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arXiv:cond-mat/0401604 · Journal of Physics Condensed Matter

The influence of Ising anisotropy on the zero-temperature phase transition in the square lattice spin-½J–J model

R. Darradi, Johannes Richter, Sven E. Krüger

Published Apr 2, 2004• 13 citations
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Abstract

We use a variational mean-field-like approach, the coupled cluster method (CCM), and exact diagonalization to investigate the ground-state order–disorder transition for the square lattice spin-half XXZ model with two different nearest-neighbour couplings J and . On increasing the model shows in the isotropic Heisenberg limit a second-order transition from semi-classical Néel order to a quantum paramagnetic phase with enhanced local dimer correlations on the bonds at about . This transition is driven by the quantum competition between and J . On increasing the anisotropy parameter Δ>1 we diminish the quantum fluctuations and thus the degree of competition. As a result the transition point is shifted to larger values. We find indications for a linear increase of with Δ, i.e. the transition disappears in the Ising limit .

DOI
10.1088/0953-8984/16/15/019

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We use a variational mean-field-like approach, the coupled cluster method (CCM), and exact diagonalization to investigate the ground-state order–disorder transition for the square lattice spin-half XXZ model with two different nearest-neighbour couplings J and . On increasing the model shows in the isotropic Heisenberg limit a second-order transition from semi-classical Néel order to a quantum paramagnetic phase with enhanced local dimer correlations on the bonds at about . This transition is driven by the quantum competition between and J . On increasing the anisotropy parameter Δ>1 we diminish the quantum fluctuations and thus the degree of competition. As a result the transition point is shifted to larger values. We find indications for a linear increase of with Δ, i.e. the transition disappears in the Ising limit .
We investigate the phase diagram of the Heisenberg antiferromagnet on the square lattice with two different nearest-neighbour bonds J and J' ( J – J' model) at zero temperature. The model exhibits a quantum phase transition at a critical value between a semi-classically ordered Néel and a magnetically disordered quantum paramagnetic phase of valence-bond type, which is driven by local singlet formation on J' bonds. We study the influence of spin quantum number s on this phase transition by means of a variational mean-field approach, the coupled cluster method and the Lanczos exact-diagonalization technique. We present evidence that the critical value increases with growing s according to .
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Using the coupled-cluster method for infinite lattices and the exact diagonalization method for finite lattices, we study the influence of an exchange anisotropy Δ on the ground-state phase diagram of the spin-1/2 frustrated J 1 - J 2 XXZ antiferromagnet on the square lattice. We find that increasing Δ > 1 (i.e. an Ising type easy-axis anisotropy) as well as decreasing Δ < 1 (i.e. an XY type easy-plane anisotropy) both lead to a monotonic shrinking of the parameter region of the magnetically disordered quantum phase. Finally, at Δ c ≈ 1.9 this quantum phase disappears, whereas in the pure XY limit (Δ = 0) there is still a narrow region around J 2 = 0.5 J 1 where the quantum paramagnetic ground-state phase exists.
