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arXiv:1511.00499 · Journal of Physics Conference Series

Frustrated Heisenberg antiferromagnet on the honeycomb lattice with spin quantum numbers≥ 1

P. H. Y. Li, R. F. Bishop, C. E. Campbell

Published Mar 1, 2016• 7 citations
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Abstract

The ground-state (GS) phase diagram of the frustrated spin- s J 1 -J 2 -J 3 Heisenberg antiferromagnet on the honeycomb lattice is studied using the coupled cluster method implemented to high orders of approximation, for spin quantum numbers s = 1, 3/2, 2 , 5/2. The model has antiferromagnetic (AFM) nearest-neighbour, next-nearest-neighbour and next-next-nearest-neighbour exchange couplings (with strength J 1 > 0, J 2 > 0 and J 3 > 0, respectively). We specifically study the case J 3 = J 2 = κJ 1 , in the range 0 < κ < 1 of the frustration parameter, which includes the point of maximum classical (s → ∞ ) frustration, viz., the classical critical point at κ cl = 1/2 , which separates the Neel phase for κ < κ cl and the collinear striped AFM phase for κ > κ cl . Results are presented for the GS energy, magnetic order parameter and plaquette valence-bond crystal (PVBC) susceptibility. For all spins s > 3/2 we find a quantum phase diagram very similar to the classical one, with a direct first-order transition between the two collinear AFM states at a value κ c (s) which is slightly greater than κ c l [e.g., κ c (3/2) ≈ 0.53(1)] and which approaches it monotonically as s → ∞ . By contrast, for the case s = 1 the transition is split into two such that the stable GS phases are one with Néel AFM order for κ < κ c1 = 0.485(5) and one with striped AFM order for κ > κ c2 = 0.528(5), just as in the case s = 1/2 (for which κ c1 ≈ 0.47 and κ c2 ≈ 0.60). For both the s = 1/2 and s = 1 models the transition at κ c2 appears to be of first-order type, while that at κ c1 appears to be continuous. However, whereas in the s = 1/2 case the intermediate phase appears to have PVBC order over the entire range κ c1 < κ < κ c2 , in the s = 1 case PVBC ordering either exists only over a very small part of the region or, more likely, is absent everywhere.

