5,808 research outputs found
Coexistence of solutions in dynamical mean-field theory of the Mott transition
In this paper, I discuss the finite-temperature metal-insulator transition of
the paramagnetic Hubbard model within dynamical mean-field theory. I show that
coexisting solutions, the hallmark of such a transition, can be obtained in a
consistent way both from Quantum Monte Carlo (QMC) simulations and from the
Exact Diagonalization method. I pay special attention to discretization errors
within QMC. These errors explain why it is difficult to obtain the solutions by
QMC close to the boundaries of the coexistence region.Comment: 3 pages, 2 figures, RevTe
Orbital selective Mott transition in multi-band systems: slave-spin representation and dynamical mean-field theory
We examine whether the Mott transition of a half-filled, two-orbital Hubbard
model with unequal bandwidths occurs simultaneously for both bands or whether
it is a two-stage process in which the orbital with narrower bandwith localizes
first (giving rise to an intermediate `orbital-selective' Mott phase). This
question is addressed using both dynamical mean-field theory, and a
representation of fermion operators in terms of slave quantum spins, followed
by a mean-field approximation (similar in spirit to a Gutzwiller
approximation). In the latter approach, the Mott transition is found to be
orbital-selective for all values of the Coulomb exchange (Hund) coupling J when
the bandwidth ratio is small, and only beyond a critical value of J when the
bandwidth ratio is larger. Dynamical mean-field theory partially confirms these
findings, but the intermediate phase at J=0 is found to differ from a
conventional Mott insulator, with spectral weight extending down to arbitrary
low energy. Finally, the orbital-selective Mott phase is found, at
zero-temperature, to be unstable with respect to an inter-orbital
hybridization, and replaced by a state with a large effective mass (and a low
quasiparticle coherence scale) for the narrower band.Comment: Discussion on the effect of hybridization on the OSMT has been
extende
Theory of Core-Level Photoemission and the X-ray Edge Singularity Across the Mott Transition
The zero temperature core-level photoemission spectrum is studied across the
metal to Mott insulator transition using dynamical mean-field theory and
Wilson's numerical renormalization group. An asymmetric power-law divergence is
obtained in the metallic phase with an exponent alpha(U,Q)-1 which depends on
the strength of both the Hubbard interaction U and the core-hole potential Q.
For Q <~ U_c/2 alpha decreases with increasing U and vanishes at the transition
(U -> U_c) leading to a symmetric peak in the insulating phase. For Q >~ U_c/2,
alpha remains finite close to the transition, but the integrated intensity of
the power-law vanishes and there is no associated peak in the insulator. The
weight and position of the remaining peaks in the spectra can be understood
within a molecular orbital approach.Comment: 5 pages, 6 figure
Dynamical singlets and correlation-assisted Peierls transition in VO2
A theory of the metal-insulator transition in vanadium dioxide from the
high-temperature rutile to the low- temperature monoclinic phase is proposed on
the basis of cluster dynamical mean field theory, in conjunction with the
density functional scheme. The interplay of strong electronic Coulomb
interactions and structural distortions, in particular the dimerization of
vanadium atoms in the low temperature phase, plays a crucial role. We find that
VO2 is not a conventional Mott insulator, but that the formation of dynamical
V-V singlet pairs due to strong Coulomb correlations is necessary to trigger
the opening of a Peierls gap.Comment: 5 page
Potential-energy (BCS) to kinetic-energy (BEC)-driven pairing in the attractive Hubbard model
The BCS-BEC crossover within the two-dimensional attractive Hubbard model is
studied by using the Cellular Dynamical Mean-Field Theory both in the normal
and superconducting ground states. Short-range spatial correlations
incorporated in this theory remove the normal-state quasiparticle peak and the
first-order transition found in the Dynamical Mean-Field Theory, rendering the
normal state crossover smooth. For smaller than the bandwidth, pairing is
driven by the potential energy, while in the opposite case it is driven by the
kinetic energy, resembling a recent optical conductivity experiment in
cuprates. Phase coherence leads to the appearance of a collective Bogoliubov
mode in the density-density correlation function and to the sharpening of the
spectral function.Comment: 5 pages, 4 figure
The Finite Temperature Mott Transition in the Hubbard Model in Infinite Dimensions
We study the second order finite temperature Mott transition point in the
fully frustrated Hubbard model at half filling, within Dynamical Mean Field
Theory. Using quantum Monte Carlo simulations we show the existence of a finite
temperature second order critical point by explicitly demonstrating the
existence of a divergent susceptibility as well as by finding coexistence in
the low temperature phase. We determine the location of the finite temperature
Mott critical point in the (U,T) plane. Our study verifies and quantifies a
scenario for the Mott transition proposed in earlier studies (Reviews of Modern
Physics 68, 13, 1996) of this problem.Comment: 4 RevTex pages, uses epsf, 2 figure
Equation of motion approach to the Hubbard model in infinite dimensions
We consider the Hubbard model on the infinite-dimensional Bethe lattice and
construct a systematic series of self-consistent approximations to the
one-particle Green's function, . The first
equations of motion are exactly fullfilled by and the
'th equation of motion is decoupled following a simple set of decoupling
rules. corresponds to the Hubbard-III approximation. We
present analytic and numerical results for the Mott-Hubbard transition at half
filling for .Comment: 10pager, REVTEX, 8-figures not available in postscript, manuscript
may be understood without figure
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