diagram in thisphase space. We furthermore consider effects beyond the Gutzwiller wavefunctionsfor the spinon Fermi surface quantum spin liquid, which are of particularimportance when spin-orbit coupling is present.Second we show that the interplay between a high density two-dimensional electrongas and localized electrons in a neighboring Mott insulator leads to kineticmagnetism unique to the Mott/band insulator interface. Our study is based upona bilayer Hubbard model at $U=\\infty$ with a potential difference between thetwo layers. We combine analytic results with DMRG simulations to show thatmagnetism, and especially kinetic ferromagnetism, is greatly enhanced relative by theproximity of the two subsystems. Third we study the effect of interactions on the properties of a model 2Dtopological Kondo insulator phase. We introduce a model Hamiltonian which webelieve captures the essential physics of the different competing phases.Perhaps the most dramatic example of many-body physics in symmetry protectedtopological phases is the existence of exotic gapless edge states. We comment onthe potentially dramatic effects that interactions can have on such edge states.

•Jan 1, 2018•0 citations

Studies on Fractionalization and Topology in Strongly Correlated Systems from Zero to Two Dimensions

Yichen Hu

The interplay among symmetry, topology and condensed matter systems has deepened our understandings of matter and lead to tremendous recent progresses in finding new topological phases of matter such as topological insulators, superconductors and semi-metals. Most examples of the aforementioned topological materials are free fermion systems, in this thesis, however, we focus on their strongly correlated counterparts where electron-electron interactions play a major role. With interactions, exotic topological phases and quantum critical points with fractionalized quantum degrees of freedom emerge. In the first part of this thesis, we study the problem of resonant tunneling through a quantum dot in a spinful Luttinger liquid. It provides the simplest example of a (0+1)d system with symmetry-protected phase transitions. We show that the problem is equivalent to a two channel SU(3) Kondo problem and can be mapped to a quantum Brownian motion model on a Kagome lattice. Utilizing boundary conformal field theory, we find the universal peak conductance and compute the scaling behavior of the resonance line-shape.\nFor the second part, we present a model of interacting Majorana fermions that describes a superconducting phase with a topological order characterized by the Fibonacci topological field theory. Our theory is based on a SO(7)1=SO(7)1/(G2)1 x (G2)1 coset construction and implemented by a solvable two-dimensional network model. In addition, we predict a closely related ''anti-Fibonacci'' phase, whose topological order is characterized by the tricritical Ising model. Finally, we propose an interferometer that generalizes the Z2 Majorana interferometer and directly probes the Fibonacci non-Abelian statistics.\nFor the third part, we argue that a correlated fluid of electrons and holes can exhibit fractional quantum Hall effects at zero magnetic field. We first show that a Chern insulator can be realized as a free fermion model with p-wave(m=1) excitonic pairing. Its ground state wavefunction is then worked out and generalized to m>1. We give several pieces of evidence that this conjectured wavefunction correctly describes a topological phase, dubbed ''fractional excitonic insulator'', within the same universality class as the corresponding Laughlin state at filling 1/m. We present physical arguments that gapless states with higher angular momentum pairing between energy bands are conducive to forming the fractional excitonic insulator in the presence of repulsive interactions. Without interactions, these gapless states appear at topological phase transitions which separate the trivial insulator from a Chern insulator with higher Chern number. Since the nonvanishing density of states at these higher angular momentum band inversion transitions can give rise to interesting many-body effects, we introduce a series of minimal lattice models realizations in two dimensions. We also study the effect of rotational symmetry broken electron-hole exciton condensation in our lattice models using mean field theory.

