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Thereza Paiva

Publications and source records attributed to Thereza Paiva.

51 records · Page 3Linked to original sources

Disordered two-dimensional superconductors: roles of temperature and interaction strength

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 $f$ of sites, while keeping a finite $U$ on the remaining ones. Through Quantum Monte Carlo (QMC) simulations for several values of $f$ and $U$, and for system sizes ranging from $8\times 8$ to $16\times 16$, we have calculated the configurational averages of the equal-time pair structure factor $P_s$, and, for a more restricted set of variables, the helicity modulus, $ρ_s$, as functions of temperature. Two finite-size scaling {\it ansatze} for $P_s$ 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, $f_c$, which increases with $U$, at least up to U=4 (in units of the hopping energy). Also, the normalized zero-temperature gap as a function of $f$ shows a maximum near $f\sim 0.07$, for $2\lesssim U\lesssim 6$. Analyses of the helicity modulus and of the pair structure factor led to the determination of the critical temperature as a function of $f$, for $U=3,$ 4 and 6: they also show maxima near $f\sim 0.07$, with the highest $T_c$ increasing with $U$ in this range. We argue that, overall, the observed behavior results from both the breakdown of CDW-superconductivity degeneracy and the fact that free sites tend to "push" electrons towards attractive sites, the latter effect being more drastic at weak couplings.

cond-mat.supr-con↗

Height and roughness distributions in thin films with Kardar-Parisi-Zhang scaling

We study height and roughness distributions of films grown with discrete Kardar-Parisi-Zhang (KPZ) models in a small time regime which is expected to parallel the typical experimental conditions. Those distributions are measured with square windows of sizes $8\leq r\leq 128$ gliding through a much larger surface. Results for models with weak finite-size corrections indicate that the absolute value of the skewness and the value of the kurtosis of height distributions converge to $0.2\leq |S|\leq 0.3$ and $0\leq Q\leq 0.5$, respectively. Despite the low accuracy of these results, they give additional support to a recent claim of KPZ scaling in oligomer films. However, there are significant finite-size effects in the scaled height distributions of models with large local slopes, such as ballistic deposition, which suggests that comparison of height distributions must not be used to rule out KPZ scaling. On the other hand, roughness distributions of the same models show good data collapse, with negligible dependence on time and window size. The estimates of skewness and kurtosis for roughness distributions are $1.7\leq S\leq 2$ and $3\leq Q\leq 7$. A stretched exponential tail was found, which seems to be a particular feature of KPZ systems in 2+1 dimensions. Moreover, the KPZ roughness distributions cannot be fitted by those of $1/f^α$ noise. This study suggests that the roughness distribution is the best option to test KPZ scaling in the growth regime, and provides quantitative data for future comparison with other models or experiments.

cond-mat.stat-mech↗

Modulation of charge-density waves by superlattice structures

We discuss the interplay between electronic correlations and an underlying superlattice structure in determining the period of charge density waves (CDW's), by considering a one-dimensional Hubbard model with a repeated (non-random) pattern of repulsive (U>0) and free (U=0) sites. Density matrix renormalization group diagonalization of finite systems (up to 120 sites) is used to calculate the charge-density correlation function and structure factor in the ground state. The modulation period can still be predicted through effective Fermi wavevectors, k_F*, and densities, and we have found that it is much more sensitive to electron (or hole) doping, both because of the narrow range of densities needed to go from q*=0 to π, but also due to sharp 2k_F*-4k_F* transitions; these features render CDW's more versatile for actual applications in heterostructures than in homogeneous systems.

cond-mat.str-el↗

The magnetic susceptibility of exchange-disordered antiferromagnetic finite chains

The low-temperature behavior of the static magnetic susceptibility $χ(T)$ of exchange-disordered antiferromagnetic spin chains is investigated. It is shown that for a relatively small and even number of spins in the chain, two exchange distributions which are expected to occur in nanochains of P donors in silicon lead to qualitatively distinct behaviors of the low-temperature susceptibility. As a consequence, magnetic measurements might be useful to characterize whether a given sample meets the requirements compatible with Kane's original proposalfor the exchange gates in a silicon-based quantum computer hardware. We also explore the dependence of $χ(T)$ on the number of spins in the chain as it increases towards the thermodynamic limit, where any degree or distribution of disorder leads to the same low-temperature scaling behavior. We identify a crossover regime where the two distributions of disorder may not be clearly differentiated, but the characteristic scaling of the thermodynamic limit has not yet been reached.

