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arXiv:1409.5063 · Physical Review B

Ground state and spectral properties across a charge density wave transition in a triangular lattice spinless fermion model

Trithep Devakul, Rajiv R. P. Singh

Published Sep 22, 2014• 2 citations
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Abstract

We study ground state properties and particle excitation spectra across a commensurate charge density wave transition in a system of strongly interacting fermions, using series expansion methods and mean-field theory. We consider a 1/3-filled system of spinless fermions on a triangular lattice, with hopping parameter $t$, nearest-neighbor repulsion $V$, and a sublattice dependent chemical potential ${\ensuremath{\mu}}_{s}$. The phase transition is found to be first order for ${\ensuremath{\mu}}_{s}=0$, but becomes continuous with increasing ${\ensuremath{\mu}}_{s}$. The particle and hole excitation spectra exhibit dramatic changes in the vicinity of the phase transitions and in the charge density wave ordered phase. We discuss the relevance of this study to the pinball Fermi liquid phase postulated theoretically in earlier studies as well as to various strongly correlated triangular lattice materials.

DOI
10.1103/physrevb.90.125136

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We analyze a model of spinless fermions on a triangular lattice at half-filling interacting via strong nearest-neighbor repulsive interactions, V, using the variational Monte Carlo simulation technique. The existence of three-sublattice long-range order is confirmed by the finite-size scaling analysis of the charge structural factor at V_c/t > 12. This ordered phase shows characteristics expected for a so called "pinball liquid" state, which has the spontaneous separation of fermionic degrees of freedom into coexisting Wigner crystal-like charge order (pin) and a metal (ball). The pins are fixed in order to maximize the kinetic energy gain of balls which move almost freely. The Fermi surface is reconstructed at V=V_c and remains towards the strong coupling limit. These features reminiscent of the strong correlation together with the large value of V_c/t distinguishes the pinball liquid from the conventional charge-density-wave.
Abstract We present a systematic investigation of the stability of the phase diagram of the spinless Falicov–Kimball model on two-dimensional non-bipartite lattices, the triangular and kagome lattices, using Markov-chain Monte Carlo simulations. Three filling or chemical potential conditions are examined: fixed chemical potentials ( μf=μc=U/2\mu _f = \mu _c = U/2μf​=μc​=U/2 μ f = μ c = U / 2 ), “generalized” half-filling ( nˉf=1/3\bar{n}_f = 1/3nˉf​=1/3 n ¯ f = 1 / 3 , nˉc=2/3\bar{n}_c = 2/3nˉc​=2/3 n ¯ c = 2 / 3 ), and conventional half-filling ( nˉf=nˉc=1/2\bar{n}_f = \bar{n}_c = 1/2nˉf​=nˉc​=1/2 n ¯ f = n ¯ c = 1 / 2 ). For each condition, the effects of a perturbatively small next-nearest-neighbor hopping are studied. On the triangular lattice, Anderson insulator, Mott insulator, and charge-density wave (CDW) phases are found in all cases, with the CDW driven by Coulomb interaction-mediated nesting. Evidence for a charge-liquid regime is found in the region between the weakly correlated regime and the CDW, characterized by competing charge-ordering wavevectors and the absence of universal scaling behavior, whose extent shrinks progressively from the grand-canonical to the conventional half-filling condition. On the kagome lattice, the CDW phase is completely absent; instead, an insulating ground state, plausibly of the Mott type, is found, with signatures of a possible quantum phase transition at zero temperature. Our results establish the crucial role of lattice geometry and particle-hole symmetry breaking in shaping the phase diagram of correlated electron systems. Graphical abstract The 2d triangular lattice (left) and the 2d kagome lattice (right) with their unit cells highlighted. Bottom: The corresponding phase diagram of the Falicov-Kimball model (FKM) on each lattice, illustrating the non-Fermi liquid (nFL), charge-density wave (CDW), Anderson insulator (AI) and Mott insulator (MI) regimes.
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We study ground state properties and excitation spectra for hard-core bosons on square and triangular lattices, at half filling, using series expansion methods. Nearest-neighbor repulsion between the bosons leads to the development of short-range density order at the antiferromagnetic wave vector, and simultaneously, a minimum in the density excitation spectra. On the square lattice, the model maps onto the well studied XXZXXZXXZ model, and the gap at the minimum collapses to zero precisely at the Heisenberg symmetry point, leading to the well known spectra for the Heisenberg antiferromagnet. On the triangular lattice, the collapse of the gap at the minimum signals the onset of the supersolid phase. Our results suggest that the transition from the superfluid to the supersolid phase may be weakly first order. We also find several features in the density of states, including two peaks and a sharp discontinuity, which may be observable in experimental realization of such systems.
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