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arXiv:1402.6277 · Physical Review B

Antiferromagnetic critical point on graphene's honeycomb lattice: A functional renormalization group approach

Lukas Janssen, Igor F. Herbut

Published May 6, 2014• 126 citations
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Abstract

Electrons on the half-filled honeycomb lattice are expected to undergo a direct continuous transition from the semimetallic into the antiferromagnetic insulating phase with increase of onsite Hubbard repulsion. We attempt to further quantify the critical behavior at this quantum phase transition by means of functional renormalization group (RG), within an effective Gross-Neveu-Yukawa theory for an $\mathrm{SO}(3)$ order parameter (``chiral Heisenberg universality class''). Our calculation yields an estimate of the critical exponents $\ensuremath{\nu}\ensuremath{\simeq}1.31$, ${\ensuremath{\eta}}_{\ensuremath{\phi}}\ensuremath{\simeq}1.01$, and ${\ensuremath{\eta}}_{\ensuremath{\Psi}}\ensuremath{\simeq}0.08$, in reasonable agreement with the second-order expansion around the upper critical dimension. To test the validity of the present method, we use the conventional Gross-Neveu-Yukawa theory with ${\mathbb{Z}}_{2}$ order parameter (``chiral Ising universality class'') as a benchmark system. We explicitly show that our functional RG approximation in the sharp-cutoff scheme becomes one-loop exact both near the upper as well as the lower critical dimension. Directly in $2+1$ dimensions, our chiral Ising results agree with the best available predictions from other methods within the single-digit percent range for $\ensuremath{\nu}$ and ${\ensuremath{\eta}}_{\ensuremath{\phi}}$ and the double-digit percent range for ${\ensuremath{\eta}}_{\ensuremath{\Psi}}$. While one would expect a similar performance of our approximation in the chiral Heisenberg universality class, discrepancies with the results of other calculations here are more significant. Discussion and summary of various approaches is presented.

