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We investigate the electronic structure of SrMnO$_3$ with Density Functional Theory (DFT) plus Dynamical Mean-Field Theory (DMFT). Within this scheme the selection of the correlated subspace and the construction of the corresponding Wannier…

强关联电子 · 物理学 2018-06-20 Daniel Bauernfeind , Robert Triebl , Manuel Zingl , Markus Aichhorn , Hans Gerd Evertz

The spinel oxide superconductor LiTi2O4 (LTO) is an intriguing material platform where the electronic structure near the Fermi energy (EF) is derived from 3d elections on the geometrically frustrated Ti pyrochlore network. A recent…

The O(3) symmetric Anderson model is an example of a system which has a stable low energy marginal Fermi liquid fixed point for a certain choice of parameters. It is also exactly equivalent, in the large U limit, to a localized model which…

强关联电子 · 物理学 2009-10-31 S. C. Bradley , R. Bulla , A. C. Hewson , G-M. Zhang

We studied the electronic band structure of pulsed laser deposition (PLD) grown (111)-oriented SrRuO$_3$ (SRO) thin films using \textit{in situ} angle-resolved photoemission spectroscopy (ARPES) technique. We observed previously unreported,…

LDA+DMFT+Sigma_k approach was applied to describe pseudogap phase of several prototype high-Tc compounds e.g. hole doped Bi2212 and LSCO systems and electron doped NCCO and PCCO, demonstrating qualitative difference of the Fermi surfaces…

强关联电子 · 物理学 2011-06-29 I. A. Nekrasov , E. Z. Kuchinskii , M. V. Sadovskii

Nb-substituting Fe impurity in KNbO3 is studied in first-principles supercell calculations by the linear muffin-tin orbital method. Possible ways to account for the impurity charge compensation are discussed. Calculations are done in the…

材料科学 · 物理学 2008-02-03 A. V. Postnikov , A. I. Poteryaev , G. Borstel

We present a first-principles investigation of the electronic structure of the inversion-symmetry-broken spin-orbit-coupled metal candidate PbRe$_2$O$_6$. Our calculations reveal that the Fermi surfaces derived from the $d_{yz}$ and…

材料科学 · 物理学 2026-04-29 Yuki Yanagi , Michi-To Suzuki

The band structures of pure and hole doped La$_2$CuO$_4$ with antiferromagnetic (AFM) spin-fluctuations are calculated and compared to spectral weights of ARPES. It is shown that observations of coexisting Fermi surface (FS) arcs and closed…

超导电性 · 物理学 2015-05-30 T. Jarlborg

A fast full-wave simulation technique is presented for the analysis of large irregular planar arrays of identical 3-D metallic antennas. The solution method relies on the Macro Basis Functions (MBF) approach and an interpolatory technique…

We analyze the spatial correlations in the spin density of an electron gas in the vicinity of a Kondo impurity. Our analysis extends to the spin-anisotropic regime, which was not investigated in the literature. We use an original and…

强关联电子 · 物理学 2015-11-09 Serge Florens , Izak Snyman

We have investigated the low-energy electronic structure of the heavy fermion superconductor CeCoIn5 by angle-resolved photoemission and band structure calculations. We measured the Fermi surface and energy distribution maps along the…

The full-potential linearized augmented-plane wave (FP-LAPW) method is well known to enable most accurate calculations of the electronic structure and magnetic properties of crystals and surfaces. The implementation of atomic forces has…

凝聚态物理 · 物理学 2009-10-31 Max Petersen , Frank Wagner , Lars Hufnagel , Matthias Scheffler , Peter Blaha , Karlheinz Schwarz

By strictly adhering to the microscopic theory of composite fermions for the Landau-level filling fractions nu_e = p/(2 p + 1), we reproduce, with remarkable accuracy, the surface-acoustic-wave (SAW)-based experimental results by Willett…

介观与纳米尺度物理 · 物理学 2009-11-11 Behnam Farid

Evaluating the similarity of non-rigid shapes with significant partiality is a fundamental task in numerous computer vision applications. Here, we propose a novel axiomatic method to match similar regions across shapes. Matching similar…

计算机视觉与模式识别 · 计算机科学 2022-07-08 David Bensaïd , Amit Bracha , Ron Kimmel

Partial differential equations posed on surfaces arise in a number of applications. In this survey we describe three popular finite element methods for approximating solutions to the Laplace-Beltrami problem posed on an $n$-dimensional…

数值分析 · 数学 2024-09-23 Andrea Bonito , Alan Demlow , Ricardo H. Nochetto

We propose a systematic procedure for constructing effective lattice fermion models for narrow-band compounds on the basis of first-principles electronic structure calculations. The method is illustrated for the series of transition-metal…

强关联电子 · 物理学 2009-11-11 I. V. Solovyev

We report the three-dimensional (3-D) momentum-resolved soft x-ray photoemission spectroscopy of the Fermi liquid LaNiO$_3$. The out-of-plane and in-plane cuts of the 3-D electron- and hole-Fermi surfaces (FSs) are observed by energy- and…

强关联电子 · 物理学 2009-04-02 R. Eguchi , A. Chainani , M. Taguchi , M. Matsunami , Y. Ishida , K. Horiba , Y. Senba , H. Ohashi , S. Shin

A three dimensional mapping of the Fermi Surface (FS) of the rare-earth compound ErGa3 was determined via measurements of the angular correlation of the electron-positron annihilation radiation. The topology of the electronlike FS does show…

材料科学 · 物理学 2009-11-07 M. Biasini , G. Ferro , G. Kontrym-Sznajd , A. Czopnik

We have examined theoretically the electronic band structure and Fermi surface of tetragonal low-temperature superconductor Bi2Pd. Our main results are that (i) the Pd 4d and Bi 6p states determine the main peculiarities of the…

超导电性 · 物理学 2012-08-09 I. R. Shein , A. L. Ivanovskii

We introduce a dual-wavelength Fourier ptychographic topography (FPT) method that extends the lambda/2 height-range limit of single-wavelength FPT. By reconstructing complex fields at two illumination wavelengths and exploiting their phase…

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