Mixed-State Quasiparticle Spectrum for d-wave Superconductors

Controversy concerning the pairing symmetry of high-$T_c$ materials has motivated an interest in those measurable properties of superconductors for which qualitative differences exist between the s-wave and d-wave cases. We report on a comparison between the microscopic electronic properties of d-wave and s-wave superconductors in the mixed state. Our study is based on self-consistent numerical solutions of the mean-field Bogoliubov-de Gennes equations for phenomenological BCS models which have s-wave and d-wave condensates in the absence of a magnetic field. We discuss differences between the s-wave and the d-wave local density-of-states, both near and away from vortex cores. Experimental implications for both scanning-tunneling-microscopy measurements and specific heat measurements are discussed.Comment: 10 pages, REVTEX3.0, 3 figures available upon reques

A Self-Consistent Microscopic Theory of Surface Superconductivity

The electronic structure of the superconducting surface sheath in a type-II superconductor in magnetic fields $H_{c2}<H<H_{c3}$ is calculated self-consistently using the Bogoliubov-de Gennes equations. We find that the pair potential $\Delta(x)$ exhibits pronounced Friedel oscillations near the surface, in marked contrast with the results of Ginzburg-Landau theory. The role of magnetic edge states is emphasized. The local density of states near the surface shows a significant depletion near the Fermi energy due to the development of local superconducting order. We suggest that this structure could be unveiled by scanning-tunneling microscopy studies performed near the edge of a superconducting sample.Comment: 12 pages, Revtex 3.0, 3 postscript figures appende

A Fractal Approach to Model Soil Structure and to Calculate Thermal Conductivity of Soils

Heat transport in soils depends on the spatial arrangement of solids, ice, air and water. In this study, we present a modified fractal approach to model the pore structure of soils and to describe its influence on the thermal conductivity. Three different fractal generators were sequentially applied to characterize a wide range of particle- and pore-size distributions. The given porosity and particle-size distribution of a clay, clay loam, silt loam and loamy sand were successfully modeled. The thermal conductivity of the fractal soil model was calculated using a network of resistors. We applied a renormalization approach to include the effects of smaller scale structures. The predictions were compared with the empirical Johansen' model (Johansen, 1975), that postulates a simple linear relationship between ice content and thermal conductivity. For high ice-saturated conditions, the calculated thermal conductivity agrees well with the empirical model. To describe partial ice saturation, we assumed that some pores were coated by ice films enclosing the air-filled center. In addition, we introduced a reduced heat exchange coefficient of the particles for unsaturated conditions. The ice-saturated and -unsaturated thermal conductivity calculated with this approach was very similar to that estimated by the empirical model. The variation of the thermal conductivities for different spatial arrangements of pores and particles in the prefractals were determined. Extreme values deviate more than 50% from the mean value

A unified electrostatic and cavitation model for first-principles molecular dynamics in solution

The electrostatic continuum solvent model developed by Fattebert and Gygi is combined with a first-principles formulation of the cavitation energy based on a natural quantum-mechanical definition for the surface of a solute. Despite its simplicity, the cavitation contribution calculated by this approach is found to be in remarkable agreement with that obtained by more complex algorithms relying on a large set of parameters. Our model allows for very efficient Car-Parrinello simulations of finite or extended systems in solution, and demonstrates a level of accuracy as good as that of established quantum-chemistry continuum solvent methods. We apply this approach to the study of tetracyanoethylene dimers in dichloromethane, providing valuable structural and dynamical insights on the dimerization phenomenon

SO(5) theory of insulating vortex cores in high-TcT_c materials

We study the fermionic states of the antiferromagnetically ordered vortex cores predicted to exist in the superconducting phase of the newly proposed SO(5) model of strongly correlated electrons. Our model calculation gives a natural explanation of the recent STM measurements on BSCCO, which in surprising contrast to YBCO revealed completely insulating vortex cores.Comment: 4 pages, 1 figur

Quasiparticle States at a d-Wave Vortex Core in High-Tc Superconductors: Induction of Local Spin Density Wave Order

The local density of states (LDOS) at one of the vortex lattice cores in a high Tc superconductor is studied by using a self-consistent mean field theory including interactions for both antiferromagnetism (AF) and d-wave superconductivity (DSC). The parameters are chosen in such a way that in an optimally doped sample the AF order is completely suppressed while DSC prevails. In the mixed state, we show that the local AF-like SDW order appears near the vortex core and acts as an effective local magnetic field on the quasiparticles. As a result, the LDOS at the core exhibits a double-peak structure near the Fermi level that is in good agreement with the STM observations on YBCO and BSCCO. The presence of local AF order near the votex core is also consistent with the recent neutron scattering experiment on LSCO.Comment: 4 pages, 2 ps figure

Electromagnetic response of a static vortex line in a type-II superconductor : a microscopic study

The electromagnetic response of a pinned Abrikosov fluxoid is examined in the framework of the Bogoliubov-de Gennes formalism. The matrix elements and the selection rules for both the single photon (emission - absorption) and two photon (Raman scattering) processes are obtained. The results reveal striking asymmetries: light absorption by quasiparticle pair creation or single quasiparticle scattering can occur only if the handedness of the incident radiation is opposite to that of the vortex core states. We show how these effects will lead to nonreciprocal circular birefringence, and also predict structure in the frequency dependence of conductivity and in the differential cross section of the Raman scattering.Comment: 14 pages (RevTex

Real-space local polynomial basis for solid-state electronic-structure calculations: A finite-element approach

We present an approach to solid-state electronic-structure calculations based on the finite-element method. In this method, the basis functions are strictly local, piecewise polynomials. Because the basis is composed of polynomials, the method is completely general and its convergence can be controlled systematically. Because the basis functions are strictly local in real space, the method allows for variable resolution in real space; produces sparse, structured matrices, enabling the effective use of iterative solution methods; and is well suited to parallel implementation. The method thus combines the significant advantages of both real-space-grid and basis-oriented approaches and so promises to be particularly well suited for large, accurate ab initio calculations. We develop the theory of our approach in detail, discuss advantages and disadvantages, and report initial results, including the first fully three-dimensional electronic band structures calculated by the method.Comment: replacement: single spaced, included figures, added journal referenc

Lattice bosons in quartic confinement

We present a theoretical study of bose condensation of non-interacting bosons in finite lattices in quartic potentials in one, two, and three dimensions. We investigate dimensionality effects and quartic potential effects on single boson density of energy states, condensation temperature, condensate fraction, and specific heat. The results obtained are compared with corresponding results for lattice bosons in harmonic traps.Comment: revised version, 11 pages including figures, accepted in EPJ