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We show that the valence electrons of Ba3NaRu2O9, which has a quasi-molecular structure, completely crystallize below 210 K. Using an extended Hubbard model, we show that the charge ordering instability results from long-range Coulomb…

We have re-investigated the crystal structure of a spinel type CuIr2S4 at low temperatures using a single-crystal in a synchrotron radiation x-ray diffraction experiment. The crystal structure of the low-temperature phase of CuIr2S4 has…

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…

强关联电子 · 物理学 2007-05-23 Y. Z. Zhang , P. Fulde , P. Thalmeier , A. Yaresko

The low and high-temperature phases of V$_4$O$_7$ have been studied by \textit{ab initio} calculations. At high temperature, all V atoms are electronically equivalent and the material is metallic. Charge and orbital ordering, associated…

强关联电子 · 物理学 2011-12-06 A. S. Botana , V. Pardo , D. Baldomir , A. V. Ushakov , D. I. Khomskii

The structural features of the charge ordering states in LuFe2O4 are characterized by in-situ cooling TEM observations from 300K down to 20K. Two distinctive structural modulations, a major q1= (1/3, 1/3, 2) and a weak q2=q1/10 + (0, 0,…

材料科学 · 物理学 2009-11-13 Y. Zhang , H. X. Yang , C. Ma , H. F. Tian , J. Q. Li *

Resonant soft x-ray scattering experiments with photon energies near the O K and the Cu L3 edge on the system La1.8-xEu0.2SrxCuO4 for 0.1 <= x <= 0.15 are presented. A phase diagram for stripe-like charge ordering is obtained together with…

超导电性 · 物理学 2015-05-20 Jörg Fink , Victor Soltwisch , Jochen Geck , Enrico Schierle , Eugen Weschke , Bernd Büchner

Measurements of the electrical and thermal conductivities, thermopower and paramagnetic susceptibility have been performed on single crystal samples of Bi1/2Sr1/2MnO3 and complemented with the X-ray powder diffraction data. A pronounced…

强关联电子 · 物理学 2009-11-07 J. Hejtmanek , K. Knizek , Z. Jirak , M. Hervieu , C. Martin , M. Nevriva , P. Beran

The crystal structure of Fe3O4 below the 122 K Verwey transition has been refined using high-resolution X-ray and neutron powder diffraction data. The refinements give direct evidence for charge ordering (CO) over four independent…

强关联电子 · 物理学 2009-11-07 J. P. Wright , J. P. Attfield , P. G. Radaelli

The local structure of the spinel LiRh$_2$O$_4$ has been studied using atomic pair distribution function (PDF) analysis of powder x-ray diffraction data. This measurement is sensitive to the presence of short Rh-Rh bonds that form due to…

Measurements of dc magnetization ($M$) and electrical resistivity ($\rho$) have been carried out as a function of temperature ($T$) for layered oxide Li$_{\rm x}$CoO$_2$ (0.51$\leq$$x$$\leq$1.0) using single crystal specimens. After slow…

强关联电子 · 物理学 2018-11-14 Kiyotaka Miyoshi , Kentaro Manami , Ryo Sasai , Shijo Nishigori , Jun Takeuchi

In {\delta}-Ag2/3V2O5 with charge degrees of freedom in V, it is known that the charge ordering state and physical properties of V that appear at low temperatures depend strongly on the ordering state of Ag. In this study, we focused on the…

强关联电子 · 物理学 2024-03-13 T. Kubo , K. Kojima , N. Katayama , T. Runčevski , R. E. Dinnebier , A. S. Gibbs , M. Isobe , H. Sawa

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…

强关联电子 · 物理学 2007-08-21 I. Leonov , A. N. Yaresko , V. N. Antonov , U. Schwingenschlögl , V. Eyert , V. I. Anisimov

Charge ordering phenomenon in $\theta$-(BEDT-TTF)$_2$X is studied by using 1/4-filled extended Hubbard model on an anisotropic triangular lattice through mean-field approximation. It is found that a metallic charge ordered state with…

强关联电子 · 物理学 2009-11-11 Masato Kaneko , Masao Ogata

We theoretically investigate the competition between charge-ordered state and Mott insulating state at finite temperatures in quarter-filled quasi-one-dimensional electron systems, by studying dimerized extended Hubbard chains with…

强关联电子 · 物理学 2007-10-09 Hideo Yoshioka , Masahisa Tsuchiizu , Hitoshi Seo

The low-temperature electronic and magnetic properties of NH$_4$V$_2$O$_5$, an isoelectronic analog of the spin-ladder compound $\alpha'$-NaV$_2$O$_5$, are investigated using DFT+$U$ calculations. Two charge-ordering patterns - zigzag and…

强关联电子 · 物理学 2025-08-20 Dm. M. Korotin

The charge ordering in La1.5Sr0.5NiO4 has been studied with neutron diffraction technique. An interesting rearrangement of the charge ordering was observed as a function of temperature. With decreasing temperature, a checkerboard-type…

强关联电子 · 物理学 2009-11-07 R. Kajimoto , K. Ishizaka , H. Yoshizawa , Y. Tokura

X-ray scattering by multiferroic LuFe2O4 is reported. Below 320 K, superstructure reflections indicate an incommensurate charge order with propagation close to (1/3,1/3,3/2). The corresponding charge configuration, also found by electronic…

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…

强关联电子 · 物理学 2007-05-23 Hitoshi Seo , Jaime Merino , Hideo Yoshioka , Masao Ogata

The competition between long-range and short-range interactions among holes moving in an antiferromagnet (AF), is studied within a model derived from the spin density wave picture of layered transition metal oxides. A novel numerical…

It is argued that both transitions observed in 50%-doped manganites, at the N\'{e}el temperature ($T_{\rm N}$) and the so-called charge ordering temperature ($T_{\rm CO}$), are magnetic. $T_{\rm N}$ corresponds to the order-disorder…

强关联电子 · 物理学 2007-05-23 I. V. Solovyev
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