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arXiv:cond-mat/0408079 · Physical Review B

Short-range correlations and spin-mode velocities in ultrathin one-dimensional conductors

M. M. Fogler

Published Apr 12, 2005• 22 citations
arXivHTMLPDF

Abstract

In ultrathin wires positioned on high-$\ensuremath{\kappa}$ dielectric substrates or nearby metallic gates, electrons can form strongly correlated one-dimensional fluids already at rather high electron densities. The density-density correlation function, charge compressibility, spin susceptibility, and electron specific heat of such fluids are calculated analytically. The results are relevant for transport and thermodynamics of carbon nanotube field-effect transistors and semiconductor quantum wires.

DOI
10.1103/physrevb.71.161304

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In ultrathin wires positioned on high-\ensuremathκ\ensuremath{\kappa}\ensuremathκ dielectric substrates or nearby metallic gates, electrons can form strongly correlated one-dimensional fluids already at rather high electron densities. The density-density correlation function, charge compressibility, spin susceptibility, and electron specific heat of such fluids are calculated analytically. The results are relevant for transport and thermodynamics of carbon nanotube field-effect transistors and semiconductor quantum wires.
The low-energy properties of a homogeneous one-dimensional electron system are completely specified by two Tomonaga-Luttinger parameters ${K}_{\ensuremath{\rho}}$ and ${v}_{\ensuremath{\sigma}}.$ In this paper we discuss microscopic estimates of the values of these parameters in semiconductor quantum wires that exploit their relationship to thermodynamic properties. Motivated by the recognized similarity between correlations in the ground state of a one-dimensional electron liquid and correlations in a Wigner crystal, we evaluate these thermodynamic quantities in a self-consistent Hartree-Fock approximation. According to our calculations, the Hartree-Fock approximation ground state is a Wigner crystal at all electron densities and has antiferromagnetic order that gradually evolves from spin-density wave to localized in character as the density is lowered. Our results for ${K}_{\ensuremath{\rho}}$ are in good agreement with weak-coupling perturbative estimates ${K}_{\ensuremath{\rho}}^{\mathrm{pert}}$ at high densities, but deviate strongly at low densities, especially when the electron-electron interaction is screened at long distances. ${K}_{\ensuremath{\rho}}^{\mathrm{pert}}\ensuremath{\sim}{n}^{1/2}$ vanishes at small carrier density n, whereas we conjecture that ${K}_{\ensuremath{\rho}}\ensuremath{\rightarrow}1/2$ when $\stackrel{\ensuremath{\rightarrow}}{n}0,$ implying that ${K}_{\ensuremath{\rho}}$ should pass through a minimum at an intermediate density. Observation of this nonmonotonic dependence could be used to measure the effective interaction range in a realistic semiconductor quantum wire geometry. In the spin sector we find that the spin velocity decreases with increasing interaction strength or decreasing n. Strong correlation effects make it difficult to obtain fully consistent estimates of ${v}_{\ensuremath{\sigma}}$ from Hartree-Fock calculations. We conjecture that ${v}_{\ensuremath{\sigma}}{/v}_{\mathrm{F}}\ensuremath{\propto}{n/V}_{0},$ where V0{V}_{0}V0​ is the interaction strength, in the limit $\stackrel{\ensuremath{\rightarrow}}{n}0.$
Dynamical response theory is employed to investigate the effects of various transverse confinements on electron correlations in the ground state of a ferromagnetic one-dimensional quantum wire for different wire widths b and density parameters r s . In the regime of a thin quantum wire, electrons are treated as a one-dimensional gas under different confinement models via effective electron-electron interaction potentials. Using the first-order random phase approximation (FRPA) including self-energy and exchange contribution, which provides the ground-state structure beyond the random phase approximation, we numerically compute the structure factor, pair-correlation function, correlation energy, and ground-state energy for various values of b and r s . Our results reveal that the correlation energy depends on the choice of confinement model. For the ultrathin wire ( b → 0 ) in the high-density limit, we find that the correlation energy for transverse confinement models V 1 ( q ) (harmonic), V 2 ( q ) (cylindrical), and V 5 ( q ) (harmonic-delta) approaches ε c ( r s ) = − π 2 / 360 ∼ − 0.02741 a.u., which agrees with the exact results in this limit [P.-F. Loos, ; V. Ashokan, , ]. This clearly illustrates that for at least these three confinement potentials, the one-dimensional Coulomb potential can be regularized at interparticle distance x = 0 to yield the same correlation energy. In contrast, other confinement potentials, V 3 ( q ) (infinite square well), V 4 ( q ) (infinite square-infinite triangular well), and V 6 ( q ) (infinite square-delta well), do not approach the same high-density limit; instead, the correlation energy tends to ε c ∼ − 0.03002 a.u. for these potentials. The percentage difference in correlation energy between the confinement models V 1 ( q ) , V 2 ( q ) , V 5 ( q ) and V 3 ( q ) ,