DOI
10.1088/1742-6596/702/1/012001

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The ground-state (GS) phase diagram of the frustrated spin- s J 1 -J 2 -J 3 Heisenberg antiferromagnet on the honeycomb lattice is studied using the coupled cluster method implemented to high orders of approximation, for spin quantum numbers s = 1, 3/2, 2 , 5/2. The model has antiferromagnetic (AFM) nearest-neighbour, next-nearest-neighbour and next-next-nearest-neighbour exchange couplings (with strength J 1 > 0, J 2 > 0 and J 3 > 0, respectively). We specifically study the case J 3 = J 2 = κJ 1 , in the range 0 < κ < 1 of the frustration parameter, which includes the point of maximum classical (s → ∞ ) frustration, viz., the classical critical point at κ cl = 1/2 , which separates the Neel phase for κ < κ cl and the collinear striped AFM phase for κ > κ cl . Results are presented for the GS energy, magnetic order parameter and plaquette valence-bond crystal (PVBC) susceptibility. For all spins s > 3/2 we find a quantum phase diagram very similar to the classical one, with a direct first-order transition between the two collinear AFM states at a value κ c (s) which is slightly greater than κ c l [e.g., κ c (3/2) ≈ 0.53(1)] and which approaches it monotonically as s → ∞ . By contrast, for the case s = 1 the transition is split into two such that the stable GS phases are one with Néel AFM order for κ < κ c1 = 0.485(5) and one with striped AFM order for κ > κ c2 = 0.528(5), just as in the case s = 1/2 (for which κ c1 ≈ 0.47 and κ c2 ≈ 0.60). For both the s = 1/2 and s = 1 models the transition at κ c2 appears to be of first-order type, while that at κ c1 appears to be continuous. However, whereas in the s = 1/2 case the intermediate phase appears to have PVBC order over the entire range κ c1 < κ < κ c2 , in the s = 1 case PVBC ordering either exists only over a very small part of the region or, more likely, is absent everywhere.
We use the coupled-cluster method in high orders of approximation to make a comprehensive study of the ground-state (GS) phase diagram of the spin-1/2 J1{J}_{1}J1​-J2{J}_{2}J2​-J3{J}_{3}J3​ model on a two-dimensional honeycomb lattice with antiferromagnetic (AFM) interactions up to third-nearest neighbors. Results are presented for the GS energy and the average local onsite magnetization. With the nearest-neighbor coupling strength ${J}_{1}\ensuremath{\equiv}1$, we find four magnetically ordered phases in the parameter window ${J}_{2},{J}_{3}\ensuremath{\in}[0,1]$, namely, the N\'eel, striped, and N\'eel-II collinear AFM phases, plus a spiral phase. The N\'eel-II phase appears as a stable GS phase in the classical version of the model only for values J3<0{J}_{3}<0J3​<0. Each of these four ordered phases shares a boundary with a disordered quantum paramagnetic (QP) phase, and at several widely separated points on the phase boundaries the QP phase has an infinite susceptibility to plaquette valence-bond crystalline order. We identify all of the phase boundaries with good precision in the parameter window studied, and we find three tricritical quantum critical points therein at (a) $({J}_{2}^{{c}_{1}},{J}_{3}^{{c}_{1}})=(0.51\ifmmode\pm\else\textpm\fi{}0.01,0.69\ifmmode\pm\else\textpm\fi{}0.01)$ between the N\'eel, striped, and QP phases; (b) $({J}_{2}^{{c}_{2}},{J}_{3}^{{c}_{2}})=(0.65\ifmmode\pm\else\textpm\fi{}0.02,0.55\ifmmode\pm\else\textpm\fi{}0.01)$ between the striped, spiral, and QP phases; and (c) $({J}_{2}^{{c}_{3}},{J}_{3}^{{c}_{3}})=(0.69\ifmmode\pm\else\textpm\fi{}0.01,0.12\ifmmode\pm\else\textpm\fi{}0.01)$ between the spiral, N\'eel-II, and QP phases.
We study the ground-state (gs) phase diagram of the frustrated spin-12\frac{1}{2}21​ J1{J}_{1}J1​--J2{J}_{2}J2​--J3{J}_{3}J3​ antiferromagnet with ${J}_{2}={J}_{3}=\ensuremath{\kappa}{J}_{1}$ on the honeycomb lattice using coupled-cluster theory and exact diagonalization methods. We present results for the gs energy, magnetic order parameter, spin-spin correlation function, and plaquette valence-bond crystal (PVBC) susceptibility. We find a N\'eel antiferromagnetic (AFM) phase for $\ensuremath{\kappa}<{\ensuremath{\kappa}}_{{c}_{1}}\ensuremath{\approx}0.47$, a collinear striped AFM phase for $\ensuremath{\kappa}>{\ensuremath{\kappa}}_{{c}_{2}}\ensuremath{\approx}0.60$, and a paramagnetic PVBC phase for ${\ensuremath{\kappa}}_{{c}_{1}}\ensuremath{\lesssim}\ensuremath{\kappa}\ensuremath{\lesssim}{\ensuremath{\kappa}}_{{c}_{2}}$. The transition at ${\ensuremath{\kappa}}_{{c}_{2}}$ appears to be of first-order type, while that at ${\ensuremath{\kappa}}_{{c}_{1}}$ is continuous. Since the N\'eel and PVBC phases break different symmetries our results favor the deconfinement scenario for the transition at ${\ensuremath{\kappa}}_{{c}_{1}}$.