•Jan 1, 2019•0 citations

Superfluidity in Strongly Correlated Systems

Eun Gook Moon

We study superfluidity in strongly correlated systems by focusing three features as follows. First, interplay between superfluidity and other order parameters near quantum critical points is studied. The onset positions of the order parameters with or without superconductivity determines how they interact with each other. For the spin density wave (SDW) transition, we find that the quantum critical point shifts by order |∆|, where ∆ is pairing amplitude, so that the region of SDW order is smaller in the superconductor than in the metal. This shift is larger than the |∆|2 shift predicted by theories of competing orders which ignore Fermi surface effects. Second, we study a doped antiferromagnetic Mott insulator motivated by copper based high temperature superconductors. Based on spin and charge fractionalization, the algebraic charge liquid phase whose bosonic spinons have energy gap but fermionic holons form Fermi surfaces and its superconductivity are studied. We show fluctuations of local SDW order orientation lead to d-wave superconductivity, and its quantum critical pairing mechanisms are investigated. Also, a theory of bound states between spinons and holons is studied. We show that the fractionalization induces a doubling electron-like quasiparticles, which naturally induces the fractionalized Fermi liquid. The bound state theory describes exotic properties of the underdoped Cuprates such as “nodal-antinodal dichotomy” at a mean field level description. At last, we study superfluidity of fermions in optical lattices near the Feshbach resonance. Due to divergence of scattering length at the resonance, universality is observed and characteristics of superfluidity has been studied. We extend such universal properties by considering superfluid-insulator transition with an even integer number of fermions per unit cell. The resulting insulator interpolates between a band insulator of fermions and a Mott insulator of fermion pairs.

•Dec 1, 2011•0 citations

Unconventional Phases in Two-Dimensional Hubbard and Kondo-Lattice Models by Variational Cluster Approaches

Benjamin Lenz

Materials with strongly correlated electrons show a multitude of unconventional phenomena, such as superconductivity or magnetism, that cannot be explained in a single-particle picture and necessitate to take many-body effects into account. A route to explain the origin of these phenomena consists in constructing effective models for these materials that are then solved, often using numerical techniques. Paradigmatic models for two different classes of strongly correlated electron systems are investigated in this thesis: The Hubbard model is a paradigmatic model to describe the Mott metal-insulator transition (MIT) and the Kondo lattice model describes the low-energy physics in heavy fermion compounds. Both models are analyzed numerically using different variations of a quantum cluster technique, the variational cluster approximation (VCA). The first part focuses on the MIT, as it is investigated experimentally in quasi-two-dimensional charge-transfer salts. Its nature and associated universality class are still heavily discussed and both experiments and theoretical approaches come to different conclusions. In this thesis, the Mott transition is investigated on an anisotropic two-dimensional Hubbard model at half-filling. By using a control parameter, which induces this anisotropy, strong evidence for Mott quantum criticality is found in weakly coupled Hubbard chains. The results at zero temperature show that the second-order critical end point Tc of the interaction-driven metal-insulator transition can be tuned down to zero at strong anisotropy. Further results for the antiferromagnetic phase suggest a similar picture and motivate adding the anisotropy as a new axis in the phase diagram to account for a low-temperature critical end point of the Mott transition. The second part of this thesis focuses on unconventional phases that emerge in a paradigmatic model for heavy fermion systems, the Kondo lattice model. Using the VCA, the two-dimensional Kondo lattice model is investigated in the paramagnetic phase as well as in phases with broken symmetry. An antiferromagnetic phase at weak coupling and a phase with Kondo-singlet formation at strong coupling are analyzed. Within the antiferromagnetically ordered region, two phases with different Fermi-surface topology, which are separated by a discontinuous transition, are identified. The model is also tested for s-wave superconductivity as found recently using dynamical mean-field theory, but no indications for robust local pairing are seen within VCA. Instead, nodal d-wave superconductivity is found and analyzed in a large range of couplings and electron fillings, and its interplay with antiferromagnetic order at weak coupling is discussed. This motivates further studies on extended models that might allow for a close comparison with experiments on heavy fermion systems. Understanding the formation of unconventional phases in strongly correlated electron systems is not only of fundamental interest, but it is also essential for designing new functional materials. Although the results of approximate cluster techniques have to be handled with care, the new aspects presented in this thesis pave the way for further investigations in this direction.

•Jan 1, 2017•0 citations

Topological Mott transition in a Weyl-Hubbard model: Dynamical mean-field theory study

