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arXiv:1302.1408 · Physical Review Letters

Néel-State to Valence-Bond-Solid Transition on the Honeycomb Lattice: Evidence for Deconfined Criticality

Sumiran Pujari, Kedar Damle, Fabien Alet

Published Aug 21, 2013• 114 citations
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Abstract

We study a spin-1/2 SU(2) model on the honeycomb lattice with nearest-neighbor antiferromagnetic exchange J that favors Néel order and competing six-spin interactions Q that favor a valence-bond-solid (VBS) state in which the bond energies order at the "columnar" wave vector K=(2π/3,-2π/3). We present quantum Monte Carlo evidence for a direct continuous quantum phase transition between Néel and VBS states, with exponents and logarithmic violations of scaling consistent with those at analogous deconfined critical points on the square lattice. Although this strongly suggests a description in terms of deconfined criticality, the measured threefold anisotropy of the phase of the VBS order parameter shows unusual near-marginal behavior at the critical point.

DOI
10.1103/physrevlett.111.087203

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We study a spin-1/2 SU(2) model on the honeycomb lattice with nearest-neighbor antiferromagnetic exchange J that favors Néel order and competing six-spin interactions Q that favor a valence-bond-solid (VBS) state in which the bond energies order at the "columnar" wave vector K=(2π/3,-2π/3). We present quantum Monte Carlo evidence for a direct continuous quantum phase transition between Néel and VBS states, with exponents and logarithmic violations of scaling consistent with those at analogous deconfined critical points on the square lattice. Although this strongly suggests a description in terms of deconfined criticality, the measured threefold anisotropy of the phase of the VBS order parameter shows unusual near-marginal behavior at the critical point.
We use quantum Monte Carlo methods to study the ground-state phase diagram of a S=1/2S=1/2S=1/2 honeycomb lattice magnet in which a nearest-neighbor antiferromagnetic exchange JJJ (favoring N\'eel order) competes with two different multispin interaction terms: a six-spin interaction Q3{Q}_{3}Q3​ that favors columnar valence-bond solid (VBS) order, and a four-spin interaction Q2{Q}_{2}Q2​ that favors staggered VBS order. For ${Q}_{3}\ensuremath{\sim}{Q}_{2}\ensuremath{\gg}J$, we establish that the competition between the two different VBS orders stabilizes N\'eel order in a large swath of the phase diagram even when JJJ is the smallest energy scale in the Hamiltonian. When ${Q}_{3}\ensuremath{\gg}({Q}_{2},J)$ $\mathrm{[}{Q}_{2}\ensuremath{\gg}({Q}_{3},J)\text{]}$, this model exhibits at zero temperature phase transition from the N\'eel state to a columnar (staggered) VBS state. We establish that the N\'eel-columnar VBS transition is continuous for all values of Q2{Q}_{2}Q2​, and that critical properties along the entire phase boundary are well characterized by critical exponents and amplitudes of the noncompact CP1{\mathrm{CP}}^{1}CP1 (NCCP1)({\mathrm{NCCP}}^{1})(NCCP1) theory of deconfined criticality, similar to what is observed on a square lattice. However, a surprising threefold anisotropy of the phase of the VBS order parameter at criticality, whose presence was recently noted at the Q2=0{Q}_{2}=0Q2​=0 deconfined critical point, is seen to persist all along this phase boundary. We use a classical analogy to explore this by studying the critical point of a three-dimensional XYXYXY model with a fourfold anisotropy field which is known to be weakly irrelevant at the three-dimensional XYXYXY critical point. In this case, we again find that the critical anisotropy appears to saturate to a nonzero value over the range of sizes accessible to our simulations.
