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The determination by powder neutron diffraction of the ambient temperature crystal structures of compounds in the NaxCoO2 family, for 0.3 < x <= 1.0, is reported. The structures consist of triangular CoO2 layers with Na ions distributed in…

Strongly Correlated Electrons · Physics 2009-11-10 Q. Huang , M. L. Foo , R. A. Pascal , J. W. Lynn , B. H. Toby , Tao He , H. W. Zandbergen , R. J. Cava

The mobility and disorder in the lattice of Cu atoms as liquid-like behavior is an important characteristic affecting the thermoelectric properties of Cu$_{2}$S. In this study, using a theoretical model called acanthite-like structure for…

We have studied the electronic structure of unoccupied states measured by O K-edge and Cu L-edge x-ray absorption spectroscopy (XAS), combined with crystal structure studied by high resolution powder x-ray diffraction (HRPXRD), of…

Superconductivity · Physics 2014-03-28 S. Agrestini , S. Sanna , K. Zheng , R. De Renzi , E. Pusceddu , G. Concas , N. L. Saini , A. Bianconi

We study the effects of bond-charge interaction (or correlated hopping) on the properties of the extended ({\it i.e.,} with both on-site ($U$) and nearest-neighbor ($V$) repulsions) Hubbard model in one dimension at half-filling. Energy…

Condensed Matter · Physics 2009-10-28 Daisy M. Luz , Raimundo R. dos Santos

We describe the low-temperature optical conductivity as a function of frequency for a quantum-mechanical system of electrons that hop along a polymer chain. To this end, we invoke the Su-Schrieffer-Heeger \emph{tight-binding} Hamiltonian…

Mathematical Physics · Physics 2022-09-28 Dionisios Margetis , Alexander B. Watson , Mitchell Luskin

We construct the complementary short-range correlation relativistic local-density-approximation functional to be used in relativistic range-separated density-functional theory based on a Dirac-Coulomb Hamiltonian in the no-pair…

Chemical Physics · Physics 2021-05-26 Julien Paquier , Julien Toulouse

Understanding the mechanism of high transition temperature (Tc) superconductivity in cuprates has been hindered by the apparent complexity of their multilayered crystal structure. Using a cryogenic scanning tunneling microscopy, we report…

Radial, angular and total correlation energies are calculated for four two-electron systems with atomic numbers Z=0-3 confined within an impenetrable sphere of radius R. We report accurate results for the non-relativistic, restricted…

Atomic Physics · Physics 2015-05-19 C. L. Wilson , H. E. Montgomery , K. D. Sen , D. C. Thompson

First principles FPLAPWcalculations were performed in the framework of Density Functional Theory (DFT), to study the electronic structures and magnetic properties for the new full-Heusler compounds: Sc2CoZ (Z=Si, Ge, Sn). The investigated…

Materials Science · Physics 2014-03-25 A. Birsan

The terahertz (THz) excitations in the quantum spin-ladder system Sr14Cu24O41 have been determined along the c-axis using THz time-domain, Raman and infrared spectroscopy. Low-frequency infrared and Raman active modes are observed above and…

Strongly Correlated Electrons · Physics 2013-02-06 V. K. Thorsmolle , C. C. Homes , A. Gozar , G. Blumberg , J. L. M. van Mechelen , A. B. Kuzmenko , S. Vanishri , C. Marin , H. M. Ronnow

Super-high resolution laser-based angle-resolved photoemission measurements have been performed on a high temperature superconductor Bi_2Sr_2CaCu_2O_8. The band back-bending characteristic of the Bogoliubov-like quasiparticle dispersion is…

Optical reflectivity measurements were performed on a single crystal of the d-electron heavy-fermion (HF) metal LiV2O4. The results evidence the highly incoherent character of the charge dynamics for all temperatures above T^* \approx 20 K.…

Strongly Correlated Electrons · Physics 2007-10-24 P. E. Jönsson , K. Takenaka , S. Niitaka , T. Sasagawa , S. Sugai , H. Takagi

Low energy properties of the metallic state of the 2-dimensional tJ model are presented at various densities and temperatures for second neighbor hopping t', with signs that are negative or positive corresponding to hole or electron doping.…

Strongly Correlated Electrons · Physics 2026-01-16 B. Sriram Shastry , Peizhi Mai

A new model with a new Hamiltonian is offered as the means for studying properties of a system of strongly correlated electrons. Consideration of the simplest possible situation, namely a system on non-interacting electrons in a two-leg…

General Physics · Physics 2018-01-30 Valentin Voroshilov

Metal-insulator transition materials such as NbO2 have generated much excitement in recent years for their potential applications in computing and sensing. NbO2 has generated considerable debate over the nature of the phase transition, and…

Measurements by high-resolution electron energy-loss spectroscopy (HREELS) of NaxCoO2 reveal spectral features that differ remarkably between the metallic Na0.33CoO2 and the charge-ordered insulator Na0.5CoO2. Calculations by density…

Strongly Correlated Electrons · Physics 2007-05-23 R. J. Xiao , J. H. Chen , H. X. Yang , C. Ma , Q. Xu , H. W. Zandbergen , J. Q. Li

In weak coupling, the spin gap in doped, even, n-leg periodic Hubbard ladders reflects the energy to break a pair into separate quasiparticles. Here we investigate the structure of the gap within a spin-fluctuation exchange approximation.…

Condensed Matter · Physics 2007-05-23 N. Bulut , D. J. Scalapino

We calculate the one-electron Green's function of the 2D attractive Hubbard model by coupling the electrons to pair fluctuations. The latter are approximated by homogeneous amplitude fluctuations and phase correlations corresponding to the…

Condensed Matter · Physics 2009-10-31 Massimiliano Capezzali , Hans Beck

The fascinating electronic properties of the family of layered organic molecular crystals kappa-(BEDT-TTF)2X where X is an anion (e.g., X=I3, Cu[N(CN)2]Br, Cu(SCN)2) are reviewed. These materials are particularly interesting because of…

Strongly Correlated Electrons · Physics 2007-05-23 Ross H. McKenzie

ZrO2:10%SiO2 thinfilms have been deposited on fused silica substrate by reactive electron beam co-evaporation technique at different oxygen partial pressure. The structural analysis shows tetragonal phase with residual tensile stress in the…

Materials Science · Physics 2020-09-22 S. Jena , R. B. Tokas , S. Thakur , N. K. Sahoo