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The electronic structure of NdVO3, YVO3 has been investigated as a function of sample temperature using resonant inelastic soft x-ray scattering at the V L3-edge. Most of the observed spectral features are in good agreement with an atomic…

Strongly Correlated Electrons · Physics 2014-11-18 J. Laverock , B. Chen , A. R. H. Preston , D. Newby , L. F. J. Piper , L. D. Tung , G. Balakrishnan , P. -A. Glans , J. -H. Guo , K. E. Smith

We report on the observation of orbital excitations in YVO3 by means of resonant inelastic x-ray scattering (RIXS) at energies across the vanadium L3 and oxygen K absorption edges. Due to the excellent experimental resolution we are able to…

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

We report resonant inelastic x-ray scattering experiments of the orbital ordered manganite LaMnO3. When the incident photon energy is tuned near the Mn K absorption edge, the spectra reveal three features at 2.5 eV, 8 eV and 11 eV. The 8 eV…

Strongly Correlated Electrons · Physics 2007-05-23 T. Inami , S. Ishihara , H. Kondo , J. Mizuki , T. Fukuda , S. Maekawa , H. Nakao , T. Matsumura , K. Hirota , Y. Murakami , Y. Endoh

We demonstrate that angle-resolved soft x-ray spectroscopy can resolve absorption by inequivalent oxygen sites and by different orbitals belonging to the same site in NaV2O5. By rotating the polarization direction, we see a dramatic change…

Strongly Correlated Electrons · Physics 2009-11-07 G. P. Zhang , G. T. Woods , Eric L. Shirley , T. A. Callcott , L. Lin , G. S. Chang , B. C. Sales , D. Mandrus , J. He

The orbital excitations of a series of transition-metal compounds are studied by means of optical spectroscopy. Our aim was to identify signatures of collective orbital excitations by comparison with experimental and theoretical results for…

We study optical excitations across the Mott gap in the multi-orbital Mott-Hubbard insulators RVO3. The multi-peak structure observed in the optical conductivity can be described consistently in terms of the different 3d^3 multiplets or…

Strongly Correlated Electrons · Physics 2015-03-20 J. Reul , A. A. Nugroho , T. T. M. Palstra , M. Grueninger

YTiO3, as a prototypical Mott insulator, has been the subject of numerous experimental investigations of its electronic structure. The onset of absorption in optical conductivity measurements has generally been interpreted to be due to…

Materials Science · Physics 2014-10-10 Burak Himmetoglu , Anderson Janotti , Lars Bjaalie , Chris G. Van de Walle

Anisotropic optical spectra coupled with antiferromagnetic spin ordering (SO) and orbital ordering (OO) have been investigated for single crystals of LaVO_{3} and YVO_{3}. The orbital-dependent Mott-Hubbard gap transitions are observed…

Strongly Correlated Electrons · Physics 2009-11-07 Shigeki Miyasaka , Yoichi Okimoto , Yoshinori Tokura

Optical and magneto-optical properties of YVO$_3$ single crystal were studied in FIR, visible, and UV regions. Two structural phase transitions at 75 K and 200 K were observed and established to be of the first and second order,…

The anisotropy of low energy (0$\sim$5eV) optical excitations in strongly correlated transition-metal oxides is closely related to the spin and orbital orderings. The recent successes of LDA+$U$ method in describing the magnetic and…

Strongly Correlated Electrons · Physics 2009-11-07 Zhong Fang , Naoto Nagaosa , Kiyoyuki Terakura

We investigate the importance of quantum orbital fluctuations in the orthorhombic and monoclinic phases of the Mott insulators LaVO3 and YVO3. First, we construct ab-initio material-specific t2g Hubbard models. Then, by using dynamical…

Strongly Correlated Electrons · Physics 2009-01-07 M. De-Raychaudhury , E. Pavarini , O. K. Andersen

V 3$d$ charge and orbital states in V$_2$OPO$_4$ have been investigated by means of x-ray absorption spectroscopy (XAS). The electronic structure of V$_2$OPO$_4$ is very unique in that the charge transfer between V$^{2+}$ and V$^{3+}$ in…

Strongly Correlated Electrons · Physics 2020-06-09 Kota Murota , Elise Pachoud , J. Paul Attfield , Robert Glaum , Ronny Sutarto , Kou Takubo , Daniel I. Khomskii , Takashi Mizokawa

The relationship between the luminescence at 1.9 eV and the absorption bands at 2.0 eV and at 4.8 eV were investigated in a wide variety of synthetic silica samples exposed to different gamma- and beta-ray irradiation doses. We found that…

Materials Science · Physics 2007-05-23 L. Vaccaro , M. Cannas , B. Boizot

The question of optical bandgap anisotropy in the monoclinic semiconductor $\beta$-Ga2O3 was revisited by combining accurate optical absorption measurements with theoretical analysis, performed using different advanced computation methods.…

Core excitation from terminal oxygen O$_T$ in O$_3$ is shown to be an excitation from a localized core orbital to a localized valence orbital. The valence orbital is localized to one of the two equivalent chemical bonds. We experimentally…

Chemical Physics · Physics 2009-11-10 K. Wiesner , A. Naves de Brito , S. L. Sorensen , N. Kosugi , O. Bjorneholm

We report on the low-frequency optical excitations in the multiferroic ground state of polycrystalline FeCr2S4 in the frequency range 0.3-3~THz and their changes upon applying external magnetic fields up to 7~T. In the ground state below…

Strongly Correlated Electrons · Physics 2020-10-12 A. Strinic , S. Reschke , K. V. Vasin , M. Schmidt , A. Loidl , V. Tsurkan , M. V. Eremin , J. Deisenhofer

We present ab initio absorption spectra of six three-dimensional semiconductors and insulators calculated using Gaussian-based periodic equation-of-motion coupled-cluster theory with single and double excitations (EOM-CCSD). The spectra are…

Chemical Physics · Physics 2021-07-13 Xiao Wang , Timothy C. Berkelbach

We have measured the V 2p3/2 and O 1s x-ray absorption spectra of single crystal V2O5 and V6O13 and compared to linear combinations of atomic orbitals (LCAO) density of states (DOS) calculations. The spectra change dramatically with…

Condensed Matter · Physics 2009-10-22 E. Goering , O. Müller , M. Klemm , J. P. Urbach , H. Petersen , C. Jung , M. L. denBoer , S. Horn

We present a theory of the collective orbital excitation termed orbital wave in perovskite titanates and vanadates with the triply degenerate $t_{2g}$ orbitals. The dispersion relations of the orbital waves for the orbital ordered LaVO$_3$,…

Strongly Correlated Electrons · Physics 2009-11-10 Sumio Ishihara
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