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arXiv:cond-mat/0203024 · Physical Review Letters

Quantum Phase Transitions to Charge-Ordered and Wigner-Crystal States under the Interplay of Lattice Commensurability and Long-Range Coulomb Interactions

Yohei Noda, Masatoshi Imada

Published Oct 8, 2002• 27 citations
arXivHTMLPDF

Abstract

The relationship among the Wigner crystal, charge ordering, and the Mott insulator is studied by the path-integral renormalization group method in two-dimensional systems with long-range Coulomb interaction. In contrast to the insensitivity of the Hartree-Fock results, the stability of the solid drastically decreases with the decrease in the lattice commensurability. The transition to liquid occurs at the electron gas parameter r(s) approximately 2 for the filling n=1/2, showing a large reduction from r(s) approximately 35 in the continuum limit. A correct account of quantum fluctuations is crucial to understanding the charge-order stability generally observed only at simple fractional fillings and the nature of quantum liquids away from them.

DOI
10.1103/physrevlett.89.176803

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The relationship among the Wigner crystal, charge ordering, and the Mott insulator is studied by the path-integral renormalization group method in two-dimensional systems with long-range Coulomb interaction. In contrast to the insensitivity of the Hartree-Fock results, the stability of the solid drastically decreases with the decrease in the lattice commensurability. The transition to liquid occurs at the electron gas parameter r(s) approximately 2 for the filling n=1/2, showing a large reduction from r(s) approximately 35 in the continuum limit. A correct account of quantum fluctuations is crucial to understanding the charge-order stability generally observed only at simple fractional fillings and the nature of quantum liquids away from them.
Continuous Wigner-Mott transition at ν=1/5ν=1/5ν=1/5
Electrons can organize themselves into charge-ordered states to minimize the effects of long-ranged Coulomb interactions. In the presence of a lattice, commensurability constraints lead to the emergence of incompressible Wigner-Mott insulators at various rational electron fillings, ν =p/qν~=p/qν =p/q. The mechanism for quantum fluctuation-mediated melting of the Mott insulators with increasing electron kinetic energy remains an outstanding problem. Here, using matrix product state techniques, we analyze the bandwidth-tuned transition out of the Wigner-Mott insulator at ν=1/5ν=1/5ν=1/5 in an extended Hubbard model on infinite cylinders of varying circumference. For the two-leg ladder, the transition from the Mott insulator to the Luttinger liquid proceeds via a distinct intermediate phase with gapless Cooper-pairs and gapped electronic excitations. The resulting Luther-Emery liquid is the analog of a strongly fluctuating superconductor. We place these results in the context of a low-energy bosonization based theory for the transition. On the five-leg cylinder, we provide numerical evidence for a direct continuous transition between the Wigner-Mott insulator and a metallic phase across which the spin and charge-gaps vanish simultaneously. We comment on the connections to ongoing experiments in dual-gated bilayer moiré transition metal dichalcogenide materials.
The generalized Wigner crystal (GWC) is a novel quantum phase of matter driven by further-range interaction at fractional fillings of a lattice. The role of further-range interaction as the driver for the incompressible state is akin to the Wigner crystal. On the other hand, the significant role of commensurate filling is akin to the Mott insulator. Recent progress in simulator platforms presents unprecedented opportunities to investigate quantum melting in the strongly interacting regime through synergy between theory and experiments. However, the earlier theory literature presents diverging predictions. We study the quantum freezing of GWC through large-scale density matrix renormalization group simulations of a triangular lattice extended Hubbard model. We find a single first-order phase transition between the Fermi liquid and the sqrt[3]×sqrt[3] GWC state. The GWC state shows long-range antiferromagnetic 120° Néel order. Our results present the simplest answers to the question of the quantum phase transition into the GWC phase and the properties of the GWC phase.
We study the influence of long-range Coulomb interactions on the properties of one-dimensional (1D) strongly correlated electron systems in the vicinity of the metal-insulator Mott-Hubbard phase transition. It is shown that, in the metallic phase, the standard square-root singularity of the compressibility at the transition point changes to a logarithmic one, due to the formation of a 1D Wigner crystal of solitons (holons). On increasing the soliton density in a finite-size chain, the behavior of the compressibilty reflects a sequence of crossovers between classical, low-density regimes of perfectly or nearly ordered Wigner-crystal states, and quantum regimes of a nearly free Fermi gas of solitons, followed (in the high-density limit) by a liquid phase of strongly correlated solitons. In a mesoscopic situation, where the screening length in a 1D chain is controlled by a massive electrode (gate) placed near the chain, there is a narrow region near the transition point where quantum fluctuations melt the Wigner crystal and recover the universal square-root singularity of the compressibility. Strong Coulomb interaction affects the formation of the charge excitations in the insulating phase, transforming the sine-Gordon solitons into quasiclassical Coulomb solitons. Multiplicative logarithmic renormalizations of the characteristic soliton size and rest energy are found.
Charge ordering is often found in the phase diagram of unconventional superconductors in close proximity to the superconducting state. This has led to the suggestion that fluctuations of charge order can mediate superconducting pairing. While several mechanisms can lead to charge order, one common mechanism is the long-range Coulomb interaction, resulting in a Wigner crystal charge ordered state. For an electron density of 0.5 per site, we investigate the extended Hubbard model on the two-dimensional square lattice using exact diagonalization and density matrix renormalization group methods. Our results show that the strength of pairing decreases with the nearest-neighbor Coulomb interaction strength VVV and remains weaker than the tendency of pairing for noninteracting electrons.
Strong correlations effects, which are often associated to the approach to a Mott insulating state, in some cases may be observed even far from half filling. This typically happens whenever the intersite Coulomb repulsion induces a tendency toward charge ordering, an effect that confines the electrons, and in turn favors local moment formation, i.e., Mott localization. A distinct intermediate regime then emerges as a precursor of such a Wigner-Mott transition, which is characterized by both charge and spin correlations, displaying large mass enhancements and strong renormalizations of other Fermi-liquid parameters. Here we present a careful study of a quarter-filled extended Hubbard model---a simple example where such physics can be studied in detail, and discuss its relevance for the understanding of the phenomenology of low-density two-dimensional electron gases.
We provide solid evidence for the long-standing presumption that model Hamiltonians with short-range interactions faithfully reproduce the physics of the long-range Coulomb interaction in real materials. For this aim, we address a generic Hubbard model that captures the quantum phase transitions between metal, Mott insulator, and charge-density-wave (CDW) insulator, in the absence of Fermi-surface nesting. By comparing the quantum phase diagrams for the 1 / r -Hubbard model on a half-filled chain with nearest-neighbor and 1 / r -long-range interactions, we argue that the inclusion of long-range interactions is not crucial for a proper description of interacting many-electron systems. To this end, we employ the density matrix renormalization group method on finite lattices and antiperiodic boundary conditions to determine the quantum phase transitions between the metallic Luttinger liquid for weak interactions, the Mott-Hubbard insulator for dominant on-site interactions, and the CDW insulator for dominant intersite interactions. The two phase diagrams qualitatively agree inasmuch as the quantum phase transitions are continuous in both cases. Moreover, simple Hartree-Fock theory and the atomic limit provide renormalization factors that allow us to quantitatively map the two phase diagrams onto each other. As a practical advantage, our findings imply that computational efforts can be reduced tremendously by using models with short-range interactions only.