We study the N\'eel to fourfold columnar valence bond solid (cVBS) quantum phase transition in a sign-free S=1S=1S=1 square-lattice model. This is the same kind of transition that for S=1/2S=1/2S=1/2 has been argued to realize the prototypical deconfined critical point. Extensive numerical simulations of the square-lattice S=1/2S=1/2S=1/2 N\'eel-VBS transition have found consistency with the deconfined critical point scenario with no direct evidence for first-order behavior. In contrast to the S=1/2S=1/2S=1/2 case, in our quantum Monte Carlo simulations for the S=1S=1S=1 model, we present unambiguous evidence for a direct conventional first-order quantum phase transition. Classic signs of a first-order transition demonstrating coexistence including double-peaked histograms and switching behavior are observed. The sharp contrast from the S=1/2S=1/2S=1/2 case is remarkable; we hypothesize that this is a striking demonstration of the role of the size of the quantum spin in the phase diagram of two-dimensional lattice models.
Abstract Berry phase interference arguments that underlie the theory of deconfined quantum criticality (DQC) for S = 1 / 2 antiferromagnets have also been invoked to allow for continuous transitions in S = 1 magnets including a Néel to (columnar) valence bond solid (cVBS) transition. We provide a microscopic model realization of this transition on the square lattice consisting of Heisenberg exchange ( J H ) and biquadratic exchange ( J B ) that favor a Néel phase, and a designed Q -term ( Q B ) interaction which favors a cVBS through large-scale quantum Monte Carlo (QMC) simulations. For J H = 0 , this model is equivalent to the SU(3) JQ model with a Néel-cVBS transition that has been argued to be DQC through QMC. Upon turning on J H which brings down the symmetry to SU(2), we find multiple signatures—a single critical point, high quality collapse of correlation ratios and order parameters, ‘U(1)-symmetric’ cVBS histograms and lack of double-peak in order parameter histograms for largest sizes studied near the critical point—that are highly suggestive of a continuous transition scenario. However, Binder analysis finds negative dips that grow sub-extensively that we interpret as these transitions rather being pseudocritical. This, along with recent results on spin- 1 2 models, suggests that deconfined pseudocriticality is the more generic scenario.
We generalize the SU(N=2) S=1/2 square-lattice quantum magnet with nearest-neighbor antiferromagnetic coupling (J(1)) and next-nearest-neighbor ferromagnetic coupling (J(2)) to arbitrary N. For all N>4, the ground state has valence-bond-solid order for J(2)=0 and Néel order for J(2)/J(1)≫1, allowing us access to the transition between these types of states for large N. Using quantum Monte Carlo simulations, we show that both order parameters vanish at a single quantum-critical point, whose universal exponents for large enough N (here up to N=12) approach the values obtained in a 1/N expansion of the noncompact CP(N-1) field theory. These results lend strong support to the deconfined quantum-criticality theory of the Néel-valence-bond-solid transition.
We present an extensive quantum Monte Carlo study of the Néel to valence-bond solid (VBS) phase transition on rectangular- and honeycomb-lattice SU(N) antiferromagnets in sign-problem-free models. We find that in contrast to the honeycomb lattice and previously studied square-lattice systems, on the rectangular lattice for small N, a first-order Néel-VBS transition is realized. On increasing N≥4, we observe that the transition becomes continuous and with the same universal exponents as found on the honeycomb and square lattices (studied here for N=5, 7, 10), providing strong support for a deconfined quantum critical point. Combining our new results with previous numerical and analytical studies, we present a general phase diagram of the stability of CPN-1 fixed points with q monopoles.
Using ground-state projector quantum Monte Carlo simulations in the valence-bond basis, it is demonstrated that nonfrustrating four-spin interactions can destroy the Néel order of the two-dimensional S=1/2 Heisenberg antiferromagnet and drive it into a valence-bond solid (VBS) phase. Results for spin and dimer correlations are consistent with a single continuous transition, and all data exhibit finite-size scaling with a single set of exponents, z=1, nu=0.78+/-0.03, and eta=0.26+/-0.03. The unusually large eta and an emergent U(1) symmetry, detected using VBS order parameter histograms, provide strong evidence for a deconfined quantum critical point.