We explore the role of electron correlation in quasi-one-dimensional quantum wires as the range of the interaction potential is changed and their thickness is varied by performing exact quantum Monte Carlo simulations at various electronic densities. In the case of unscreened interactions with a long-range 1/x1/x1/x tail there is a crossover from a liquid to a quasi-Wigner crystal state as the density decreases. When this interaction is screened, quasi-long-range order is prevented from forming, although a significant correlation with 4kF4{k}_{F}4kF​ periodicity is still present at low densities. At even lower electron concentration, exchange is suppressed and the electrons behave like spinless fermions. Finally, we study the effect of electron correlations in the double quantum wire experiment [Steinberg et al., Phys. Rev. B 73, 113307 (2006)] by introducing an accurate model for the screening in the experiment and explicitly including the finite length of the system in our simulations. We find that decreasing the electron density continuously drives the system from a liquid to a state with quite strong 4kF4{k}_{F}4kF​ correlations. This crossover takes place around $22\text{ }\ensuremath{\mu}{\text{m}}^{\ensuremath{-}1}$, near the density where the electron localization occurs in the experiment. The charge and spin velocities are also in good agreement with the experimental findings in the proximity of the crossover. We argue that correlation effects play an important role at the onset of the localization transition.
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This thesis presents theoretical studies of strongly correlated systems as well as topologically ordered systems in 1D. Non-Fermi liquid behavior characteristic of interacting 1D electron systems is investigated with an emphasis on experimentally relevant setups and observables. The existence of end Majorana fermions in a 1D p-wave superconductor subject to periodic, incommensurate and disordered potentials is studied. The Tomonaga-Luttinger liquid (TLL), a model of interacting electrons in one spatial dimension, is considered in the context of two systems of experimental interest. First, a study of the electronic properties of single-walled armchair carbon nanotubes in the presence of transverse electric and magnetic fields is presented. As a result of their effect on the band structure and electron wave functions, fields alter the nature of the (effective) Coulomb interaction in tubes. In particular, it is found that fields couple to nanotube bands (or valleys), a quantum degree of freedom inherited from the underlying graphene lattice. As revealed by a detailed TLL calculation, it is predicted that fields induce electrons to disperse into their spin, band, and charge components. Fields also provide a means of tuning the shell-filling behavior associated with short tubes. The phenomenon of charge fractionalization is investigated in a one-dimensional ring. TLL theory predicts that momentum-resolved electrons injected into the ring will fractionalize into clockwise- and counterclockwise-moving quasiparticles. As a complement to transport measurements in quantum wires connected to leads, non-invasive measures involving the magnetic field profiles around the ring are proposed. Topological aspects of 1D p-wave superconductors are explored. The intimate connection between non-trivial topology (fermions) and spontaneous symmetry breaking (spins) in one-dimension is investigated. Building on this connection, a spin ladder system endowed with vortex degrees of freedom is proposed in order to study the effects that inhomogeneous potentials have on the topological phase diagram. Periodic vortex patterns yield a rich parameter space for tuning into a topologically non-trivial phase. This analysis hinges on the development of a topological invariant based on the wave function of Majorana fermions which inhabit the ends of the system and are robust to disorder. The method is generalized to aperiodic and disordered potentials. The topological phase diagram of such systems is studied; numerical and analytic results are found to be in close agreement.
Experiments on quasi-one-dimensional systems such as quantum wires and metallic chains on surfaces suggest the existence of electron-electron interactions of substantial range and hence physics beyond the Hubbard model. We therefore investigate one-dimensional, quarter-filled chains with a Coulomb potential with variable screening length by quantum Monte Carlo methods and exact diagonalization. The Luttinger liquid interaction parameter ${K}_{\ensuremath{\rho}}$ decreases with increasing interaction strength and range. Experimentally observed values close to 1/4 require strong interactions and/or large screening lengths. As predicted by bosonization, we find a metal-insulator transition at ${K}_{\ensuremath{\rho}}=1/4$. Upon increasing the screening length, the charge and spin correlation functions reveal the crossover from dominant 2kF2{k}_{\mathrm{F}}2kF​ spin correlations to dominant 4kF4{k}_{\mathrm{F}}4kF​ charge correlations, and a strong enhancement of the charge velocity. In the metallic phase, the signatures of spin-charge separation in the single-particle spectrum, spinon and holon bands, remain robust even for rather long-ranged interactions. The charge-density-wave state exhibits backfolded shadow bands.