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Spectroscopic ellipsometry was used to study the dielectric function of LiCuVO$_{4}$, a compound comprised of chains of edge-sharing CuO$_4$ plaquettes, in the spectral range (0.75 - 6.5) eV at temperatures (7-300) K. For photon…

Strongly Correlated Electrons · Physics 2015-05-14 Y. Matiks , P. Horsch , R. K. Kremer , B. Keimer , A. V. Boris

The magnetic anisotropy af a rectangular Cu-O-Cu bond is investigated in second order of the spin-orbit interaction. Such a bond is characteristic for cuprates having edge sharing CuO_2 chains, and exists also in the Cu_3O_4 plane or in…

Strongly Correlated Electrons · Physics 2009-10-31 V. Yu. Yushankhai , R. Hayn

We present an analytical investigation of the optical absorption spectrum of monolayer molybdenumdisulfide. Based on the density matrix formalism, our approach gives insights into the microscopic origin of excitonic transitions, their…

Materials Science · Physics 2014-03-24 Gunnar Berghäuser , Ermin Malic

Using a combination of X-ray absorption spectroscopy experiments with first principle calculations, we demonstrate that insulating KCuO_2 contains Cu in an unusually-high formal-3+ valence state, the ligand-to-metal (O to Cu) charge…

Strongly Correlated Electrons · Physics 2015-11-25 D. Choudhury , P. Rivero , D. Meyers , X. Liu , Y. Cao , S. Middey , M. J. Whitaker , S. Barraza-Lopez , J. W. Freeland , M. Greenblatt , J. Chakhalian

In the Mott-Hubbard insulators YTiO3 and SmTiO3 we study optical excitations from the lower to the upper Hubbard band, d^1d^1 -> d^0d^2. The multi-peak structure observed in the optical conductivity reflects the multiplet structure of the…

Strongly Correlated Electrons · Physics 2024-11-05 A. Gössling , R. Schmitz , H. Roth , M. W. Haverkort , T. Lorenz , J. A. Mydosh , E. Müller-Hartmann , M. Grüninger

Compounds with intermediate-size transition metals such as Fe or Mn are close to the transition between charge-transfer systems and Mott-Hubbard systems. We study the optical conductivity \sigma(\omega) of insulating layered LaSrFeO_4 in…

Strongly Correlated Electrons · Physics 2014-05-08 J. Reul , L. Fels , N. Qureshi , K. Shportko , M. Braden , M. Grüninger

We perform first-principles calculations to investigate the band structure, density of states, optical absorption, and the imaginary part of dielectric function of Cu, Ag, and Au-doped anatase TiO2 in 72 atoms systems. The electronic…

Materials Science · Physics 2015-08-10 Meili Guo , Jiulin Du

Spin-$1/2$ chains with alternating antiferromagnetic and ferromagnetic couplings have attracted considerable interest due to the topological character of their spin excitations. Here, using density functional theory and density matrix…

We report the complex dielectric function along and perpendicular to the IrO2 planes in the layered perovskite Sr2IrO4 determined by spectroscopic ellipsometry in the spectral range from 12 meV to 6 eV. Thin high quality single crystals…

Strongly Correlated Electrons · Physics 2016-08-24 D. Pröpper , A. N. Yaresko , M. Höppner , Y. Matiks , Y. -L. Mathis , T. Takayama , A. Matsumoto , H. Takagi , B. Keimer , A. V. Boris

A resonant inelastic x-ray scattering study of the electronic structure of the semiconductor cuprous oxide, $\rm Cu_2O$, is reported. When the incident x-ray energy is tuned to the Cu K-absorption edge, large enhancements of the spectral…

Materials Science · Physics 2012-06-18 Young-June Kim , J. P. Hill , H. Yamaguchi , T. Gog , D. Casa

Using spectroscopic ellipsometry, we study the optical conductivity sigma(omega) of insulating LaSrMnO4 in the energy range of 0.75-5.8 eV from 15 to 330 K. The layered structure gives rise to a pronounced anisotropy. A multipeak structure…