cond-mat.stat-mech↗

Destruction of Superconductivity by Impurities in the Attractive Hubbard Model

We study the effect of U=0 impurities on the superconducting and thermodynamic properties of the attractive Hubbard model on a square lattice. Removal of the interaction on a critical fraction of $f_{\rm crit} \approx 0.30$ of the sites results in the destruction of off-diagonal long range order in the ground state. This critical fraction is roughly independent of filling in the range $0.75 < ρ< 1.00$, although our data suggest that $f_{\rm crit}$ might be somewhat larger below half-filling than at $ρ=1$. We also find that the two peak structure in the specific heat is present at $f$ both below and above the value which destroys long range pairing order. It is expected that the high $T$ peak associated with local pair formation should be robust, but apparently local pairing fluctuations are sufficient to generate a low temperature peak.

cond-mat.supr-con↗

Ground state and finite temperature signatures of quantum phase transitions in the half-filled Hubbard model on a honeycomb lattice

We investigate ground state and finite temperature properties of the half-filled Hubbard model on a honeycomb lattice using quantum monte carlo and series expansion techniques. Unlike the square lattice, for which magnetic order exists at T=0 for any non-zero $U$, the honeycomb lattice is known to have a semi-metal phase at small $U$ and an antiferromagnetic one at large $U$. We investigate the phase transition at T=0 by studying the magnetic structure$and compressibility using quantum monte carlo simulations and by calculating the sublattice magnetization, uniform susceptibility, spin-wave and single hole %single-particle dispersion using series expansions around the ordered phase. Our results are consistent with a single continuous transition at $U_c/t$ in the range 4-5. Finite temperature signatures of this phase transition are seen in the behavior of the specific heat, $C(T)$, which changes from a two-peaked structure for $U>U_c$ to a one-peaked structure for $U < U_c$. Furthermore, the $U$ dependence of the low temperature coefficient of $C(T)$ exhibits an anomaly at $U \approx U_c$.

cond-mat.str-el↗

Critical temperature for the two-dimensional attractive Hubbard Model

The critical temperature for the attractive Hubbard model on a square lattice is determined from the analysis of two independent quantities, the helicity modulus, $ρ_s$, and the pairing correlation function, $P_s$. These quantities have been calculated through Quantum Monte Carlo simulations for lattices up to $18\times 18$, and for several densities, in the intermediate-coupling regime. Imposing the universal-jump condition for an accurately calculated $ρ_s$, 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.

cond-mat.str-el↗

Doping-dependent study of the periodic Anderson model in three dimensions

We study a simple model for $f$-electron systems, the three-dimensional periodic Anderson model, in which localized $f$ states hybridize with neighboring $d$ states. The $f$ states have a strong on-site repulsion which suppresses the double occupancy and can lead to the formation of a Mott-Hubbard insulator. When the hybridization between the $f$ and $d$ states increases, the effects of these strong electron correlations gradually diminish, giving rise to interesting phenomena on the way. We use the exact quantum Monte-Carlo, approximate diagrammatic fluctuation-exchange approximation, and mean-field Hartree-Fock methods to calculate the local moment, entropy, antiferromagnetic structure factor, singlet-correlator, and internal energy as a function of the $f-d$ hybridization for various dopings. Finally, we discuss the relevance of this work to the volume-collapse phenomenon experimentally observed in f-electron systems.

cond-mat.str-el↗

A layering model for superconductivity in the borocarbides

We propose a superlattice model to describe superconductivity in layered materials, such as the borocarbide families with the chemical formulæ $RT_2$B$_2$C and $RT$BC, with $R$ being (essentially) a rare earth, and $T$ a transition metal. We assume a single band in which electrons feel a local attractive interaction (negative Hubbard-$U$) on sites representing the $T$B layers, while U=0 on sites representing the $R$C layers; the multi-band structure is taken into account minimally through a band offset $ε$. The one-dimensional model is studied numerically through the calculation of the charge gap, the Drude weight, and of the pairing correlation function. A comparison with the available information on the nature of the electronic ground state (metallic or superconducting) indicates that the model provides a systematic parametrization of the whole borocarbide family.

