Spectral function of the one-dimensional Hubbard model away from half filling

We calculate the photoemission spectral function of the one-dimensional Hubbard model away from half filling using the dynamical density matrix renormalization group method. An approach for calculating momentum-dependent quantities in finite open chains is presented. Comparison with exact Bethe Ansatz results demonstrates the unprecedented accuracy of our method. Our results show that the photoemission spectrum of the quasi-one-dimensional conductor TTF-TCNQ provides evidence for spin-charge separation on the scale of the conduction band width.Comment: REVTEX, 4 pages including 4 EPS figures (changed); correct chemical potential used to define excitation energies in figures and tex

Charge and spin Drude weight of the one-dimensional extended Hubbard model at quarter-filling

We calculate the charge and spin Drude weight of the one-dimensional extended Hubbard model with on-site repulsion $U$ and nearest-neighbor repulsion $V$ at quarter filling using the density-matrix renormalization group method combined with a variational principle. Our numerical results for the Hubbard model (V=0) agree with exact results obtained from the Bethe ansatz solution. We obtain the contour map for both Drude weights in the $UV$-parameter space for repulsive interactions. We find that the charge Drude weight is discontinuous across the Kosterlitz-Thouless transition between the Luttinger liquid and the charge-density-wave insulator, while the spin Drude weight varies smoothly and remains finite in both phases. Our results can be generally understood using bosonization and renormalization group results. The finite-size scaling of the charge Drude weight is well fitted by a polynomial function of the inverse system size in the metallic region. In the insulating region we find an exponential decay of the finite-size corrections with the system size and a universal relation between the charge gap $\Delta_c$ and the correlation length $\xi$ which controls this exponential decay.Comment: 10 pages, 9 figure

Optical excitations in a one-dimensional Mott insulator

The density-matrix renormalization-group (DMRG) method is used to investigate optical excitations in the Mott insulating phase of a one-dimensional extended Hubbard model. The linear optical conductivity is calculated using the dynamical DMRG method and the nature of the lowest optically excited states is investigated using a symmetrized DMRG approach. The numerical calculations agree perfectly with field-theoretical predictions for a small Mott gap and analytical results for a large Mott gap obtained with a strong-coupling analysis. Is is shown that four types of optical excitations exist in this Mott insulator: pairs of unbound charge excitations, excitons, excitonic strings, and charge-density-wave (CDW) droplets. Each type of excitations dominates the low-energy optical spectrum in some region of the interaction parameter space and corresponds to distinct spectral features: a continuum starting at the Mott gap (unbound charge excitations), a single peak or several isolated peaks below the Mott gap (excitons and excitonic strings, respectively), and a continuum below the Mott gap (CDW droplets).Comment: 12 pages (REVTEX 4), 12 figures (in 14 eps files), 1 tabl

Ground state phases of the Half-Filled One-Dimensional Extended Hubbard Model

Using quantum Monte Carlo simulations, results of a strong-coupling expansion, and Luttinger liquid theory, we determine quantitatively the ground state phase diagram of the one-dimensional extended Hubbard model with on-site and nearest-neighbor repulsions U and V. We show that spin frustration stabilizes a bond-ordered (dimerized) state for U appr. V/2 up to U/t appr. 9, where t is the nearest-neighbor hopping. The transition from the dimerized state to the staggered charge-density-wave state for large V/U is continuous for U up to appr. 5.5 and first-order for higher U.Comment: 4 pages, 4 figure

Low-energy local density of states of the 1D Hubbard model

We examine the local density of states (DOS) at low energies numerically and analytically for the Hubbard model in one dimension. The eigenstates represent separate spin and charge excitations with a remarkably rich structure of the local DOS in space and energy. The results predict signatures of strongly correlated excitations in the tunneling probability along finite quantum wires, such as carbon nanotubes, atomic chains or semiconductor wires in scanning tunneling spectroscopy (STS) experiments. However, the detailed signatures can only be partly explained by standard Luttinger liquid theory. In particular, we find that the effective boundary exponent can be negative in finite wires, which leads to an increase of the local DOS near the edges in contrast to the established behavior in the thermodynamic limit.Comment: 6 pages, 4 figures, more information can be found at http://www.physik.uni-kl.de/eggert/papers/index.htm

Phase separation in the Edwards model

The nature of charge transport within a correlated background medium can be described by spinless fermions coupled to bosons in the model introduced by Edwards. Combining numerical density matrix renormalization group and analytical projector-based renormalization methods we explore the ground-state phase diagram of the Edwards model in one dimension. Below a critical boson frequency any long-range order disappears and the system becomes metallic. If the charge carriers are coupled to slow quantum bosons the Tomonaga-Luttinger liquid is attractive and finally makes room for a phase separated state, just as in the t-J model. The phase boundary separating repulsive from the attractive Tomonaga-Luttinger liquid is determined from long-wavelength charge correlations, whereas fermion segregation is indicated by a vanishing inverse compressibility. On approaching phase separation the photoemission spectra develop strong anomalies.Comment: 6 pages, 5 figures, final versio

Differences Between Hole and Electron Doping of a Two-Leg CuO Ladder

Here we report results of a density-matrix-renormalization-group (DMRG) calculation of the charge, spin, and pairing properties of a two-leg CuO Hubbard ladder. The outer oxygen atoms as well as the rung and leg oxygen atoms are included along with near-neighbor and oxygen-hopping matrix elements. This system allows us to study the effects of hole and electron doping on a system which is a charge transfer insulator at a filling of one hole per Cu and exhibits power law, d-wave-like pairing correlations when doped. In particular, we focus on the differences between doping with holes or electrons.Comment: REVTEX 4, 10 pages, 13 figure

Peierls transition in the presence of finite-frequency phonons in the one-dimensional extended Peierls-Hubbard model at half-filling

We report quantum Monte Carlo (stochastic series expansion) results for the transition from a Mott insulator to a dimerized Peierls insulating state in a half-filled, 1D extended Hubbard model coupled to optical bond phonons. Using electron-electron (e-e) interaction parameters corresponding approximately to polyacetylene, we show that the Mott-Peierls transition occurs at a finite value of the electron-phonon (e-ph) coupling. We discuss several different criteria for detecting the transition and show that they give consistent results. We calculate the critical e-ph coupling as a function of the bare phonon frequency and also investigate the sensitivity of the critical coupling to the strength of the e-e interaction. In the limit of strong e-e couplings, we map the model to a spin-Peierls chain and compare the phase boundary with previous results for the spin-Peierls transition. We point out effects of a nonlinear spin-phonon coupling neglected in the mapping to the spin-Peierls model.Comment: 7 pages, 5 figure