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arXiv:cond-mat/0105450 · Physical review. B, Condensed matter

Quantum phase transitions in the two-dimensional hardcore boson model

F. Hébert, G. G. Batrouni, R. T. Scalettar, Guido Schmid, Matthias Troyer, Ansgar Dorneich

Published Dec 5, 2001• 188 citations
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Abstract

We use two quantum Monte Carlo algorithms to map out the phase diagram of the two-dimensional hardcore boson Hubbard model with near ${(V}_{1})$ and next near ${(V}_{2})$ neighbor repulsion. At half filling we find three phases: superfluid (SF), checkerboard solid, and striped solid depending on the relative values of ${V}_{1}{,V}_{2},$ and the kinetic energy. Doping away from half filling, the checkerboard solid undergoes phase separation: The superfluid and solid phases coexist but not as a single thermodynamic phase. As a function of doping, the transition from the checkerboard solid is therefore first order. In contrast, doping the striped solid away from half filling instead produces a striped supersolid phase: coexistence of density order with superfluidity as a single phase. One surprising result is that the entire line of transitions between the SF and checkerboard solid phases at half filling appears to exhibit dynamical $O(3)$ symmetry restoration. The transitions appear to be in the same universality class as the special Heisenberg point even though this symmetry is explicitly broken by the ${V}_{2}$ interaction.

DOI
10.1103/physrevb.65.014513

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We use two quantum Monte Carlo algorithms to map out the phase diagram of the two-dimensional hardcore boson Hubbard model with near (V1){(V}_{1})(V1​) and next near (V2){(V}_{2})(V2​) neighbor repulsion. At half filling we find three phases: superfluid (SF), checkerboard solid, and striped solid depending on the relative values of V1,V2,{V}_{1}{,V}_{2},V1​,V2​, and the kinetic energy. Doping away from half filling, the checkerboard solid undergoes phase separation: The superfluid and solid phases coexist but not as a single thermodynamic phase. As a function of doping, the transition from the checkerboard solid is therefore first order. In contrast, doping the striped solid away from half filling instead produces a striped supersolid phase: coexistence of density order with superfluidity as a single phase. One surprising result is that the entire line of transitions between the SF and checkerboard solid phases at half filling appears to exhibit dynamical O(3)O(3)O(3) symmetry restoration. The transitions appear to be in the same universality class as the special Heisenberg point even though this symmetry is explicitly broken by the V2{V}_{2}V2​ interaction.
We present a comprehensive numerical study on the ground state phase diagram of the two-dimensional hard core bosonic extended Hubbard model with nearest (V1)({V}_{1})(V1​) and next nearest neighbor (V2)({V}_{2})(V2​) repulsions. In addition to the quantum solid and superfluid phases, we report the existence of a striped supersolid and three-quarter (quarter)-filled supersolid at commensurate density $\ensuremath{\rho}=0.75$ (0.25) due to the interplay of V1{V}_{1}V1​ and V2{V}_{2}V2​ interactions. The nature of the three-quarter-filled supersolid and the associated quantum solid will be discussed. The observed quantum phase transition between the two supersolids of different symmetries is found to be first order.
We use quantum Monte Carlo simulations to determine the ground state phase diagram of the Bose-Hubbard Hamiltonian with long-range repulsive interactions. At half filling one finds superfluidity and insulating solid phases. Depending on the relative sizes of near-neighbor and next-near-neighbor interactions, this solid follows either a checkerboard or a striped pattern. In neither case is there a coexistence with superfluidity. However, at incommensurate densities ``supersolid'' phases appear with simultaneous diagonal and off-diagonal long-range order.
We use quantum Monte Carlo method employing stochastic-series-expansion technique to study the ground state properties of the ${t}_{2}\ensuremath{-}{V}_{1}$ model of hard-core bosons on a square lattice. We find that, away from half fillings, the minimal combination of nearest-neighbor repulsion V1{V}_{1}V1​ and next-nearest-neighbor hopping t2{t}_{2}t2​ may give rise to checkerboard supersolidity. The nature of the quantum phase transition, where the superfluid changes to a checkerboard supersolid, depends on the relative strength of V1/t2{V}_{1}/{t}_{2}V1​/t2​ and the average site occupancy. Interestingly, at the half filling, the model displays the extreme Thouless effect. As the filling is varied away from half filling, the model exhibits initially a mixed-order transition, next a tricritical point, and finally a second-order transition.
Understanding the microscopic mechanism of coexisting long-range orders (such as lattice supersolidity) in strongly correlated systems is a subject of immense interest. We study the possible manifestations of long-range orders, including lattice-supersolid phases with differently broken symmetry, in a two-dimensional square lattice system of hard-core bosons (HCBs) coupled to archetypal cooperative/coherent normal-mode distortions such as those in perovskites. At strong HCB-phonon coupling, using a duality transformation to map the strong-coupling problem to a weak-coupling one, we obtain an effective Hamiltonian involving nearest-neighbor, next-nearest-neighbor, and next-to-next-nearest-neighbor hoppings and repulsions. Using stochastic series expansion quantum Monte Carlo, we construct the phase diagram of the system. As coupling strength is increased, we find that the system undergoes a first-order quantum phase transition from a superfluid to a checkerboard solid at half-filling and from a superfluid to a diagonal striped solid [with crystalline ordering wave vector $\stackrel{P\vec}{Q}=(2\ensuremath{\pi}/3,2\ensuremath{\pi}/3)$ or $(2\ensuremath{\pi}/3,4\ensuremath{\pi}/3)]$ at one-third filling without showing any evidence of supersolidity. On tuning the system away from these commensurate fillings, checkerboard supersolid is generated near half-filling whereas a rare diagonal striped supersolid is realized near one-third filling. Interestingly, there is an asymmetry in the extent of supersolidity about one-third filling. Within our framework, we also provide an explanation for the observed checkerboard and stripe formations in ${\mathrm{La}}_{2\ensuremath{-}x}{\mathrm{Sr}}_{x}{\mathrm{NiO}}_{4}$ at x=1/2x=1/2x=1/2 and x=1/3x=1/3x=1/3.
We study the ground-state phase diagram of the hard-core extended boson Hubbard model on the square lattice with both nearest- and next-nearest-neighbor hoppings and repulsions, using Gutzwiller mean-field theory and quantum Monte Carlo simulations. We observe the formation of supersolid states with checkerboard, striped, and quarter-filled crystal structures when the system is doped away from commensurate fillings. In the striped supersolid phase, a strong anisotropy in the superfluid density is obtained from the simulations; however, the transverse component remains finite, indicating a true two-dimensional superflow. We find that upon doping, the striped supersolid transitions directly into the supersolid with quarter-filled crystal structure, via a first-order stripe melting transition.
We study quantum phase transitions in the ground state of the two dimensional hard-core boson Hubbard Hamiltonian. Recent work on this and related models has suggested "supersolid" phases with simultaneous diagonal and off-diagonal long range order. We show numerically that, contrary to the generally held belief, the most commonly discussed "checkerboard" supersolid is thermodynamically unstable. Furthermore, this supersolid cannot be stabilized by next-near-neighbor interaction. We obtain the correct phase diagram using the Maxwell construction. We demonstrate that the "striped" supersolid is thermodynamically stable and is separated from the superfluid phase by a continuous phase transition.