We study the zero-temperature phase diagram and the low-lying excitations of a square-lattice spin-half Heisenberg antiferromagnet with two types of regularly distributed nearest-neighbor exchange bonds [J>0[J>0[J>0 (antiferromagnetic) and $\ensuremath{-}\ensuremath{\infty}<{J}^{\ensuremath{'}}<\ensuremath{\infty}]$ using the coupled cluster method (CCM) for high orders of approximation (up to LSUB8). We use a N\'eel model state as well as a helical model state as a starting point for the CCM calculations. We find a second-order transition from a phase with N\'eel order to a finite-gap quantum disordered phase for sufficiently large antiferromagnetic exchange constants ${J}^{\ensuremath{'}}>0.$ For frustrating ferromagnetic couplings ${J}^{\ensuremath{'}}<0$ we find indications that quantum fluctuations favor a first-order phase transition from the N\'eel order to a quantum helical state, by contrast with the corresponding second-order transition in the corresponding classical model. The results are compared to those of exact diagonalizations of finite systems (up to 32 sites) and those of spin-wave and variational calculations. The CCM results agree well with the exact diagonalization data over the whole range of the parameters. The special case of ${J}^{\ensuremath{'}}=0,$ which is equivalent to the honeycomb lattice, is treated more closely.
We study the zero-temperature phase diagram of the two-dimensional quantum J1XXZ−−J2XXZ{J}_{1}^{XXZ}--{J}_{2}^{XXZ}J1XXZ​−−J2XXZ​ spin-1/2 anisotropic Heisenberg model on the square lattice. In particular, the effects of the anisotropy $\ensuremath{\Delta}$ on the zzz-aligned N\'eel and (collinear) stripe states, as well as on the xyxyxy-planar-aligned N\'eel and collinear stripe states, are examined. All four of these quasiclassical states are chosen in turn as model states, on top of which we systematically include the quantum correlations using a coupled cluster method analysis carried out to very high orders. We find strong evidence for two quantum triple points (QTPs) at $({\ensuremath{\Delta}}^{c}=\ensuremath{-}0.10\ifmmode\pm\else\textpm\fi{}0.15,\text{ }{J}_{2}^{c}/{J}_{1}=0.505\ifmmode\pm\else\textpm\fi{}0.015)$ and $({\ensuremath{\Delta}}^{c}=2.05\ifmmode\pm\else\textpm\fi{}0.15,\text{ }{J}_{2}^{c}/{J}_{1}=0.530\ifmmode\pm\else\textpm\fi{}0.015)$, between which an intermediate magnetically disordered phase emerges to separate the quasiclassical N\'eel and stripe collinear phases. Above the upper QTP $(\ensuremath{\Delta}\ensuremath{\gtrsim}2.0)$ we find a direct first-order phase transition between the N\'eel and stripe phases, exactly as for the classical case. The zzz-aligned and xyxyxy-planar-aligned phases meet precisely at $\ensuremath{\Delta}=1$, also as for the classical case. For all values of the anisotropy parameter between those of the two QTPs there exists a narrow range of values of J2/J1{J}_{2}/{J}_{1}J2​/J1​, ${\ensuremath{\alpha}}^{{c}_{1}}(\ensuremath{\Delta})<{J}_{2}/{J}_{1}<{\ensuremath{\alpha}}^{{c}_{2}}(\ensuremath{\Delta})$, centered near the point of maximum classical frustration, J2/J1=12{J}_{2}/{J}_{1}=\frac{1}{2}J2​/J1​=21​, for which the intermediate phase exists. This range is widest precisely at the isotropic point, $\ensuremath{\Delta}=1$, where ${\ensuremath{\alpha}}^{{c}_{1}}(1)=0.44\ifmmode\pm\else\textpm\fi{}0.01$ and ${\ensuremath{\alpha}}^{{c}_{2}}(1)=0.59\ifmmode\pm\else\textpm\fi{}0.01$. The two QTPs are characterized by values $\ensuremath{\Delta}={\ensuremath{\Delta}}^{c}$ at which ${\ensuremath{\alpha}}^{{c}_{1}}({\ensuremath{\Delta}}^{c})={\ensuremath{\alpha}}^{{c}_{2}}({\ensuremath{\Delta}}^{c})$.
Interest in lattice quantum spin systems as models of quantum magnets has increased with the discovery of new and interesting magnetic materials. Here we use a well-known technique of quantum many-body theory, namely the coupled-cluster method (CCM), to investigate the nearest-neighbour, spin-½, anisotropic Heisenberg model on the square lattice. Ground-state expectation values for quantities such as the ground-state energy and the sublattice magnetisation are determined to an accuracy comparable with that of the best of other available techniques including Monte Carlo methods. In order to demonstrate this point we present results for various values of the anisotropy parameter, including those for the isotropic Heisenberg model and the isotropic XY model. We show that it is now possible to determine the presence and position of the quantum phase transitions using ab initio CCM calculations, and furthermore that we can accurately predict the critical behaviour at these points.