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arXiv:cond-mat/0403397 · Physical Review B

Critical temperature for the two-dimensional attractive Hubbard model

Thereza Paiva, Raimundo R. dos Santos, Richard T. Scalettar, P. J. H. Denteneer

Published May 3, 2004• 111 citations
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Abstract

The critical temperature for the attractive Hubbard model on a square lattice is determined from the analysis of two independent quantities, the helicity modulus ${\ensuremath{\rho}}_{s}$ and the pairing correlation function ${P}_{s}.$ These quantities have been calculated through quantum Monte Carlo simulations for lattices up to $18\ifmmode\times\else\texttimes\fi{}18,$ and for several densities, in the intermediate-coupling regime. Imposing the universal-jump condition for an accurately calculated ${\ensuremath{\rho}}_{s},$ together with thorough finite-size scaling analyses (in the spirit of the phenomenological renormalization group) of ${P}_{s},$ suggests that ${T}_{c}$ is considerably higher than hitherto assumed.

DOI
10.1103/physrevb.69.184501

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The critical temperature for the attractive Hubbard model on a square lattice is determined from the analysis of two independent quantities, the helicity modulus \ensuremathρs{\ensuremath{\rho}}_{s}\ensuremathρs​ and the pairing correlation function Ps.{P}_{s}.Ps​. These quantities have been calculated through quantum Monte Carlo simulations for lattices up to 18\ifmmode×\else\texttimes\fi18,18\ifmmode\times\else\texttimes\fi{}18,18\ifmmode×\else\texttimes\fi18, and for several densities, in the intermediate-coupling regime. Imposing the universal-jump condition for an accurately calculated \ensuremathρs,{\ensuremath{\rho}}_{s},\ensuremathρs​, together with thorough finite-size scaling analyses (in the spirit of the phenomenological renormalization group) of Ps,{P}_{s},Ps​, suggests that Tc{T}_{c}Tc​ is considerably higher than hitherto assumed.
We have considered the half-filled disordered attractive Hubbard model on a square lattice, in which the on-site attraction is switched off on a fraction fff of sites, while keeping a finite UUU on the remaining ones. Through quantum Monte Carlo simulations for several values of fff and UUU and for system sizes ranging from $8\ifmmode\times\else\texttimes\fi{}8$ to $16\ifmmode\times\else\texttimes\fi{}16$, we have calculated the configurational averages of the equal-time pair structure factor Ps{P}_{s}Ps​ and, for a more restricted set of variables, the helicity modulus ${\ensuremath{\rho}}_{s}$, as functions of temperature. Two finite-size scaling Ans\"atze for Ps{P}_{s}Ps​ have been used: one for zero temperature and the other for finite temperatures. We have found that the system sustains superconductivity in the ground state up to a critical impurity concentration fc{f}_{c}fc​, which increases with UUU, at least up to U=4U=4U=4 (in units of the hopping energy). Also, the normalized zero-temperature gap as a function of fff shows a maximum near $f\ensuremath{\sim}0.07$ for $2\ensuremath{\lesssim}U\ensuremath{\lesssim}6$. Analyses of the helicity modulus and of the pair structure factor led to the determination of the critical temperature as a function of fff for U=3U=3U=3, 4, and 6: they also show maxima near $f\ensuremath{\sim}0.07$, with the highest Tc{T}_{c}Tc​ increasing with UUU in this range. We argue that, overall, the observed behavior results from both the breakdown of charge-density-wave-superconductivity degeneracy and the fact that free sites tend to ``push'' electrons toward attractive sites; the latter effect being more drastic at weak couplings.
The critical temperature for superconductivity for the two-dimensional attractive (negative- U ) Hubbard model on a square lattice is calculated as a function of the strength of the interaction and of the density of electrons. The critical temperature is obtained by calculating the helicity modulus associated with a wavelike distortion of the gap parameter in the BCS approximation as a function of temperature and subsequent comparison with the Kosterlitz-Thouless relation between critical temperature and helicity modulus. The adequacy of the approximations is discussed and a comparison with recent Monte Carlo calculations is made.
