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arXiv:1605.05848 · Physical review. B./Physical review. B

Linked-cluster expansions for quantum magnets on the hypercubic lattice

K. Coester, Darshan G. Joshi, Matthias Vojta C, Kai Phillip Schmidt

Published Sep 6, 2016• 17 citations
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Abstract

For arbitrary space dimension $d$, we investigate the quantum phase transitions of two paradigmatic spin models defined on a hypercubic lattice, the coupled-dimer Heisenberg model and the transverse-field Ising model. To this end, high-order linked-cluster expansions for the ground-state energy and the one-particle gap are performed up to order 9 about the decoupled-dimer and high-field limits, respectively. Extrapolations of the high-order series yield the location of the quantum phase transition and the correlation-length exponent $\ensuremath{\nu}$ as a function of space dimension $d$. The results are complemented by $1/d$ expansions to next-to-leading order of observables across the phase diagrams. Remarkably, our analysis of the extrapolated linked-cluster expansion allows to extract the coefficients of the full $1/d$ expansion for the phase-boundary location in both models exactly in leading order and quantitatively for subleading corrections.

DOI
10.1103/physrevb.94.125109

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For arbitrary space dimension ddd, we investigate the quantum phase transitions of two paradigmatic spin models defined on a hypercubic lattice, the coupled-dimer Heisenberg model and the transverse-field Ising model. To this end, high-order linked-cluster expansions for the ground-state energy and the one-particle gap are performed up to order 9 about the decoupled-dimer and high-field limits, respectively. Extrapolations of the high-order series yield the location of the quantum phase transition and the correlation-length exponent \ensuremathν\ensuremath{\nu}\ensuremathν as a function of space dimension ddd. The results are complemented by 1/d1/d1/d expansions to next-to-leading order of observables across the phase diagrams. Remarkably, our analysis of the extrapolated linked-cluster expansion allows to extract the coefficients of the full 1/d1/d1/d expansion for the phase-boundary location in both models exactly in leading order and quantitatively for subleading corrections.
We use linked-cluster expansions to analyze the quantum phase transitions between symmetry-unbroken trivial and topological Haldane phases in two different spin-one chains. The first model is the spin-one Heisenberg chain in the presence of a single-ion anisotropy, while the second one is the dimerized spin-one Heisenberg chain. For both models, we determine the ground-state energy and the one-particle gap inside the nontopological phase as a high-order series using perturbative continuous unitary transformations. Extrapolations of the gap series are applied to locate the quantum critical point and to extract the associated critical exponent. We find that this approach works unsatisfactorily for the anisotropic chain, since the quality of the extrapolation appears insufficient due to the large correlation length exponent. In contrast, extrapolation schemes display very good convergence for the gap closing in the case of the dimerized spin-one Heisenberg chain.
In the study of strongly interacting condensed-matter systems controlled microscopic theories hold a key position. Spin-wave theory, large-N expansion, and epsilonepsilonepsilon-expansion are some of the few successful cornerstones. In this doctoral thesis work, we have developed a novel large-ddd expansion method, ddd being the spatial dimension, to study model Hamiltonians hosting a quantum phase transition between a paramagnet and a magnetically ordered phase. A highlight of this technique is that it can consistently describe the entire phase diagram of the above mentioned models, including the quantum critical point. Note that most analytical techniques either efficiently describe only one of the phases or suffer from divergences near the critical point. The idea of large-ddd formalism is that in this limit, non-local fluctuations become unimportant and that a suitable product state delivers exact expectation values for local observables, with corrections being suppressed in powers of 1/d1/d1/d. It turns out that, due to momentum summation properties of the interaction structure factor, all diagrams are suppressed in powers of 1/d1/d1/d leading to an analytic expansion. We have demonstrated this method in two important systems namely, the coupled-dimer magnets and the transverse-field Ising model. Coupled-dimer magnets are Heisenberg spin systems with two spins, coupled by intra-dimer antiferromagnetic interaction, per crystallographic unit cell (dimer). In turn, spins from neighboring dimers interact via some inter-dimer interaction. A quantum paramagnet is realized for a dominant intra-dimer interaction, while a magnetically ordered phase exists for a dominant (or of the same order as intra-dimer interaction) inter-dimer interaction. These two phases are connected by a quantum phase transition, which is in the Heisenberg O(3) universality class. Microscopic analytical theories to study such systems have been restricted to either only one of the phases or involve uncontrolled approximations. Using a non-linear bond-operator theory for spins with S=1/21/21/2, we have calculated the 1/d1/d1/d expansion of static and dynamic observables for coupled dimers on a hypercubic lattice at zero temperature. Analyticity of the 1/d1/d1/d expansion, even at the critical point, is ensured by correctly identifying suitable observables using the mean-field critical exponents. This method yields gapless excitation modes in the continuous symmetry