Charge ordering and chemical potential shift in La2−x_{2-x}Srx_xNiO4_4 studied by photoemission spectroscopy

We have studied the chemical potential shift in La$_{2-x}$Sr$_x$NiO$_4$ and the charge ordering transition in La$_{1.67}$Sr$_{0.33}$NiO$_4$ by photoemission spectroscopy. The result shows a large ($\sim$ 1 eV/hole) downward shift of the chemical potential with hole doping in the high-doping regime ($\delta \gtrsim$ 0.33) while the shift is suppressed in the low-doping regime ($\delta \lesssim$ 0.33). This suppression is attributed to a segregation of doped holes on a microscopic scale when the hole concentration is lower than $\delta \simeq 1/3$. In the $\delta = 1/3$ sample, the photoemission intensity at the chemical potential vanishes below the charge ordering transition temperature $T_{\rm CO}=$ 240 K.Comment: 5 pages, 4 figure

Chemical Potential Shift in Nd2−x_{2-x}Cex_{x}CuO4_{4}: Contrasting Behaviors of the Electron- and Hole-Doped Cuprates

We have studied the chemical potential shift in the electron-doped superconductor Nd$_{2-x}$Ce$_{x}$CuO$_{4}$ by precise measurements of core-level photoemission spectra. The result shows that the chemical potential monotonously increases with electron doping, quite differently from La$_{2-x}$Sr$_{x}$CuO$_{4}$, where the shift is suppressed in the underdoped region. If the suppression of the shift in La$_{2-x}$Sr$_{x}$CuO$_{4}$ is attributed to strong stripe fluctuations, the monotonous increase of the chemical potential is consistent with the absence of stripe fluctuations in Nd$_{2-x}$Ce$_{x}$CuO$_{4}$. The chemical potential jump between Nd$_{2}$CuO$_{4}$ and La$_{2}$CuO$_{4}$ is found to be much smaller than the optical band gaps.Comment: 4 pages, 5 figure

Charge Stripes and Antiferromagnetism in Insulating Nickelates and Superconducting Cuprates

Neutron and X-ray scattering studies have provided strong evidence for coupled spatial modulations of charge and spin densities in layered nickelates and cuprates. The accumulated results for La(2-x)Sr(x)NiO(4+d) are consistent with the strongly-modulated topological-stripe concept. Clues from Nd-doped La(2-x)Sr(x)CuO(4) suggest similar behavior for the cuprates. The experimental results are summarized, and features that conflict with an interpretation based on a Fermi-surface instability are emphasized. A rationalization for the differences in transport properties between the cuprates and nickelates is given.Comment: 10pp., uses elsart.sty, 3 eps figures embedded with psfig; for proceedings of Spectroscopies in Novel Superconductors '97, J. Phys. Chem. Solid

Distribution of spectral weight in a system with disordered stripes

The ``band-structure'' of a disordered stripe array is computed and compared, at a qualitative level, to angle resolved photoemission experiments on the cuprate high temperature superconductors. The low-energy states are found to be strongly localized transverse to the stripe direction, so the electron dynamics is strictly one-dimensional (along the stripe). Despite this, aspects of the two dimensional band-structure Fermi surface are still vividly apparent.Comment: 10 pages, 11 figure

DDW Order and its Role in the Phase Diagram of Extended Hubbard Models

We show in a mean-field calculation that phase diagrams remarkably similar to those recently proposed for the cuprates arise in simple microscopic models of interacting electrons near half-filling. The models are extended Hubbard models with nearest neighbor interaction and correlated hopping. The underdoped region of the phase diagram features $d_{{x^2}-{y^2}}$ density-wave (DDW) order. In a certain regime of temperature and doping, DDW order coexists with antiferromagnetic (AF) order. For larger doping, it coexists with $d_{{x^2}-{y^2}}$ superconductivity (DSC). While phase diagrams of this form are robust, they are not inevitable. For other reasonable values of the coupling constants, drastically different phase diagrams are obtained. We comment on implications for the cuprates.Comment: 7 pages, 3 figure

Magnetotransport in the Normal State of La1.85Sr0.15Cu(1-y)Zn(y)O4 Films

We have studied the magnetotransport properties in the normal state for a series of La1.85Sr0.15Cu(1-y)Zn(y)O4 films with values of y, between 0 and 0.12. A variable degree of compressive or tensile strain results from the lattice mismatch between the substrate and the film, and affects the transport properties differently from the influence of the zinc impurities. In particular, the orbital magnetoresistance (OMR) varies with y but is strain-independent. The relations for the resistivity and the Hall angle and the proportionality between the OMR and tan^2 theta are followed about 70 K. We have been able to separate the strain and impurity effects by rewriting the above relations, where each term is strain-independent and depends on y only. We also find that changes in the lattice constants give rise to closely the same fractional changes in other terms of the equation.The OMR is more strongly supressed by the addition of impurities than tan^2 theta. We conclude that the relaxation ratethat governs Hall effect is not the same as for the magnetoresistance. We also suggest a correspondence between the transport properties and the opening of the pseudogap at a temperature which changes when the La-sr ratio changes, but does not change with the addition of the zinc impurities

