No Arabic abstract
We apply the density-matrix renormalization group (DMRG) method to a one-dimensional Hubbard model that lacks Umklapp scattering and thus provides an ideal case to study the Mott-Hubbard transition analytically and numerically. The model has a linear dispersion and displays a metal-to-insulator transition when the Hubbard interaction~$U$ equals the band width, $U_{rm c}=W$, where the single-particle gap opens linearly, $Delta(Ugeq W)=U-W$. The simple nature of the elementary excitations permits to determine numerically with high accuracy the critical interaction strength and the gap function in the thermodynamic limit. The jump discontinuity of the momentum distribution $n_k$ at the Fermi wave number $k_{rm F}=0$ cannot be used to locate accurately $U_{rm c}$ from finite-size systems. However, the slope of $n_k$ at the band edges, $k_{rm B}=pm pi$, reveals the formation of a single-particle bound state which can be used to determine $U_{rm c}$ reliably from $n_k$ using accurate finite-size data.
We study the superfluid-insulator transition in Bose-Hubbard models in one-, two-, and three-dimensional cubic lattices by means of a recently proposed variational wave function. In one dimension, the variational results agree with the expected Berezinskii-Kosterlitz-Thouless scenario of the interaction-driven Mott transition. In two and three dimensions, we find evidences that, across the transition,most of the spectral weight is concentrated at high energies, suggestive of pre-formed Mott-Hubbard side-bands. This result is compatible with the experimental data by Stoferle et al. [Phys. Rev. Lett. 92, 130403 (2004)].
We study the Mott transition in a frustrated Hubbard model with next-nearest neighbor hopping at half-filling. The interplay between interaction, dimensionality and geometric frustration closes the one-dimensional Mott gap and gives rise to a metallic phase with Fermi surface pockets. We argue that they emerge as a consequence of remnant one-dimensional Umklapp scattering at the momenta with vanishing interchain hopping matrix elements. In this pseudogap phase, enhanced d-wave pairing correlations are driven by antiferromagnetic fluctuations. Within the adopted cluster dynamical mean-field theory on the $8times 2$ cluster and down to our lowest temperatures the transition from one to two dimensions is continuous.
We consider the one-dimensional extended Hubbard model in the presence of an explicit dimerization $delta$. For a sufficiently strong nearest neighbour repulsion we establish the existence of a quantum phase transition between a mixed bond-order wave and charge-density wave phase from a pure bond-order wave phase. This phase transition is in the universality class of the two-dimensional Ising model.
We consider the one-band Hubbard model on the square lattice by using variational and Greens function Monte Carlo methods, where the variational states contain Jastrow and backflow correlations on top of an uncorrelated wave function that includes BCS pairing and magnetic order. At half filling, where the ground state is antiferromagnetically ordered for any value of the on-site interaction $U$, we can identify a hidden critical point $U_{rm Mott}$, above which a finite BCS pairing is stabilized in the wave function. The existence of this point is reminiscent of the Mott transition in the paramagnetic sector and determines a separation between a Slater insulator (at small values of $U$), where magnetism induces a potential energy gain, and a Mott insulator (at large values of $U$), where magnetic correlations drive a kinetic energy gain. Most importantly, the existence of $U_{rm Mott}$ has crucial consequences when doping the system: We observe a tendency to phase separation into a hole-rich and a hole-poor region only when doping the Slater insulator, while the system is uniform by doping the Mott insulator. Superconducting correlations are clearly observed above $U_{rm Mott}$, leading to the characteristic dome structure in doping. Furthermore, we show that the energy gain due to the presence of a finite BCS pairing above $U_{rm Mott}$ shifts from the potential to the kinetic sector by increasing the value of the Coulomb repulsion.
We study the behavior of fermion liquid defined on hexagonal and triangular lattices with short-range repulsion at half filling. In strong coupling limit the Mott-Hubbard phase state is present, the main peculiarity of insulator state is a doubled cell of the lattices. In the insulator state at half filling fermions with momenta $k$ and $k+pi$ are coupled via the effective $lambda$-field, the gap in the spectrum of quasi-particle excitations opens and the Mott phase transition is occured at a critical value of the one-site Hubbard repulsion~$U_c$. $U_c=3.904$ and $U_c=5.125$ are calculated values for hexagonal and triangular lattices, respectively. Depending on the magnitude of the short-range repulsion, the gap in the spectrum and the energy of the ground state are calculated. The proposed approach is universal; it is implemented for an arbitrary dimension and symmetry of the lattice for fermions models with short-range repulsion.