Bernhard Irsigler, Tobias Graß, Jun-Hui Zheng +2 more

Weyl semimetals are three-dimensional, topologically protected, gapless phases which show exotic phenomena such as Fermi arc surface states or negative magnetoresistance. It is an open question whether interparticle interactions can turn the topological semimetal into a topologically nontrivial Mott-insulating phase. We investigate an experimentally motivated model for Weyl physics of cold atoms in optical lattices, with the main focus on interaction effects and topological properties, by means of dynamical mean-field theory. We characterize topological phases by numerically evaluating the Chern number via the Ishikawa-Matsuyama formula for interacting phases. Within our studies, we find that the Chern numbers become trivial when interactions lead to insulating behavior. For a deeper understanding of the Weyl-semimetal-to-Mott-insulator topological phase transition, we evaluate the topological properties of quasiparticle bands as well as so-called blind bands. Finally, we consider a system with an open boundary along one spatial direction in order to study correlation effects of surface states. In a narrow regime close to the topological phase transition, we find a correlation-induced state in which the surface becomes metallic while the bulk is semimetallic.

arXiv:2011.05100•Physical review. B./Physical review. B•Mar 15, 2021•10 citations
We discuss the appearance of quantum orders in the Hubbard model for interacting electrons, at half-filling. Such phases do not have local order parameters and need to be characterized by the quantum mechanical properties of their ground state. On one hand, we study the Mott transition from a metal to a spin liquid insulator in two dimensions, of potential relevance to some layered organic compounds. The correlation-driven transition occurs at fixed filling and involves fractionalization of the electron: upon entering the insulator, a Fermi surface of neutral spinons coupled to an internal gauge field emerges. We focus on the transport properties near the quantum critical point and find that the emergent gauge fluctuations play a key role in determining the universal scaling. Second, motivated by a class of three-dimensional transition metal oxides, the pyrochlore iridates, we study the interplay of non-trivial band topology and correlations. Building on the strong spin orbit coupling in these compounds, we construct a general microscopic Hubbard model and determine its mean-field phase diagram, which contains topological insulators, Weyl semimetals, axion insulators and various antiferromagnets. We also discuss the effects many-body correlations on theses phases. We close by examining a fractionalized topological insulator that combines the two main themes of the thesis: fractionalization and non-trivial band topology. Specifically, we study how the two-dimensional protected surface states of a topological Mott insulator interact with a three-dimensional emergent gauge field. Various correlation effects on observables are identified.
Abstract We present a T = 0 K renormalization group (RG) phase diagram for the electronic Hubbard model in two dimensions on the square lattice at half filling. The RG procedure treats quantum fluctuations in the single particle occupation number nonperturbatively via the unitarily decoupling of one electronic state at every RG step. The resulting phase diagram thus possesses the quantum fluctuation energy scale (ω) as one of its axes. A relation is derived between ω and the effective temperature scale upto which gapless, as well as emergent gapped phases can be obtained. We find that the normal and insulating phases of the half-filled Hubbard model correspond, for any on-site repulsion, to a marginal Fermi liquid normal phase and a topologically-ordered gapped Mott insulating liquid respectively. The marginal Fermi liquid is found to arise from singular forward scattering in directions normal to the nested Fermi surface, while singular backscattering events lead to Mott liquid state. The transition between these two phases involves passage through a pseudogapped phase bookended by Fermi surface topology-changing Lifshitz transitions. The pseudogap phase is observed to arise from the electronic differentiation encoded within the nested Fermi surface, and involves the gradual gapping of the Fermi surface from antinodes to nodes via charge and spin excitations that are mutually entangled. We obtain effective Hamiltonians for various phases, as well as wavefunctions for the low-energy many-body eigenstates of the Mott liquid. Benchmarking of the ground-state energy per particle and the double-occupancy fraction for the Mott liquid against existing numerical results yields excellent agreement. Presence of a Néel ordering symmetry-breaking perturbation in the RG leads to an antiferromagnetic spin-ordered charge insulating Mott state. Our results thus offer novel insights on a variety of aspects of the Mott–Hubbard problem, and can be extended to the doped system.
