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arXiv:cond-mat/0608446 · Journal of the Physical Society of Japan

Dimer-Quadrupolar Quantum Phase Transition in the Quasi-One-Dimensional Heisenberg Model with Biquadratic Interaction

Kenji Harada, Naoki Kawashima, Matthias Troyer

Published Dec 25, 2006• 40 citations
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Abstract

The quasi-one-dimensional S=1 Heisenberg antiferromagnet with a biquadratic term is investigated at zero temperature by quantum Monte Carlo simulation. As the magnitude of the inter-chain coupling is increased, the system undergoes a phase transition from a spontaneously dimerized phase to a Néel ordered or spin nematic phase. The numerical results suggest the possibility of an unconventional second-order transition in which the symmetry group characterizing one phase is not a subgroup of the other.

DOI
10.1143/jpsj.76.013703

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The quasi-one-dimensional S=1 Heisenberg antiferromagnet with a biquadratic term is investigated at zero temperature by quantum Monte Carlo simulation. As the magnitude of the inter-chain coupling is increased, the system undergoes a phase transition from a spontaneously dimerized phase to a Néel ordered or spin nematic phase. The numerical results suggest the possibility of an unconventional second-order transition in which the symmetry group characterizing one phase is not a subgroup of the other.
The spin-Peierls transition in the ground state of a quasi-one-dimensional spin-1/2 Heisenberg model coupled to adiabatic bond phonons is studied using a quantum Monte Carlo (QMC) method. The transition from a gapless Neel state to a spin-gapped Peierls state is explored in the parameter space spanned by the spatial anisotropy and the strength of spin-lattice coupling. It is found that for any finite inter-chain coupling, the transition to a dimerized Peierls ground state occurs only when the spin-lattice coupling exceeds a finite, non-zero critical value. This is in contrast to the pure 1D model, where adiabatic phonons lead to a dimerized ground state for any non-zero spin-phonon coupling. The phase diagram in the above parameter space is mapped out. No evidence is found for a region of co-existing long range magnetic order and dimerization. The vanishing of the Neel order occurs simultaneously with the setting in of the dimerization.
The zero and finite temperature spin-Peierls transitions in a quasi-one-dimensional spin-12\frac{1}{2}21​ Heisenberg model coupled to adiabatic bond phonons is investigated using the stochastic series expansion (SSE) quantum Monte Carlo (QMC) method. The quantum phase transition from a gapless N\'eel state to a spin-gapped Peierls state is studied in the parameter space spanned by spatial anisotropy, interchain coupling strength, and spin-lattice coupling strength. It is found that for any finite interchain coupling, the transition to a dimerized Peierls ground state only occurs when the spin-lattice coupling exceeds a finite, nonzero critical value. This is in contrast to the pure 1D model (zero interchain coupling), where adiabatic/classical phonons lead to a dimerized ground state for any nonzero spin-phonon interaction. The phase diagram in the parameter space shows that for a strong interchain coupling, the relation between the interchain coupling and the critical value of the spin-phonon interaction is linear whereas for weak interchain coupling, this behavior is found to have a natural logarithmlike relation. No region was found to have a long range magnetic order and dimerization occurring simultaneously. Instead, the N\'eel state order vanishes simultaneously with the setting in of the spin-Peierls state. For the thermal phase transition, a continuous heat capacity with a peak at the critical temperature Tc{T}_{c}Tc​ shows a second order phase transition. The variation of the equilibrium bond length distortion ${\ensuremath{\delta}}_{eq}$ with temperature showed a power law relation which decayed to zero as the temperature was increased to Tc{T}_{c}Tc​, indicating a continuous transition from the dimerized phase to a paramagnetic phase with uniform bond length and zero antiferromagnetic susceptibility.
Nematic order is an exotic property observed in several strongly correlated systems, such as iron-based superconductors. Using large-scale density matrix renormalization group (DMRG) techniques, we study at zero temperature the nematic spin liquid that competes with spin dipolar and quadrupolar orders. We use these nematic orders to characterize different quantum phases and quantum phase transitions. More specifically, we study a spin-1 bilinear-biquadratic Heisenberg model on the square lattice with couplings beyond nearest neighbors. We focus on parameter regions around the highly symmetric SU(3)SU(3)SU(3) point where the bilinear and biquadratic interactions are equal. With growing further-neighbor biquadratic interactions, we identify different spin dipolar and quadrupolar orders. We find that the DMRG results for cylindrical geometries correctly detect nematicity in different quantum states and accurately characterize the quantum phase transitions among them. Therefore, spin-driven nematicity, here defined as the spontaneous breaking of the lattice invariance under a ${90}^{\ensuremath{\circ}}$ rotation, is an order parameter which can be studied directly in DMRG calculations in two dimensions in different quantum states.
The quantum phase transition between a spin gap state and an antiferromagnetic phase is investigated. We study S =1/2 antiferromagnetic Heisenberg chains coupled by antiferromagnetic interchain interaction. The intrachain exchanges have alternating strength. The phase boundary between the antiferromagnetically ordered phase and a spin gap phase is also obtained in a parameter space of the amplitude of the interchain coupling and the dimerization. The spin-wave approximation substantially overestimates the antiferromagnetic phase. The competition between the long range order and the spin gap is examined in detail. We estimate a variety of critical exponents at the transition, namely, exponents ν, θ and z defined as the exponent of the correlation length, the magnetization curve and the dynamical exponent, respectively. From the quantum Monte Carlo simulation, the exponents ν, θ and z are estimated to be unity. The exponents ν and θ are different from the estimated values in one dimension. It suggests that the universality changes due to the dimensionality change. In our estimates, the exponent ν does not agree with the prediction from three dimensional classical Heisenberg model. We also discuss the relevance of our result to spin-Peierls systems with lattice distortion.
We study numerically the ground-state phase diagram of the bilinear-biquadratic spin-1 chain near the ferromagnetic instability point, where the existence of a gapped or gapless nondimerized quantum nematic phase has been suggested. Our results, obtained by a highly accurate density-matrix renormalization-group calculation, are consistent with the view that the order parameter characterizing the dimer phase vanishes only at the point where the system becomes ferromagnetic, although the existence of a gapped or gapless nondimerized phase in a very narrow parameter range between the ferromagnetic and the dimerized regimes cannot be ruled out.