cond-mat.supr-con↗

Multiperiodic magnetic structures in Hubbard superlattices

We consider fermions in one-dimensional superlattices (SL's), modeled by site-dependent Hubbard-U couplings arranged in a repeated pattern of repulsive (i.e., U>0) and free (U=0) sites. Density Matrix Renormalization Group (DMRG) diagonalization of finite systems is used to calculate the local moment and the magnetic structure factor in the ground state. We have found four regimes for magnetic behavior: uniform local moments forming a spin-density wave (SDW), `floppy' local moments with short-ranged correlations, local moments on repulsive sites forming long-period SDW's superimposed with short-ranged correlations, and local moments on repulsive sites solely with long-period SDW's; the boundaries between these regimes depend on the range of electronic densities, rho, and on the SL aspect ratio. Above a critical electronic density, rho_{uparrow downarrow}, the SDW period oscillates both with rho and with the spacer thickness. The former oscillation allows one to reproduce all SDW wave vectors within a small range of electronic densities, unlike the homogeneous system. The latter oscillation is related to the exchange oscillation observed in magnetic multilayers. A crossover between regimes of `thin' to `thick' layers has also been observed.

cond-mat.str-el↗

Charge-density waves in one-dimensional Hubbard superlattices

We study the formation of charge density waves (CDW's) in one-dimensional Hubbard superlattices, modeled by a repeated pattern of repulsive (U>0) and free (U=0) sites. By means of Lanczos diagonalizations for the ground state, we calculate the charge structure factor. Our results show that while the superlattice structure affects the modulation of the charge density waves, the periodicity can still be predicted through an effective density. We also show that, for a fixed repulsive layer thickness, the periodicity of the CDW is an oscillatory function of the free layer thickness.

cond-mat.str-el↗

Signatures of Spin and Charge Energy Scales in the Local Moment and Specific Heat of the Two-Dimensional Hubbard Model

Local moment formation driven by the on--site repulsion $U$ is one of the most fundamental features in the Hubbard model. At the simplest level, the temperature dependence of the local moment is expected to have a single structure at $T \sim U$, reflecting the suppression of the double occupancy. In this paper we show new low temperature Quantum Monte Carlo data which emphasize that the local moment also has a signature at a lower energy scale which previously had been thought to characterize only the temperatures below which moments on {\it different} sites begin to correlate locally. We discuss implications of these results for the structure of the specific heat, and connections to quasiparticle resonance and pseudogap formation in the density of states.

cond-mat.str-el↗

Charge-density waves in the Hubbard chain: evidence for 4k_F instability

Charge density waves in the Hubbard chain are studied by means of finite-temperature Quantum Monte Carlo simulations and Lanczos diagonalizations for the ground state. We present results both for the charge susceptibilities and for the charge structure factor at densities ρ=1/6 and 1/3; for ρ=1/2 (quarter filled) we only present results for the charge structure factor. The data are consistent with a 4k_F instability dominating over the 2k_F one, at least for sufficiently large values of the Coulomb repulsion, U. This can only be reconciled with the Luttinger liquid analyses if the amplitude of the 2k_F contribution vanishes above some U^*(ρ).

cond-mat.str-el↗

Field-induced Ordering in Critical Antiferromagnets

Transfer-matrix scaling methods have been used to study critical properties of field-induced phase transitions of two distinct two-dimensional antiferromagnets with discrete-symmetry order parameters: triangular-lattice Ising systems (TIAF) and the square-lattice three-state Potts model (SPAF-3). Our main findings are summarised as follows. For TIAF, we have shown that the critical line leaves the zero-temperature, zero -field fixed point at a finite angle. Our best estimate of the slope at the origin is $(dT_c/dH)_{T=H=0} = 4.74 \pm 0.15$. For SPAF-3 we provided evidence that the zero-field correlation length diverges as $ξ(T \to 0, H=0) \simeq \exp (a/T^{x})$, with $x=1.08 \pm 0.13$, through analysis of the critical curve at $H \neq 0$ plus crossover arguments. For SPAF-3 we have also ascertained that the conformal anomaly and decay-of-correlations exponent behave as: (a) H=0: $c=1, η=1/3$; (b) $H \neq 0: c=1/2, η=1/4$.

cond-mat.stat-mech↗

Metal-Insulator transition in one-dimensional Hubbard superlattices

We study the Metal-Insulator transition in one-dimensional Hubbard superlattices (SL's), modelled by a repeated pattern of repulsive (i.e., positive on-site coupling) and free sites. The evolution of the local moment and of the charge gap (calculated from Lanczos diagonalization of chains up to 18 sites), together with a strong coupling analysis, show that the electron density at which the system is insulating increases with the size of the free layer, relative to the repulsive one. In the insulating state, the mechanism of interaction between fermions separated by a free layer is the analog of superexchange, and the charge gap display universal features.

cond-mat.str-el↗