Search

We present a comprehensive study of the low-temperature heat capacity and thermal expansion of single crystals of the hole-doped Ba1-xKxFe2As2 series (0, Comment: Submitted to Phys. Rev. B

An extensive calorimetric study of the normal- and superconducting-state properties of Ba(Fe1-xCox)2As2 is presented for 0 < x < 0.2. The normal-state Sommerfeld coefficient increases (decreases) with Co doping for x < 0.06 (x > 0.06), which illustrates the strong competition between magnetism and superconductivity to monopolize the Fermi surface in the underdoped region and the filling of the hole bands for overdoped Ba(Fe1-xCox)2As2. All superconducting samples exhibit a residual electronic density of states of unknown origin in the zero-temperature limit, which is minimal at optimal doping but increases to the normal-state value in the strongly under- and over-doped regions. The remaining specific heat in the superconducting state is well described using a two-band model with isotropic s-wave superconducting gaps., Submitted to Europhysics Letters

The mechanism of high-temperature superconductivity (HTS) and the correlation between the antiferromagnetic long-range order (AFLRO) and superconductivity (SC) phases are the central issues of the study of HTS theory. SC and AFLRO of the hole-doped two-dimensional extended t- J model are studied by the variational Monte Carlo method. The results show that SC is greatly enhanced by the long-range hopping terms t' and t" for the optimal and overdoped cases. The phase of coexisting SC and AFM in the t-J model disappears when t and t" are included. It is concluded that the extended t-J model provides a more accurate description for HTS than the traditional t-J model does. The momentum distribution function n(k) and the shape of Fermi surface play critical roles for establishing the phase diagram of HTS materials.

The electronic structure and the single-particle spectral density of a stripe array formed by ladder-like domain walls (DWs) and by antiferromagnetic (AF) domains of width 2 lattice spacings are computed and compared with ARPES spectra from some doped cuprates belonging to the 214 family of compounds. We assume that bond order is formed on legs in DWs and that the phase of the sublattice magnetization changes by Pi across each DW. The intensity map plotted in the coordination frame momentum-energy reproduces quite well the ARPES spectra obtained at the doping level of 15%. We consider this agreement as an argument for a scenario of coexisting bond-ordered regions and AF regions in the stripe phase of moderately doped cuprates., 16 pages, 8 figures

Motivated by recent inelastic neutron scattering experiments on cuprates, we discuss the formation of bond order in the stripe phase. We suggest that the spin Peierls order emerges in hole-rich domain walls (DWs) formed between hole-poor regions in which long-range antiferromagnetic (AF) correlations exist. On the example of a single stripe we analyze the stability of such structures. The motion of a hole inside the DW which takes the form of a bond ordered ladder is in principle unrestricted. The hole hopping in domains is to some extent obscured by the fact that a moving hole spoils AF correlations. The propagation of a hole along the stripe which takes the form of the ladder-like domain wall that separates antiphase AF domains is a combination of these two types of motion occurring in two different environments. By analyzing the energy dispersion of a quasiparticle propagating along the bond-centered, bond-ordered stripe and of a quasiparticle propagating along the site-centered stripe we deduce that bond ordered stripes are stable at the total doping level 1/8 and the linear stripe-filling level 1/2. This conclusion seems to be relevant to the nature of the stripe phase in La_1.875 Ba_0.125 Cu O_4., 18 pages, 9 figures

We investigate the effects of the next-nearest-neighbor ($t'$) and the third-nearest-neighbor (t") hopping terms on superconductivity (SC) correlation in the 2D hole-doped extended t-J model based on the variational Monte-Carlo (VMC), mean-field (MF) calculation, and exact diagonalization (ED) method. Despite of the diversity of the methods employed, the results all point to a consistent conclusion: While the d-wave SC correlation is slightly suppressed by t' and t" in underdoped regions, it is greatly enhanced in the optimal and overdoped regions. The optimal T_c is a result upon balance of these two opposite trends., Comment: 5 figures, submitted to Phys. Rev. Lett

