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Related papers: On the Stacking Charge Order in NaV2O5

200 papers

The ordering of Na ions in Na$_x$CoO$_2$ is investigated systematically by combining detailed density functional theory (DFT) studies with model calculations. Various ground state ordering patterns are identified, and they are in excellent…

Materials Science · Physics 2009-11-11 Peihong Zhang , Rodrigo B. Capaz , Marvin L. Cohen , Steven G. Louie

Since the discovery of charge disproportionation in the FeO$_2$ square-lattice compound Sr$_3$Fe$_2$O$_7$ by M\"ossbauer spectroscopy more than fifty years ago, the spatial ordering pattern of the disproportionated charges has remained…

Charge order has recently been identified as a leading competitor of high-temperature superconductivity in moderately doped cuprates. We provide a survey of universal and materials-specific aspects of this phenomenon, with emphasis on…

Strongly Correlated Electrons · Physics 2021-02-19 Alex Frano , Santiago Blanco-Canosa , Bernhard Keimer , Robert J Birgeneau

We determine the electronic structure of the one-dimensional spin-1/2 Heisenberg compound $\gamma$-LiV$_2$O$_5$, which has two inequivalent vanadium ions, V(1) and V(2), via density-functional calculations. We find a relative V(1)-V(2)…

Condensed Matter · Physics 2009-11-07 R. Valenti , T. Saha-Dasgupta , J. V. Alvarez , K. Pozgajcic , C. Gros

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

Charge order is a commonly observed phenomenon in strongly correlated materials. However, most theories are based on a repulsive inter-site Coulomb interaction in order to explain charge order. We here show that only due to local…

Strongly Correlated Electrons · Physics 2013-04-29 Robert Peters , Shintaro Hoshino , Norio Kawakami , Junya Otsuki , Yoshio Kuramoto

A combined neutron and x-ray diffraction study of TbBaFe2O5 reveals a rare checkerboard to charge ordering transition. TbBaFe2O5 is a mixed valent compound where Fe2+/Fe3+ ions are known to arrange into a stripe charge-ordered state below…

Strongly Correlated Electrons · Physics 2013-02-07 D. K. Pratt , S. Chang , W. Tain , A. A. Taskin , Yoichi Ando , J. L. Zarestky , A. Kreyssig , A. I. Goldman , R. J. McQueeney

The present understanding of the electronic and magnetic properties of $\alpha'$-NaV$_2$O$_5$ is based on the hypothesis of strong charge disproportionation into V$^{4+}$ and V$^{5+}$, which is assumed to lead to a spin-1/2 Heisenberg chain…

Strongly Correlated Electrons · Physics 2009-10-31 P. Horsch , F. Mack

To investigate the possibility of charge order and superconductivity in a doped two-dimensional triangular lattice, we study the extended Hubbard model with variational Monte Carlo method. At n=2/3, a commensurate filling for a triangular…

Strongly Correlated Electrons · Physics 2007-05-23 Hiroshi Watanabe , Masao Ogata

Landau theory and symmetry considerations are invoked to give a unified treatment of charge and spin ordering in the mixed valence compound LuFe2O4. In particular, the unusual evolution of charge ordering correlations can be explained by…

Strongly Correlated Electrons · Physics 2013-05-29 A. B. Harris , T. Yildirim

A combined resistivity and hard x-ray diffraction study of superconductivity and charge ordering in $\mathrm{Ir_{1-x}Pt_xTe_2}$, as a function of Pt substitution and externally applied hydrostatic pressure, is presented. Experiments are…

Charge ordering in the low-temperature triclinic structure of titanium oxide (Ti4O7) is investigated using the local density approximation (LDA)+U method. Although the total 3d charge separation is rather small, an orbital order parameter…

Strongly Correlated Electrons · Physics 2007-08-21 I. Leonov , A. N. Yaresko , V. N. Antonov , U. Schwingenschlögl , V. Eyert , V. I. Anisimov

Charge and spin-Peierls instabilities in quarter-filled (n=1/2) compounds consisting of coupled ladders and/or zig-zag chains are investigated. Hubbard and t-J models including local Holstein and/or Peierls couplings to the lattice are…

Strongly Correlated Electrons · Physics 2009-10-31 J. Riera , D. Poilblanc

Ab initio calculations have been performed to unravel the origin of the recently found superlattice peaks in the trilayer nickelate La$_4$Ni$_3$O$_8$. These peaks arise from static charge ordering of Ni$^{2+}$/ Ni$^{1+}$ stripes oriented at…

Strongly Correlated Electrons · Physics 2016-08-31 A. S. Botana , V. Pardo , W. E. Pickett , M. R. Norman

Theoretical studies on charge ordering phenomena in quarter-filled molecular (organic) conductors are reviewed. Extended Hubbard models including not only the on-site but also the inter-site Coulomb repulsion are constructed in a…

Strongly Correlated Electrons · Physics 2007-05-23 Hitoshi Seo , Jaime Merino , Hideo Yoshioka , Masao Ogata

We study the 2D Ising model on a square lattice with additional non-equal diagonal next-nearest neighbor interactions. The cases of classical and quantum (transverse) models are considered. Possible phases and their locations in the space…

Statistical Mechanics · Physics 2009-11-10 G. Y. Chitov , C. Gros

Photonic modes exhibiting a polarization winding akin to a vortex possess an integer topological charge. Lasing with topological charge 1 or 2 can be realized in periodic lattices of up to six-fold rotational symmetry. Higher order charges…

Evidence is mounting that charge order competes with superconductivity in high Tc cuprates. Whether this has any relationship to the pairing mechanism is unknown since neither the universality of the competition nor its microscopic nature…

There have been recent reports of charge ordering around $x=0.5$ in the bilayer manganites. At $x=0.5$, there appears to be a coexistence region of layered A-type antiferromagnetc and charge order. There are also reports of orbital order in…

Strongly Correlated Electrons · Physics 2009-11-11 T. Maitra , A. Taraphder , H. Beck

We develop a microscopic theory for the charge ordering (CO) transitions in the spinels AlV$_2$O$_4$ and LiV$_2$O$_4$ (under pressure). The high degeneracy of CO states is lifted by a coupling to the rhombohedral lattice deformations which…

Strongly Correlated Electrons · Physics 2007-05-23 Y. Z. Zhang , P. Fulde , P. Thalmeier , A. Yaresko