Strongly correlated electron systems have the potential to host very exoticphases of matter. In order to have relevance to real materials, this exoticphysics often must emerge from relatively simple models. The quantumwavefunctions which describe such phases may bear little resemblance to theoriginal microscopic models. In these cases a variety of complex analytictools often must be supplemented with controlled numerical calculations tofully understand the essential behavior of these models. In this dissertation,we study such quantum phases of matter and their relationship to real materials.We focus on three main problems. First, we explore the relationship betweenstrong spin-orbit coupling and spin liquid physics by studying a very generalmodel on the triangular lattice where spin-orbit coupling leads to the presenceof highly anisotropic interactions. We use variational Monte Carlo to study bothU(1) quantum spin liquid states and ordered ones, via the Gutzwiller projectedfermion construction. We thereby obtain the ground state phase diagram in thisphase space. We furthermore consider effects beyond the Gutzwiller wavefunctionsfor the spinon Fermi surface quantum spin liquid, which are of particularimportance when spin-orbit coupling is present.Second we show that the interplay between a high density two-dimensional electrongas and localized electrons in a neighboring Mott insulator leads to kineticmagnetism unique to the Mott/band insulator interface. Our study is based upona bilayer Hubbard model at U=inftyU=\\inftyU=infty with a potential difference between thetwo layers. We combine analytic results with DMRG simulations to show thatmagnetism, and especially kinetic ferromagnetism, is greatly enhanced relative by theproximity of the two subsystems. Third we study the effect of interactions on the properties of a model 2Dtopological Kondo insulator phase. We introduce a model Hamiltonian which webelieve captures the essential physics of the different competing phases.Perhaps the most dramatic example of many-body physics in symmetry protectedtopological phases is the existence of exotic gapless edge states. We comment onthe potentially dramatic effects that interactions can have on such edge states.
The interplay among symmetry, topology and condensed matter systems has deepened our understandings of matter and lead to tremendous recent progresses in finding new topological phases of matter such as topological insulators, superconductors and semi-metals. Most examples of the aforementioned topological materials are free fermion systems, in this thesis, however, we focus on their strongly correlated counterparts where electron-electron interactions play a major role. With interactions, exotic topological phases and quantum critical points with fractionalized quantum degrees of freedom emerge. In the first part of this thesis, we study the problem of resonant tunneling through a quantum dot in a spinful Luttinger liquid. It provides the simplest example of a (0+1)d system with symmetry-protected phase transitions. We show that the problem is equivalent to a two channel SU(3) Kondo problem and can be mapped to a quantum Brownian motion model on a Kagome lattice. Utilizing boundary conformal field theory, we find the universal peak conductance and compute the scaling behavior of the resonance line-shape.\nFor the second part, we present a model of interacting Majorana fermions that describes a superconducting phase with a topological order characterized by the Fibonacci topological field theory. Our theory is based on a SO(7)1=SO(7)1/(G2)1 x (G2)1 coset construction and implemented by a solvable two-dimensional network model. In addition, we predict a closely related ''anti-Fibonacci'' phase, whose topological order is characterized by the tricritical Ising model. Finally, we propose an interferometer that generalizes the Z2 Majorana interferometer and directly probes the Fibonacci non-Abelian statistics.\nFor the third part, we argue that a correlated fluid of electrons and holes can exhibit fractional quantum Hall effects at zero magnetic field. We first show that a Chern insulator can be realized as a free fermion model with p-wave(m=1) excitonic pairing. Its ground state wavefunction is then worked out and generalized to m>1. We give several pieces of evidence that this conjectured wavefunction correctly describes a topological phase, dubbed ''fractional excitonic insulator'', within the same universality class as the corresponding Laughlin state at filling 1/m. We present physical arguments that gapless states with higher angular momentum pairing between energy bands are conducive to forming the fractional excitonic insulator in the presence of repulsive interactions. Without interactions, these gapless states appear at topological phase transitions which separate the trivial insulator from a Chern insulator with higher Chern number. Since the nonvanishing density of states at these higher angular momentum band inversion transitions can give rise to interesting many-body effects, we introduce a series of minimal lattice models realizations in two dimensions. We also study the effect of rotational symmetry broken electron-hole exciton condensation in our lattice models using mean field theory.
We study superfluidity in strongly correlated systems by focusing three features as follows. First, interplay between superfluidity and other order parameters near quantum critical points is studied. The onset positions of the order parameters with or without superconductivity determines how they interact with each other. For the spin density wave (SDW) transition, we find that the quantum critical point shifts by order |∆|, where ∆ is pairing amplitude, so that the region of SDW order is smaller in the superconductor than in the metal. This shift is larger than the |∆|2 shift predicted by theories of competing orders which ignore Fermi surface effects. Second, we study a doped antiferromagnetic Mott insulator motivated by copper based high temperature superconductors. Based on spin and charge fractionalization, the algebraic charge liquid phase whose bosonic