The 2D t-J model with and without t' and t'' hopping-terms is studied by exact diagonalization on a 5 x 4 cluster, which realizes a hole stripe in y-direction in a dimerized singlet background. Next nearest hopping terms with a sign appropriate for hole-doped cuprates enhance the stripe formation. The dispersion of the quasiparticle-peaks in the single-particle spectrum is in good agreement with a simple bond operator theory for hole motion in the spin-Peierls phase, particularly so for realistic values of t' and t''. The resulting spectral weight distribution and Fermi surface agree well with experimental ARPES spectra on La_1.28 Nd_0.6 Sr_0.12 Cu O_4., 4 pages with 3 eps-figures

We study the electronic structure of the doped paramagnetic insulator by finite temperature Quantum Monte-Carlo simulations for the 2D Hubbard model. Throughout we use the moderately high temperature T=0.33t, where the spin correlation length has dropped to < 1.5 lattice spacings, and study the evolution of the band structure with hole doping. The effect of doping can be best described as a rigid shift of the chemical potential into the lower Hubbard band, accompanied by some transfer of spectral weight. For hole dopings, RevTex-file, 4 PRB pages with 5 eps figures. Hardcopies of figures (or the entire manuscript) can be obtained by e-mail request to: eder@physik.uni-wuerzburg.de

Numerical and analytical results are reviewed, which support SO(5) symmetry as a concept unifying superconductivity and antiferromagnetism in the high-temperature superconductors. Exact cluster diagonalizations verify that the low-energy states of the two-dimensional t-J and Hubbard models, widely used microscopic models for the high-Tc cuprates, form SO(5) symmetry multiplets. Apart from a small standard deviation ~J/10, these multiplets become degenerate at a critical chemical potential (transition into doped system). As a consequence, the d-wave superconducting states away from half-filling are obtained from the higher spin states at half-filling through SO(5) rotations. Between one and two dimensions, using weak-coupling renormalization, a rather general ladder Hamiltonian including next-nearest-neighbor hopping can be shown to flow to an SO(5) symmetric point. Experimental tests and consequences such as the existence of a pi-Goldstone mode both in the insulator and superconductor and, in particular, the relationship between the photoemission spectra of the insulator and superconductor, are emphasized., LaTeX, 12 pages, 9 postscript figures. To appear in: Festkoerperprobleme/Advances in Solid State Physics

An exact-diagonalization technique on finite-size clusters is used to study the ground state and excitation spectra of the two-dimensional effective-fermion model, a fictious model of hole quasiparticles derived from numerical studies of the two-dimensional t-J model at low doping. We show that then is actually a reasonable range of parameter values where the d(x)2(-y)2-wave pairing of holes occurs and the low-lying excitation can be described by the picture of Bogoliubov quasiparticles in the BCS pairing theory. The gap parameter of a size Delta(d) similar or equal to 0.13\V\ (where V is the attractive interaction between holes) is estimated ar low doping levels. The paired state gives way to the state of clustering of holes for some stronger attractions.

We present a k-dependent study of the single hole states in Sr2CuO2Cl2. We demonstrate that the controversial ''1 eV peaks'' in the high T-c's are quasiparticles derived from the same O 2p states as the Zhang-Rice (ZR) singlets, but of different symmetry and intensity in those regions of the Brillouin zone where the hybridization with the correlated Cu 3d states vanishes by symmetry. We use this new source of information to estimate the quasiparticle weight of the ZR singlets, discuss the quasiparticle line shape, and suggest a strong k dependence of the self-energy.

We study the momentum distribution function n(k) in the 2D t-J model on small clusters by exact diagonalization. We show that n(k) can be decomposed systematically into two components with Bosonic and Fermionic doping dependence. The Bosonic component originates from the incoherent motion of holes and has no significance for the low energy physics. For the Fermionic component we exlicitely perform the one-to-one Landau mapping between the low lying eigenstates of the t-J model clusters and those of an equivalent system of spin-1/2 quasiparticles. This mapping allows to extract the quasiparticle dispersion, statistics, and Landau parameters. The results show conclusively that the 2D t-J model for small doping is a Fermi liquid with a `small' Fermi surface and a moderately strong attractive interaction between the quasiparticles., Comment: Revtex file, 5 pages with 5 embedded eps-files, hardcopies of figures (or the entire manuscript) can be obtained by e-mail request to: eder@vsf1.phys.rug.nl