DOI
10.1103/physrevb.89.205403

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Electrons on the half-filled honeycomb lattice are expected to undergo a direct continuous transition from the semimetallic into the antiferromagnetic insulating phase with increase of onsite Hubbard repulsion. We attempt to further quantify the critical behavior at this quantum phase transition by means of functional renormalization group (RG), within an effective Gross-Neveu-Yukawa theory for an SO(3)\mathrm{SO}(3)SO(3) order parameter (chiral Heisenberg universality class''). Our calculation yields an estimate of the critical exponents $\ensuremath{\nu}\ensuremath{\simeq}1.31$, ${\ensuremath{\eta}}_{\ensuremath{\phi}}\ensuremath{\simeq}1.01$, and ${\ensuremath{\eta}}_{\ensuremath{\Psi}}\ensuremath{\simeq}0.08$, in reasonable agreement with the second-order expansion around the upper critical dimension. To test the validity of the present method, we use the conventional Gross-Neveu-Yukawa theory with ${\mathbb{Z}}_{2}$ order parameter (chiral Ising universality class'') as a benchmark system. We explicitly show that our functional RG approximation in the sharp-cutoff scheme becomes one-loop exact both near the upper as well as the lower critical dimension. Directly in 2+12+12+1 dimensions, our chiral Ising results agree with the best available predictions from other methods within the single-digit percent range for \ensuremathν\ensuremath{\nu}\ensuremathν and \ensuremathη\ensuremathϕ{\ensuremath{\eta}}_{\ensuremath{\phi}}\ensuremathη\ensuremathϕ​ and the double-digit percent range for \ensuremathη\ensuremathΨ{\ensuremath{\eta}}_{\ensuremath{\Psi}}\ensuremathη\ensuremathΨ​. While one would expect a similar performance of our approximation in the chiral Heisenberg universality class, discrepancies with the results of other calculations here are more significant. Discussion and summary of various approaches is presented.
The Gross-Neveu-Heisenberg universality class describes a continuous quantum phase transition between a Dirac semimetal and an antiferromagnetic insulator. Such quantum critical points have originally been discussed in the context of Hubbard models on $\ensuremath{\pi}$-flux and honeycomb lattices, but more recently also in Bernal-stacked bilayer models, of potential relevance for bilayer graphene. Here, we demonstrate how the critical behavior of this fermionic universality class can be computed within an $\ensuremath{\epsilon}$ expansion around the lower critical space-time dimension of two. This approach is complementary to the previously studied expansion around the upper critical dimension of four. The crucial technical difference near the lower critical dimension is the presence of different four-fermion interaction channels at the critical point, which we take into account in a Fierz-complete way. By interpolating between the lower and upper critical dimensions, we obtain improved estimates for the critical exponents in 2+12+12+1 space-time dimensions. For the situation relevant to single-layer graphene, we find an unusually small leading-correction-to-scaling exponent, arising from the competition between different interaction channels. This suggests that corrections to scaling may need to be taken into account when comparing analytical estimates with numerical data from finite-size extrapolations.
We perform large-scale quantum Monte Carlo simulations of the Hubbard model at half filling with a single Dirac cone close to the critical point, which separates a Dirac semimetal from an antiferromagnetically ordered phase where SU(2) spin rotational symmetry is spontaneously broken. We discuss the implementation of a single Dirac cone in the SLAC formulation for eight Dirac components and the influence of dynamically induced long-range superexchange interactions. The finite-size behavior of dimensionless ratios and the finite-size scaling properties of the Hubbard model with a single Dirac cone are shown to be superior compared to the honeycomb lattice. We extract the critical exponent believed to belong to the chiral Heisenberg Gross-Neveu-Yukawa universality class: the critical exponent ν = 1.02 ( 3 ) coincides for the two lattice types once honeycomb lattices of linear dimension L > 15 are considered. In contrast to the SLAC formulation, where the anomalous dimensions are estimated to be η ϕ = 0.73 ( 1 ) and η ψ = 0.09 ( 1 ) , they remain less stable on honeycomb lattices, but tend towards the estimates from the SLAC formulation.
Wilson–Fisher expansion near upper critical dimension has proven to be an invaluable conceptual and computational tool in our understanding of the universal critical behavior in the [Formula: see text] field theories that describe low-energy physics of the canonical models, such as Ising, XY, and Heisenberg. Here, I review its application to a class of the Gross–Neveu–Yukawa (GNY) field theories, which emerge as possible universal description of a number of quantum phase transitions in electronic two-dimensional systems such as graphene and d-wave superconductors. GNY field theories may be viewed as minimal modifications of the [Formula: see text] field theories in which the order parameter is coupled to relativistic Dirac fermions through Yukawa term and which still exhibit critical fixed points in the suitably formulated Wilson–Fisher [Formula: see text]-expansion. I discuss the unified GNY field theory for a set of different symmetry-breaking patterns, with focus on the semimetal-Néel-ordered-Mott insulator quantum phase transition in the half-filled Hubbard model on the honeycomb lattice, for which a comparison between the state-of-the-art [Formula: see text]-expansion, quantum Monte Carlo, large N, and functional renormalization-group calculations can be made.
We numerically investigate the critical behavior of the Hubbard model on the honeycomb and the $\ensuremath{\pi}$-flux lattice, which exhibits a direct transition from a Dirac semimetal to an antiferromagnetically ordered Mott insulator. We use projective auxiliary-field quantum Monte Carlo simulations and a careful finite-size scaling analysis that exploits approximately improved renormalization-group-invariant observables. This approach, which is successfully verified for the three-dimensional XY transition of the Kane-Mele-Hubbard model, allows us to extract estimates for the critical couplings and the critical exponents. The results confirm that the critical behavior for the semimetal to Mott insulator transition in the Hubbard model belongs to the Gross-Neveu-Heisenberg universality class on both lattices.
Fermionic quantum criticality in honeycomb and π\piπ-flux Hubbard models
We numerically investigate the critical behavior of the Hubbard model on the honeycomb and the π\piπ-flux lattice, which exhibits a direct transition from a Dirac semimetal to an antiferromagnetically ordered Mott insulator. We use projective auxiliary-field quantum Monte Carlo simulations and a careful finite-size scaling analysis that exploits approximately improved renormalization-group-invariant observables. This approach, which is successfully verified for the three-dimensional XY transition of the Kane-Mele-Hubbard model, allows us to extract estimates for the critical couplings and the critical exponents. The results confirm that the critical behavior for the semimetal to Mott insulator transition in the Hubbard model belongs to the Gross-Neveu-Heisenberg universality class on both lattices.
The Hubbard model on the honeycomb lattice undergoes a quantum phase transition from a semimetallic to a Mott insulating phase and from a disordered to an anti-ferromagnetically phase. We show that these transitions occur simultaneously and we calculate the critical coupling Uc=3.835(14)U_c=3.835(14)Uc​=3.835(14) as well as the critical exponents ν=1.181(43)\nu=1.181(43)ν=1.181(43) and β=0.898(37)\beta= 0.898(37)β=0.898(37) which are expected to fall into the SU(2)SU(2)SU(2) Gross-Neveu universality class. For this we employ Hybrid Monte Carlo simulations, extrapolate the single particle gap and the spin structure factors to the thermodynamic and continuous time limits, and perform a data collapse fit. We also determine the zero temperature values of single particle gap and staggered magnetisation on both sides of the phase transition.