broken phase, as required by Goldstone\'s theorem. In appropriate limits, our results match with perturbation expansion in small ratio of inter-dimer and intra-dimer coupling, performed using continuous unitary transformations, as well as the spin-wave theory for spin-1/21/21/2 in arbitrary dimensions. We also discuss the Brueckner approach, which relies on small quasiparticle density, and derive the same 1/d1/d1/d expansion for the dispersion relation in the disordered phase. Another success of our work is in describing the amplitude (Higgs) mode in coupled-dimer magnets. Our novel method establishes the popular bond-operator theory as a controlled approach. In d=2d=2d=2, the results from our calculations are in qualitative agreement with the quantum Monte Carlo study of the square-lattice bilayer Heisenberg AF spin-1/21/21/2 model. In particular, our results are useful to identify the amplitude (Higgs) mode in the QMC data. The ideas of large-ddd are also successfully applied to the transverse-field Ising model on a hypercubic lattice. Similar to bond operators, we have introduced auxiliary Bosonsic operators to set up our method in this case. We have also discussed briefly the bilayer Kitaev model, constructed by antiferromagnetically coupling two layers of the Kitaev model on a honeycomb lattice. In this case, we investigate the dimer quantum paramagnetic phase, realized in the strong inter-layer coupling limit. Using bond-operator theory, we calculate the mode dispersion in this phase, within the harmonic approximation. We also conjecture a zero-temperature phase diagram for this model.
For coupled-dimer Heisenberg magnets, a paradigm of magnetic quantum phase transitions, we develop a systematic expansion in 1/d1/d1/d, the inverse number of space dimensions. The expansion employs a formulation of the bond-operator technique and is based on the observation that a suitably chosen product-state wave function yields exact zero-temperature expectation values of local observables in the $d\ensuremath{\rightarrow}\ensuremath{\infty}$ limit, with corrections vanishing as 1/d1/d1/d. We demonstrate the approach for a model of dimers on a hypercubic lattice, which generalizes the square-lattice bilayer Heisenberg model to arbitrary ddd. In this paper, we use the 1/d1/d1/d expansion to calculate static and dynamic observables at zero temperature in the paramagnetic singlet phase, up to the quantum phase transition, and compare the results with numerical data available for d=2d=2d=2. Contact is also made with previously proposed refinements of bond-operator theory as well as with a perturbative expansion in the interdimer coupling. In a companion paper, the present 1/d1/d1/d expansion will be extended to the ordered phase, where it is shown to consistently describe the entire phase diagram including the quantum critical point.
We propose a generalization of the linked-cluster expansions to study driven-dissipative quantum lattice models, directly accessing the thermodynamic limit of the system. Our method leads to the evaluation of the desired extensive property onto small connected clusters of a given size and topology. We first test this approach on the isotropic spin-1/2 Hamiltonian in two dimensions, where each spin is coupled to an independent environment that induces incoherent spin flips. Then we apply it to the study of an anisotropic model displaying a dissipative phase transition from a magnetically ordered to a disordered phase. By means of a Pad\'e analysis on the series expansions for the average magnetization, we provide a viable route to locate the phase transition and to extrapolate the critical exponent for the magnetic susceptibility.
We extend to magnetically ordered phases a recently developed expansion in 1/d1/d1/d for coupled-dimer Heisenberg magnets, where ddd is the number of space dimensions. This extension utilizes generalized bond operators describing spin excitations on top of a reference state involving triplet condensates. We explicitly consider a model of dimers on a hypercubic lattice which displays, in addition to the paramagnetic singlet phase, a collinear antiferromagnetic phase for which we calculate static and dynamic observables at zero temperature. In particular, we show that the 1/d1/d1/d expansion smoothly connects the paramagnetic and antiferromagnetic phases and produces sensible results at and near the quantum phase transition point. Among others, we determine the dispersion and spectral-weight distribution of the amplitude (i.e., Higgs) mode of the ordered phase. In the limit of vanishing intradimer coupling, we connect our approach to spin-wave theory.
We study the ±J transverse-field Ising spin-glass model at zero temperature on d-dimensional hypercubic lattices and in the Sherrington-Kirkpatrick (SK) model, by series expansions around the strong-field limit. In the SK model and in high dimensions our calculated critical properties are in excellent agreement with the exact mean-field results, surprisingly even down to dimension d=6, which is below the upper critical dimension of d=8. In contrast, at lower dimensions we find a rich singular behavior consisting of critical and Griffiths-McCoy singularities. The divergence of the equal-time structure factor allows us to locate the critical coupling where the correlation length diverges, implying the onset of a thermodynamic phase transition. We find that the spin-glass susceptibility as well as various power moments of the local susceptibility become singular in the paramagnetic phase before the critical point. Griffiths-McCoy singularities are very strong in two dimensions but decrease rapidly as the dimension increases. We present evidence that high enough powers of the local susceptibility may become singular at the pure-system critical point.