spinons have energy gap but fermionic holons form Fermi surfaces and its superconductivity are studied. We show fluctuations of local SDW order orientation lead to d-wave superconductivity, and its quantum critical pairing mechanisms are investigated. Also, a theory of bound states between spinons and holons is studied. We show that the fractionalization induces a doubling electron-like quasiparticles, which naturally induces the fractionalized Fermi liquid. The bound state theory describes exotic properties of the underdoped Cuprates such as “nodal-antinodal dichotomy” at a mean field level description. At last, we study superfluidity of fermions in optical lattices near the Feshbach resonance. Due to divergence of scattering length at the resonance, universality is observed and characteristics of superfluidity has been studied. We extend such universal properties by considering superfluid-insulator transition with an even integer number of fermions per unit cell. The resulting insulator interpolates between a band insulator of fermions and a Mott insulator of fermion pairs.
Materials with strongly correlated electrons show a multitude of unconventional phenomena, such as superconductivity or magnetism, that cannot be explained in a single-particle picture and necessitate to take many-body effects into account. A route to explain the origin of these phenomena consists in constructing effective models for these materials that are then solved, often using numerical techniques. Paradigmatic models for two different classes of strongly correlated electron systems are investigated in this thesis: The Hubbard model is a paradigmatic model to describe the Mott metal-insulator transition (MIT) and the Kondo lattice model describes the low-energy physics in heavy fermion compounds. Both models are analyzed numerically using different variations of a quantum cluster technique, the variational cluster approximation (VCA). The first part focuses on the MIT, as it is investigated experimentally in quasi-two-dimensional charge-transfer salts. Its nature and associated universality class are still heavily discussed and both experiments and theoretical approaches come to different conclusions. In this thesis, the Mott transition is investigated on an anisotropic two-dimensional Hubbard model at half-filling. By using a control parameter, which induces this anisotropy, strong evidence for Mott quantum criticality is found in weakly coupled Hubbard chains. The results at zero temperature show that the second-order critical end point Tc of the interaction-driven metal-insulator transition can be tuned down to zero at strong anisotropy. Further results for the antiferromagnetic phase suggest a similar picture and motivate adding the anisotropy as a new axis in the phase diagram to account for a low-temperature critical end point of the Mott transition. The second part of this thesis focuses on unconventional phases that emerge in a paradigmatic model for heavy fermion systems, the Kondo lattice model. Using the VCA, the two-dimensional Kondo lattice model is investigated in the paramagnetic phase as well as in phases with broken symmetry. An antiferromagnetic phase at weak coupling and a phase with Kondo-singlet formation at strong coupling are analyzed. Within the antiferromagnetically ordered region, two phases with different Fermi-surface topology, which are separated by a discontinuous transition, are identified. The model is also tested for s-wave superconductivity as found recently using dynamical mean-field theory, but no indications for robust local pairing are seen within VCA. Instead, nodal d-wave superconductivity is found and analyzed in a large range of couplings and electron fillings, and its interplay with antiferromagnetic order at weak coupling is discussed. This motivates further studies on extended models that might allow for a close comparison with experiments on heavy fermion systems. Understanding the formation of unconventional phases in strongly correlated electron systems is not only of fundamental interest, but it is also essential for designing new functional materials. Although the results of approximate cluster techniques have to be handled with care, the new aspects presented in this thesis pave the way for further investigations in this direction.
Weyl semimetals are three-dimensional, topologically protected, gapless phases which show exotic phenomena such as Fermi arc surface states or negative magnetoresistance. It is an open question whether interparticle interactions can turn the topological semimetal into a topologically nontrivial Mott-insulating phase. We investigate an experimentally motivated model for Weyl physics of cold atoms in optical lattices, with the main focus on interaction effects and topological properties, by means of dynamical mean-field theory. We characterize topological phases by numerically evaluating the Chern number via the Ishikawa-Matsuyama formula for interacting phases. Within our studies, we find that the Chern numbers become trivial when interactions lead to insulating behavior. For a deeper understanding of the Weyl-semimetal-to-Mott-insulator topological phase transition, we evaluate the topological properties of quasiparticle bands as well as so-called blind bands. Finally, we consider a system with an open boundary along one spatial direction in order to study correlation effects of surface states. In a narrow regime close to the topological phase transition, we find a correlation-induced state in which the surface becomes metallic while the bulk is semimetallic.