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Register a new userGround state properties of one-dimensional and two-dimensional Hubbard model from Gutzwiller conjugate gradient minimization theory
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We introduce Gutzwiller conjugate gradient minimization (GCGM) theory, an ab initio quantum many-body theory for computing the ground-state properties of infinite systems. GCGM uses the Gutzwiller wave function but does not use the commonly adopted Gutzwiller approximation (GA), which is a major source of inaccuracy. Instead, the theory uses an approximation that is based on the occupation probability of the on-site configurations, rather than approximations that decouple the site-site correlations as used in the GA. We test the theory in the one-dimensional and two-dimensional Hubbard models at various electron densities and find that GCGM reproduces energies and double occupancies in reasonable agreement with benchmark data at a very small computational cost.
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We use the density-matrix renormalization group method to investigate ground-state and dynamic properties of the one-dimensional Bose-Hubbard model, the effective model of ultracold bosonic atoms in an optical lattice. For fixed maximum site occupancy $n_b=5$, we calculate the phase boundaries between the Mott insulator and the `superfluid phase for the lowest two Mott lobes. We extract the Tomonaga-Luttinger parameter from the density-density correlation function and determine accurately the critical interaction strength for the Mott transition. For both phases, we study the momentum distribution function in the homogeneous system, and the particle distribution and quasi-momentum distribution functions in a parabolic trap. With our zero-temperature method we determine the photoemission spectra in the Mott insulator and in the `superfluid phase of the one-dimensional Bose-Hubbard model. In the insulator, the Mott gap separates the quasi-particle and quasi-hole dispersions. In the `superfluid phase the spectral weight is concentrated around zero momentum.
A one-dimensional (1D) Bose system with dipole-dipole repulsion is studied at zero temperature by means of a Quantum Monte Carlo method. It is shown that in the limit of small linear density the bosonic system of dipole moments acquires many properties of a system of non-interacting fermions. At larger linear densities a Variational Monte Carlo calculation suggests a crossover from a liquid-like to a solid-like state. The system is superfluid on the liquid-like side of the crossover and is normal in the deep on the solid-like side. Energy and structural functions are presented for a wide range of densities. Possible realizations of the model are 1D Bose atom systems with permanent dipoles or dipoles induced by static field or resonance radiation, or indirect excitons in coupled quantum wires, etc. We propose parameters of a possible experiment and discuss manifestations of the zero-temperature quantum crossover.
We generalize the linear discrete dimensional scaling approach for the repulsive Hubbard model to obtain a nonlinear scaling relation that yields accurate approximations to the ground-state energy in both two and three dimensions, as judged by comparison to auxiliary-field quantum Monte Carlo (QMC) data. Predictions are made for the per-site ground-state energies in two and three dimensions for $n$ (filling factor) and $U$ (Coulomb interaction) values for which QMC data are currently unavailable.
We study finite-temperature transport properties of the one-dimensional Hubbard model using the density matrix renormalization group. Our aim is two-fold: First, we compute both the charge and the spin current correlation function of the integrable model at half filling. The former decays rapidly, implying that the corresponding Drude weight is either zero or very small. Second, we calculate the optical charge conductivity sigma(omega) in presence of small integrability-breaking next-nearest neighbor interactions (the extended Hubbard model). The DC conductivity is finite and diverges as the temperature is decreased below the gap. Our results thus suggest that the half-filled, gapped Hubbard model is a normal charge conductor at finite temperatures. As a testbed for our numerics, we compute sigma(omega) for the integrable XXZ spin chain in its gapped phase.
We study photoinduced ultrafast coherent oscillations originating from orbital degrees of freedom in the one-dimensional two-orbital Hubbard model. By solving the time-dependent Schrodinger equation for the numerically exact many-electron wave function, we obtain time-dependent optical response functions. The calculated spectra show characteristic coherent oscillations that vary with the frequency of probe light. A simple analysis for the dominant oscillating components clarifies that these photoinduced oscillations are caused by the quantum interference between photogenerated states. The oscillation attributed to the Raman-active orbital excitations (orbitons) clearly appears around the charge-transfer peak.
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