The helicity modulus, which is the stiffness associated with a twisted order parameter, for the two-dimensional Hubbard model is calculated for the equivalent cases of (i) attractive on-site interaction (negative U) with arbitrary strength, arbitrary electron density, and zero magnetic field and (ii) repulsive on-site interaction (positive U) with arbitrary strength, at half-filling and in an arbitrary magnetic field. An explicit formula for the helicity modulus is derived using the Bogoliubov-Hartree-Fock approximation. An improved value for the helicity modulus is obtained by performing variational Monte Carlo calculations using a Gutzwiller projected trial wave function. To within a small correction term the helicity modulus is found to be given by -1/8 the average kinetic energy. The variational Monte Carlo calculation is found to increase the value of the helicity modulus by a small amount (about 5% for intermediate values of the interaction strength) compared to the results from the Bogoliubov-Hartree-Fock approximation. In the case of attractive interaction, from a comparison with the Kosterlitz-Thouless relation between critical temperature and helicity modulus, the critical temperature for a Kosterlitz-Thouless transition is calculated and a phase diagram is obtained. An optimal critical temperature is found for an intermediate value of U. We discuss connections of our results with results in the literature on the Hubbard model using the random-phase approximation and quantum Monte Carlo calculations.
The two-dimensional attractive Hubbard model is studied in the weak-to-intermediate-coupling regime by employing a nonperturbative approach. It is shown that this approach is in quantitative agreement with Monte Carlo calculations for both single-particle and two-particle quantities. Both the density of states and the single-particle spectral weight show a pseudogap at the Fermi energy below some characteristic temperature T∗,{T}^{*},T∗, also in good agreement with quantum Monte Carlo calculations. The pseudogap is caused by critical pairing fluctuations in the low-temperature renormalized classical regime $(\ensuremath{\Elzxh}\ensuremath{\omega}<{k}_{B}T)$ of the two-dimensional system. With increasing temperature the spectral weight fills in the pseudogap instead of closing it, and the pseudogap appears earlier in the density of states than in the spectral function. Small temperature changes around T∗{T}^{*}T∗ can modify the spectral weight over frequency scales much larger than temperature. Several qualitative results for the s-wave case should remain true for d-wave superconductors.
We report the results of zero-temperature quantum Monte Carlo simulations and zero-temperature mean-field calculations of the attractive Hubbard model on chains, ladders, and square lattices. We investigated the predictability of the BCS approximation, the dimensional crossover of the pairing correlation function from one to two dimensions as a function of the ladder width, and the scaling of these correlations to the thermodynamic limit of the two-dimensional model. We found that the BCS wave function is quantitatively correct only for small values of U/t.U/t.U/t. For the system sizes, electron fillings, and interaction strengths studied, we never saw the dimensional crossover. In general, our ability to achieve the dimensional crossover and accurate scaling to the thermodynamic limit was limited by the size of the systems we could simulate. For these sizes, although we saw the necessary signature of off-diagonal long-range order, the properties of the model did not vary monotonically with increasing system size because of shell effects. We contrast this situation with the dimensional crossover and scaling to the thermodynamic limit of the Ising model.
The two-dimensional Holstein-Hubbard model is studied by means of continuous-time quantum Monte Carlo simulations. Using renormalization-group-invariant correlation ratios and finite-size extrapolation, the critical temperature of the charge-density-wave transition is determined as a function of coupling strength, phonon frequency, and Hubbard repulsion. The phase transition is demonstrated to be in the universality class of the two-dimensional Ising model and detectable via the fidelity susceptibility. The structure of the ground-state phase diagram and the possibility of a bipolaronic metal with a single-particle gap above Tc{T}_{c}Tc​ are explored.