Related papers: Calculated Spin Fluctuational Pairing Interaction …
Understanding the origin of the pseudogap is an essential step towards elucidating the pairing mechanism in the cuprate superconductors. Recently there has been strong experimental evidence showing that C4 symmetry breaking occurs on…
We report a series of calculations testing the predictions of the Tran-Blaha functional for the electronic structure and magnetic properties of condensed systems. We find a general improvement in the properties of semiconducting and…
Heavily electron-doped surfaces of Bi$_2$Se$_3$ have been studied by spin and angle resolved photoemission spectroscopy. Upon doping, electrons occupy a series of {\bf k}-split pairs of states above the topological surface state. The {\bf…
Electron collisions for a two dimensional Fermi liquid (FL) are shown to give a quasiparticle damping with interesting frequency and temperature variations in the BCS superconducting state. The spin susceptibility which determines the…
We perform a theoretical study of the effects of electronic correlations on the superconducting gap structure of multi-band superconductors. In particular, by comparing standard RPA-based spin-fluctuation mediated gap structures to those…
The ab initio computational method known as Hubbard-corrected density functional theory (DFT+$U$) captures well ground electronic structures of a set of solids that are poorly described by standard DFT alone. Since lattice dynamical…
A microscopic theory of superconductivity in the extended Hubbard model which takes into account the intersite Coulomb repulsion and electron-phonon interaction is developed in the limit of strong correlations. The Dyson equation for normal…
Correlation effects in CuO$_2$ layers give rise to a complicated landscape of collective excitations in high-T$_{\rm c}$ cuprates. Their description requires an accurate account for electronic fluctuations at a very broad energy range and…
In correlated electron materials, the application of many-body techniques for the study of interaction effects or unconventional superconductivity often requires the formulation of an effective low-energy model that contains only the…
We use Ru $L_3$-edge (2838.5 eV) resonant inelastic x-ray scattering (RIXS) to quantify the electronic structure of Ca$_2$RuO$_4$, a layered $4d$-electron compound that exhibits a correlation-driven metal-insulator transition and…
For the recently discovered cuprate superconductor $\mathrm{Ba_{2}CuO_{3+\delta}}$, we propose a lattice structure which resembles the model considered by Lieb to represent the vastly oxygen-deficient material. We first investigate the…
Cluster dynamical mean field calculations are used to construct the superconducting gap function of the two dimensional Hubbard model. The frequency dependence of the imaginary part of the gap function indicates that the pairing is…
We propose a minimum single-band model for the newly discovered iron-based superconducting K$_x$Fe$_2$Se$_2$. Our model is found to be numerically consistent with the five-orbital model at low energies. Based on our model and the random…
We present a systematic analysis on the basis of ab initio calculations and many-body perturbation theory for clarifying the dominant fluctuation in complex charge-spin-orbital coupled systems. For a tight-binding multiband model obtained…
Using the Becke-3-LYP functional, we have performed band structure calculations on the high temperature superconductor parent compound, La2CuO4. Under the restricted spin formalism (rho(alpha) equal to rho(beta)), the R-B3LYP band structure…
We have theoretically investigated the spin and charge fluctuations in the quasi-one dimensional organic superconductor (TMTSF)2ClO4. Using the extended multi-site Hubbard model, which contains four sites in a unit cell and the transfer…
In this work, the effect of uniaxial pressure along the c axis on the electronic structure of the HTSC cuprate La2-xSrxCuO4 is investigated at the doping levels x = 0.1, 0.15, 0.25. The GTB method within the five-band p-d model framework is…
A new decoupling scheme is developed for the Hubbard model which provides a unified description of the spin-symmetric (paramagnetic metallic and insulating) phases as well as the broken-symmetry AFI phase. Independent of magnetic ordering,…
The fluctuation exchange, or FLEX, approximation for interacting electrons is applied to study instabilities in the standard three-band model for CuO2 layers in the high-temperature superconductors. Both intra-orbital and near-neigbor…
We observe an enhanced visibility of charge-density-wave correlations in a cold-atom realization of the attractive Hubbard model following a rapid boost of the interaction strength. The interaction boost associates nonlocal pairs into…