We use numerical and analytical results to construct a simple ansatz for the energy dynamical correlation function of the 1D antiferromagnetic Heisenberg model. This is applied to compute the phonon assisted absorption spectra of magnetic excitations (spinons) in quasi-one dimensional spin 1/2 insulators and show to reproduce very well recent infrared measurements in Sr$_2$CuO$_3$., Revtex, 4 pages

An exact-diagonalization technique on small clusters is used to study low-lying excitations and superconductivity in the two-dimensional negative-$U$ Hubbard model. We first calculate the Bogoliubov-quasiparticle spectrum, condensation amplitude, and coherence length as functions of the coupling strength $U/t$, thereby working out how the picture of Bogoliubov quasiparticles in the BCS superconductors is affected by increasing the attraction. We then define the Cooper-pair operator as a spatially-extended composite boson and make a variational evaluation of its internal structure. We thereby calculate the single-particle spectral function of the Cooper pair and obtain the dispersion relation for its translational motion. The dynamical density correlation function of the pairs is also calculated. We thus demonstrate the applicability of our numerical method for gaining insight into low-lying excitations of models for the intermediate coupling superconductivity relevant to cuprate materials., 4 pages, revtex, figures will be sent upon request

We present an exact diagonalization study of bilayer clusters of the t-J model. Our results indicate a crossover between two markedly different regimes which occurs when the ratio J(perpendicular to)/J between interlayer and intralayer exchange constants increases: for small J(perpendicular to)/J the data suggest the development of three-dimensional antiferromagnetic correlations without appreciable degradation of the intralayer spin order and the d(x2-y2) hole pairs within the planes persist. For larger values of J(perpendicular to)/J local singlets along the interlayer bonds dominate, leading to an almost complete suppression of the intralayer spin correlation and the breaking of the intralayer hole pairs. The ground state with two holes in this regime has s-like symmetry. We present data for static spin correlation function, magnetic structure factor and spin gap. We calculate the momentum distribution and electronic spectral function of the ''local singlet state'' realized for large J(perpendicular to)/J, and show that it deviates markedly from that of a single layer, making it an implausible candidate for modeling high-temperature superconductors.

A detailed exact-diagonalization study is made for the doping dependence of the single-particle spectral function $A({\bf k},\omega)$ and momentum distribution function $n({\bf k})$ of the two-dimensional $t$$-$$J$ model as a representative model for doped Mott insulators. The results for $A({\bf k},\omega)$ show unambiguously that the rigid-band behavior is realized in the small-cluster $t$$-$$J$ model: upon doping, the uppermost states of the quasiparticle band observed at half filling simply cross the Fermi level and reappear as the lowermost states of the inverse photoemission spectrum, while the photoemission side of the band remains essentially unaffected. We discuss problems in directly determining the Fermi surface from $n({\bf k})$ and make a situation where they are largely avoided; we then find clear signatures of a Fermi surface which takes the form of small hole pockets. The identical scaling with $t/J$ of the quasiparticle weight $Z_h$ and difference in $n({\bf k})$ between neighboring ${\bf k}$-points suggests the existence of such a Fermi surface in the physical regime of parameters. We construct spin-bag operators which describe the holes dressed by the antiferromagnetic spin fluctuations and find that elementary electronic excitations of the system can be described well in terms of weakly-interacting spin-1/2 Fermionic quasiparticles corresponding to the doped holes. We make a comparison with other numerical calculations and recent angle-resolved photoemission experiment and argue that, adopting this rather conventional Fermi-liquid scenario with non-Luttinger Fermi surface, one would explain many quasiparticle-relating properties of doped cuprates in a very simple and natural way. We also show that the dynamical spin and charge excitations deviate from the particle-hole excitations of this Fermi liquid: e.g., the dominant low-energy spin excitation at momentum transfer $(\pi,\pi)$ reflects excitations of the incoherent spin background and is identified as a collective mode comparable to spin waves in the Heisenberg antiferromagnet., Comment: 12 pages, PlainTex, hard copy with figures available upon request