We study the ground-state (GS) properties of the frustrated spin-12\frac{1}{2}21​ J1{J}_{1}J1​--J2{J}_{2}J2​--J3{J}_{3}J3​ Heisenberg model on the two-dimensional honeycomb lattice with ferromagnetic nearest-neighbor (${J}_{1}=\ensuremath{-}1$) exchange and frustrating antiferromagnetic next-nearest-neighbor (J2>0{J}_{2}>0J2​>0) and next-next-nearest-neighbor (J3>0{J}_{3}>0J3​>0) exchanges, for the case J3=J2{J}_{3}={J}_{2}J3​=J2​. We use the coupled-cluster method implemented to high orders of approximation, complemented by the Lanczos exact diagonalization of a large finite lattice with 32 sites, in order to calculate the GS energy, magnetic order parameter, and spin-spin correlation functions. In one scenario we find a quantum phase transition point between regions characterized by ferromagnetic order and a form of antiferromagnetic (``striped'') collinear order at ${J}_{2}^{c}\ensuremath{\approx}0.1095\ifmmode\pm\else\textpm\fi{}0.0005$, which is below the corresponding hypothetical transition point at J2cl=17{J}_{2}^{\mathrm{cl}}=\frac{1}{7}J2cl​=71​ ($\ensuremath{\approx}0.143$) for the classical version of the model, in which we momentarily ignore the intervening noncollinear spiral phase in the region 110<J2<15\frac{1}{10}<{J}_{2}<\frac{1}{5}101​<J2​<51​. Hence we see that quantum fluctuations appear to stabilize somewhat the collinear antiferromagnetic order in preference to the ferromagnetic order in this model. We compare results for the present ferromagnetic case (with ${J}_{1}=\ensuremath{-}1$) to previous results for the corresponding antiferromagnetic case (with J1=+1{J}_{1}=+1J1​=+1). The magnetic order parameter is found to behave similarly for the ferromagnetic and the antiferromagnetic models for large values of the frustration parameter J2{J}_{2}J2​. However, there are considerable differences in the behavior of the order parameters for the two models for ${J}_{2}/|{J}_{1}|\ensuremath{\lesssim}0.6$. For example, the quasiclassical collinear magnetic long-range order for the antiferromagnetic model (with J1=+1{J}_{1}=+1J1​=+1) breaks down at ${J}_{2}^{{c}_{2}}\ensuremath{\approx}0.60$, whereas the ``equivalent'' point for the ferromagnetic model (with ${J}_{1}=\ensuremath{-}1$) occurs at ${J}_{2}^{c}\ensuremath{\approx}0.11$. Unlike in the antiferromagnetic model (with J1=+1{J}_{1}=+1J1​=+1), where a plaquette valence-bond crystal phase intrudes between the two corresponding quasiclassical antiferromagnetic phases (with N\'eel and striped order) for J2c1<J2<J2c2{J}_{2}^{{c}_{1}}<{J}_{2}<{J}_{2}^{{c}_{2}}J2c1​​<J2​<J2c2​​, with ${J}_{2}^{{c}_{1}}\ensuremath{\approx}0.47$, we find no clear indications at all in the ferromagnetic model for an intermediate magnetically disordered phase between the corresponding phases exhibiting ferromagnetic and striped order. Instead the evidence for the ferromagnetic model (with ${J}_{1}=\ensuremath{-}1$) points to one of two scenarios: either there is a direct first-order transition between the two magnetically ordered phases, as mentioned above; or there exists an intervening phase between them in the very narrow range $0.10\ensuremath{\lesssim}{J}_{2}\ensuremath{\lesssim}0.12$, which is probably a remnant of the spiral phase that exists in the classical counterpart of the model over the larger range 110<J2<15\frac{1}{10}<{J}_{2}<\frac{1}{5}101​<J2​<51​.
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We study the zero-temperature quantum phase diagram of a spin-1 Heisenberg antiferromagnet on the honeycomb lattice with both nearest-neighbor exchange coupling J1>0{J}_{1}>0J1​>0 and frustrating next-nearest-neighbor coupling ${J}_{2}\ensuremath{\equiv}\ensuremath{\kappa}{J}_{1}>0$, using the coupled cluster method implemented to high orders of approximation, and based on model states with different forms of classical magnetic order. For each we calculate directly in the bulk thermodynamic limit both ground-state low-energy parameters (including the energy per spin, magnetic order parameter, spin stiffness coefficient, and zero-field uniform transverse magnetic susceptibility) and their generalized susceptibilities to various forms of valence-bond crystalline (VBC) order, as well as the energy gap to the lowest-lying spin-triplet excitation. In the range $0<\ensuremath{\kappa}<1$ we find evidence for four distinct phases. Two of these are quasiclassical phases with antiferromagnetic long-range order, one with two-sublattice N\'eel order for $\ensuremath{\kappa}<{\ensuremath{\kappa}}_{{c}_{1}}=0.250(5)$, and another with four-sublattice N\'eel-II order for $\ensuremath{\kappa}>{\ensuremath{\kappa}}_{{c}_{2}}=0.340(5)$. Two different paramagnetic phases are found to exist in the intermediate region. Over the range ${\ensuremath{\kappa}}_{{c}_{1}}<\ensuremath{\kappa}<{\ensuremath{\kappa}}_{c}^{i}=0.305(5)$ we find a gapless phase with no discernible magnetic order, which is a strong candidate for being a quantum spin liquid, while over the range ${\ensuremath{\kappa}}_{c}^{i}<\ensuremath{\kappa}<{\ensuremath{\kappa}}_{{c}_{2}}$ we find a gapped phase, which is most likely a lattice nematic with staggered dimer VBC order that breaks the lattice rotational symmetry.