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In the iron-based superconductors, understanding the relation between superconductivity and electronic structure upon doping is crucial for exploring the pairing mechanism. Recently it was found that in iron selenide (FeSe), enhanced…

Superconductivity · Physics 2017-08-21 M. Q. Ren , Y. J. Yan , X. H. Niu , R. Tao , D. Hu , R. Peng , B. P. Xie , J. Zhao , T. Zhang , D. L. Feng

The doping mechanism and realistic Fermi surface (FS) evolution of La$_{2-x}$Sr$_x$CuO$_4$ (LSCO) are modelled within an extensive ab-initio framework including advanced band-unfolding techniques. We show that ordinary Kohn-Sham DFT+U can…

Materials Science · Physics 2015-12-01 P. Lazic , D. K. Sunko

Lanthanum family of high-temperature cuprate superconductors is known to exhibit both spin and charge electronic modulations around doping level 1/8. We assume that these modulations have the character of two-dimensional spin-vortex…

Strongly Correlated Electrons · Physics 2017-08-23 Pavel E. Dolgirev , Boris V. Fine

We investigate the orbital fluctuations in the ferromagnetic-metallic phase of La$_{1.2}$Sr$_{1.8}$Mn$_2$O$_7$ by considering a two orbital model within a tight-binding description which reproduces the ARPES Fermi surface. We find strong…

Strongly Correlated Electrons · Physics 2017-06-29 Dheeraj Kumar Singh , Ki Hoon Lee , Tetsuya Takimoto

The electronic structure of low-density n-type SrTiO3 delta-doped heterostructures is investigated by angular dependent Shubnikov-de Haas oscillations. In addition to a controllable crossover from a three- to two-dimensional Fermi surface,…

Strongly Correlated Electrons · Physics 2015-05-27 M. Kim , C. Bell , Y. Kozuka , M. Kurita , Y. Hikita , H. Y. Hwang

It is investigated, on the basis of the fluctuation exchange approximation, how the shape of the Fermi surface is modified in two-dimensional $t-t'-U$ Hubbard model at half filling as strength of the onsite Coulomb interaction $U$ is…

Strongly Correlated Electrons · Physics 2009-10-31 K. Morita , K. Miyake

The lack of nesting of the electron and hole Fermi-surface sheets in the Fe-based superconductor LiFeAs, with a critical temperature of 18 K, has led to questions as to whether the origin of superconductivity in this material might be…

By paying special attention to the fact that the doped holes induce deformation of CuO6 octahedrons (or CuO5 pyramids) in cuprate superconductors, we develop a non-rigid band theory treating doping-induced alterations of energy-band…

Superconductivity · Physics 2016-11-11 Hiroshi Kamimura , Jaw-Shen Tsai , Osamu Sugino , Kunio Ishida , Hideki Ushio

We point out at the possible relationship between the two many-body phenomena: Friedel oscillations and Mahan exciton/Fermi edge singularity in a recombination process of a localized valence band hole with a degenerate electron system. It…

Mesoscale and Nanoscale Physics · Physics 2017-10-19 V. V. Solovyev , I. V. Kukushkin

We show, from first-principles calculations, that the hole-doped side of FeAs-based compounds is different from its electron-doped counterparts. The electron side is characterized as Fermi surface nesting, and SDW-to-NM quantum critical…

Superconductivity · Physics 2009-01-12 Gang Xu , Haijun Zhang , Xi Dai , Zhong Fang

We investigate the effect of external pressure on the Fe magnetic moment in undoped LaOFeAs within the framework of density functional theory and show that this system is close to a magnetic instability: The Fe moment is found to drop by…

Superconductivity · Physics 2009-01-22 I. Opahle , H. C. Kandpal , Y. Zhang , C. Gros , R. Valenti

We demonstrate that the Fulde-Ferrell (FF) phase can be induced uniquely by the orbital effect in a cylindrical metallic nanowire. In the external magnetic field the two-fold degeneracy with respect to the orbital quantum number $m$ is…

Superconductivity · Physics 2015-05-12 Paweł Wójcik , Michał Zegrodnik , Józef Spałek

We study electron propagation in a molecular lattice model. Each molecular site involves doubly degenerate electronic states coupled to doubly degenerate molecular vibration, leading to a so--called E-e type of Jahn-Teller Hamiltonian. For…

Condensed Matter · Physics 2009-10-28 Michele Fabrizio , Marco Airoldi , Erio Tosatti

We have carried out first principles all-electron calculations of the (001)-projected 2D electron momentum density and the directional Compton profiles along the [100], [001] and [110] directions in the Fe-based superconductor LaOFeAs…

Strongly Correlated Electrons · Physics 2010-02-08 Y. J. Wang , Hsin Lin , B. Barbiellini , P. E. Mijnarends , S. Kaprzyk , W. Al-Sawai , R. S. Markiewicz , A. Bansil

We study the attractive Hubbard model with spin imbalance on two lattices featuring a flat band: the Lieb and kagome lattices. We present mean-field phase diagrams featuring exotic superfluid phases, similar to the…

The iron-based LaFeAsO$_{1-x}$F$_x$ recently discovered by Hosono's group is a fresh theoretical challenge as a new class of high-temperature superconductors. Here we describe the electronic structure of the material and the mechanism of…

Superconductivity · Physics 2009-11-13 Hideo Aoki

Effects of Coulomb correlation on LaOFeAs electronic structure have been investigated by LDA+DMFT(QMC) method. The calculation results show that LaOFeAs is in the regime of intermediate correlation strength with significant part of the…

Strongly Correlated Electrons · Physics 2009-11-13 A. O. Shorikov , M. A. Korotin , S. V. Streltsov , S. L. Skornyakov , D. M. Korotin , V. I. Anisimov

Among numerous hypotheses, recently proposed to explain superconductivity in iron-based superconductors [1-9], many consider Fermi surface (FS) nesting [2, 4, 8, 10] and dimensionality [4, 9] as important contributors. Precise determination…

The results of a previous work, where it was considered the effect of hole doping on a simple model of the CuO2 planes in La2CuO4, are extended. The parameters are adjusted with the objective to fix the known values of the gap of 2 eV for…

Superconductivity · Physics 2014-10-08 Yoandri Vielza de la Cruz , Alejandro Cabo Montes de Oca

Measured transport properties of three representative cuprates are reproduced within the paradigm of two electron subsystems, itinerant and localized. The localized subsystem evolves continuously from the Cu 3d$^9$ hole at half-filling and…