Stability of metallic stripes in the extended one-band Hubbard model

Based on an unrestricted Gutzwiller approximation (GA) we investigate the stripe orientation and periodicity in an extended one-band Hubbard model. A negative ratio between next-nearest and nearest neighbor hopping t'/t, as appropriate for cuprates, favors partially filled (metallic) stripes for both vertical and diagonal configurations. At around optimal doping diagonal stripes, site centered (SC) and bond centered (BC) vertical stripes become degenerate suggesting strong lateral and orientational fluctuations. We find that within the GA the resulting phase diagram is in agreement with experiment whereas it is not in the Hartree-Fock approximation due to a strong overestimation of the stripe filling. Results are in agreement with previous calculations within the three-band Hubbard model but with the role of SC and BC stripes interchanged.Comment: 10 pages, 8 figure

Theory of Kondo lattices and its application to high-temperature superconductivity and pseudo-gaps in cuprate oxides

A theory of Kondo lattices is developed for the t-J model on a square lattice. The spin susceptibility is described in a form consistent with a physical picture of Kondo lattices: Local spin fluctuations at different sites interact with each other by a bare intersite exchange interaction, which is mainly composed of two terms such as the superexchange interaction, which arises from the virtual exchange of spin-channel pair excitations of electrons across the Mott-Hubbard gap, and an exchange interaction arising from that of Gutzwiller's quasi-particles. The bare exchange interaction is enhanced by intersite spin fluctuations developed because of itself. The enhanced exchange interaction is responsible for the development of superconducting fluctuations as well as the Cooper pairing between Gutzwiller's quasi-particles. On the basis of the microscopic theory, we develop a phenomenological theory of low-temperature superconductivity and pseudo-gaps in the under-doped region as well as high-temperature superconductivity in the optimal-doped region. Anisotropic pseudo-gaps open mainly because of d\gamma-wave superconducting low-energy fluctuations: Quasi-particle spectra around (\pm\pi/a,0) and (0,\pm\pi/a), with a the lattice constant, or X points at the chemical potential are swept away by strong inelastic scatterings, and quasi-particles are well defined only around (\pm\pi/2a,\pm\pi/2a) on the Fermi surface or line. As temperatures decrease in the vicinity of superconducting critical temperatures, pseudo-gaps become smaller and the well-defined region is extending toward X points. The condensation of d\gamma-wave Cooper pairs eventually occurs at low enough temperatures when the pair breaking by inelastic scatterings becomes small enough.Comment: 15 pages, 14 figure

Pentagonal nanowires: a first-principles study of atomic and electronic structure

We performed an extensive first-principles study of nanowires in various pentagonal structures by using pseudopotential plane wave method within the density functional theory. Our results show that nanowires of different types of elements, such as alkali, simple, transition and noble metals and inert gas atoms, have a stable structure made from staggered pentagons with a linear chain perpendicular to the planes of the pentagons and passing through their centers. This structure exhibits bond angles close to those in the icosahedral structure. However, silicon is found to be energetically more favorable in the eclipsed pentagonal structure. These quasi one dimensional pentagonal nanowires have higher cohesive energies than many other one dimensional structures and hence may be realized experimentally. The effect of magnetic state are examined by spin-polarized calculations. The origin of the stability are discussed by examining optimized structural parameters, charge density and electronic band structure, and by using analysis based on the empirical Lennard-Jones type interaction. Electronic band structure of pentagonal wires of different elements are discussed and their effects on quantum ballistic conductance are mentioned. It is found that the pentagonal wire of silicon exhibits metallic band structure.Comment: 4 figures, accepted for publication in Phys. Rev.

Spectral functions, Fermi surface and pseudogap in the t-J model

Spectral functions within the generalized t-J model as relevant to cuprates are analyzed using the method of equations of motion for projected fermion operators. In the evaluation of the self energy the decoupling of spin and single-particle fluctuations is performed. It is shown that in an undoped antiferromagnet (AFM) the method reproduces the selfconsistent Born approximation. For finite doping with short range AFM order the approximation evolves into a paramagnon contribution which retains large incoherent contribution in the hole part of the spectral function as well as the hole-pocket-like Fermi surface at low doping. On the other hand, the contribution of (longitudinal) spin fluctuations, with the coupling mostly determined predominantly by J and next-neighbor hopping t', is essential for the emergence of the pseudogap. The latter shows at low doping in the effective truncation of the large Fermi surface, reduced electron density of states and at the same time quasiparticle density of states at the Fermi level.Comment: RevTex, 13 pages, 11 figures (5 color