Strongly Correlated Electrons · Physics 2008-01-31 A. Gössling , M. W. Haverkort , M. Benomar , H. Wu , D. Senff , T. Möller , M. Braden , J. A. Mydosh , M. Grüninger

The Ortho-II phase of YBa$_2$Cu$_3$O$_6.5$ is characterized by a periodic alternation of empty Cu and filled Cu-O b-axis doubling the unit cell in the a direction. The extra oxygen in the full chains gives rise to an attractive potential…

Superconductivity · Physics 2009-11-10 E. Bascones , T. M. Rice , A. O. Shorikov , V. I. Anisimov

We report on a comprehensive characterization of the newly synthesized Cu$^{2+}$-based molecular magnet [Cu(pz)$_2$(2-HOpy)$_2$](PF$_6$)$_2$ (CuPOF), where pz = C$_4$H$_4$N$_2$ and 2-HOpy = C$_5$H$_4$NHO. From a comparison of theoretical…

The study of the strength of correlations in Na$_x$CoO$_2$ is extended to the x=0 end of the phase diagram where Mott insulating behavior has been widely anticipated. Inclusion of correlation as modeled by the LDA+U approach leads to a Mott…

Strongly Correlated Electrons · Physics 2007-05-23 K. -W. Lee , W. E. Pickett

Mott gap excitations in the high-Tc superconductor of the optimal doped YBa2Cu3O7-d (Tc = 93 K) have been studied by the resonant inelastic x-ray scattering method. Anisotropic spectra in the ab-plane are observed in a twin-free crystal.…

Strongly Correlated Electrons · Physics 2007-05-23 K. Ishii , K. Tsutsui , Y. Endoh , T. Tohyama , K. Kuzushita , T. Inami , K. Ohwada , S. Maekawa , T. Masui , S. Tajima , Y. Murakami , J. Mizuki

We investigated the crystal structure, magnetic behavior, and optical properties of the layered honeycomb compound Na2Cu2TeO6. X-ray and neutron diffraction confirmed a monoclinic structure, with Cu ions arranged in dimerized chains.…

Strongly Correlated Electrons · Physics 2025-08-25 Shubham Patil , S. D. Kaushik

An investigation of the spin excitation spectrum of charge ordered (CO) NaV2O5 is presented. We discuss several different exchange models which may be relevant for this compound, namely in- line and zig-zag chain models with weak as well as…

Strongly Correlated Electrons · Physics 2015-06-25 P. Thalmeier , A. N. Yaresko

Optical conductivity spectra of cubic pyrochlore $Y_{2-x} Bi_x Ru_2 O_7$ (0.0$\leq ${\it x}$\leq $2.0) compounds are investigated. As a metal-insulator transition (MIT) occurs around {\it x}$=$0.8, large spectral changes are observed. With…

Strongly Correlated Electrons · Physics 2009-11-11 J. S. Lee , S. J. Moon , T. W. Noh , T. Takeda , R. Kanno , S. Yoshii , M. Sato

Sr_2CuO_3 and Ca_2CuO_3 are considered to be model systems of strongly anisotropic, spin-1/2 Heisenberg antiferromagnets. We report on the basis of a band-structure analysis within the local density approximation and on the basis of…

Strongly Correlated Electrons · Physics 2009-10-30 H. Rosner , H. Eschrig , R. Hayn , S. -L. Drechsler , J. Malek

The temperature and angular dependence of the upper critical field (Hc2) is reported for cobalt-doped SrFe2As2 epitaxial films between Tc and 0.5 K in pulsed magnetic fields up to 50 T. For H parallel c, Hc2 is close to a linear function of…

Superconductivity · Physics 2009-04-12 S. A. Baily , Y. Kohama , H. Hiramatsu , B. Maiorov , F. F. Balakirev , M. Hirano , H. Hosono
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