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Related papers: Orbital ordering in charge transfer insulators

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We derive a spin-orbital model for insulating LaMnO_3 which fulfills the SU(2) symmetry of S=2 spins at Mn^{3+} ions. It includes the complete e_g and t_{2g} superexchange which follows from a realistic Mn^{2+} multiplet structure in cubic…

Strongly Correlated Electrons · Physics 2009-10-31 Louis Felix Feiner , Andrzej M. Oles

We study the manganese oxides from the viewpoint of the strongly correlated doped Mott insulator. The magnetic ordering and the charge transport are governed by the orbital degrees of freedom, and their dimensionality is controlled by the…

Strongly Correlated Electrons · Physics 2016-08-31 R. Maezono , S. Murakami , N. Nagaosa , S. Ishihara , M. Yamanaka , H. C. Lee

A spin-orbital superexchange Hamiltonian in a Mott insulator with $t_{2g}$ orbital degeneracy is investigated. More specifically, we focus on a spin ferromagnetic state of the model and study a collective behavior of orbital angular…

Strongly Correlated Electrons · Physics 2009-11-11 G. Khaliullin , S. Okamoto

We study a two dimensional, two-band double-exchange model for $e_g$ electrons coupled to Jahn-Teller distortions in the presence of quenched disorder using a recently developed Monte-Carlo technique. In the absence of disorder the…

Strongly Correlated Electrons · Physics 2008-01-29 Sanjeev Kumar , Arno P. Kampf , Pinaki Majumdar

We study the ground state orbital ordering of $LaMnO_3$, at weak electron-phonon coupling, when the spin state is A-type antiferromagnet. We determine the orbital ordering by extending to our Jahn-Teller system a recently developed Peierls…

Strongly Correlated Electrons · Physics 2015-05-13 S. Yarlagadda , P. B. Littlewood , M. Mitra , R. K. Monu

To understand the orbital ordering of $LaMnO_3$ in the ground state, we study it in the A-type spin antiferromagnetic state. We calculate the two-dimensional response functions associated with the Jahn-Teller $Q_2$ and $Q_3$ distortions and…

Strongly Correlated Electrons · Physics 2007-05-23 Sudhakar Yarlagadda , Manidipa Mitra

We study the effects of temperature and magnetic field on a two-orbital Hubbard model within dynamical mean field theory. We focus on the quarter filled system, which is a special point in the phase diagram due to orbital degeneracy. At…

Strongly Correlated Electrons · Physics 2011-03-29 Robert Peters , Norio Kawakami , Thomas Pruschke

It was recently discovered that in spite of the scalar nature of its order parameter, the charge order in 1T-TiSe2 can be chiral. This is made possible by the emergence of orbital order in conjunction with the charge density modulations.…

Strongly Correlated Electrons · Physics 2012-02-16 Jasper van Wezel

We investigate the origin of the orbital ordering in the paramagnetic phase of KCrF$_3$. All previous studies described structural parameters of the paramagnetic phase using a magnetic ordering in the compound. Our simulations of real…

Strongly Correlated Electrons · Physics 2016-08-24 D. Novoselov , Dm. M. Korotin , V. I. Anisimov

A gas of strongly interacting spinless p-orbital fermionic atoms in 2D optical lattices is proposed and studied. Several interesting new features are found. In the Mott limit on a square lattice, the gas is found to be described effectively…

Strongly Correlated Electrons · Physics 2009-11-13 Erhai Zhao , W. Vincent Liu

An orbital ordering, often observed in Mott insulators with orbital degeneracy, is usually supposed to disappear with doping, e.g. in the ferromagnetic metallic phase of manganites. We propose that the orbital ordering of a novel type may…

Condensed Matter · Physics 2016-08-31 Daniel Khomskii

Resonant soft x-ray diffraction has been used to probe the temperature dependent orbital and magnetic structure of $\mathrm{LaSr_{2}Mn_{2}O_7}$. Previous crystallographic studies have shown that this material has almost no MnO$_{6}$ oxygen…

Strongly Correlated Electrons · Physics 2007-05-23 S. B. Wilkins , N. Stojic , T. A. W. Beale , N. Binggeli , P. Bencok , S. Stanescu , J. F. Mitchell , P. Abbamonte , P. D. Hatton , M. Altarelli

It is shown that the time-reversal symmetry is broken during the phase transition causing orbital ordering in a crystal with Jahn-Teller (J-T) ions. This means that such phase transitions are magnetic ones. As an example we have considered…

Strongly Correlated Electrons · Physics 2023-11-27 Khisa Borlakov , Dalkhat Ediev , Amina Borlakova

The orbital, lattice, and spin ordering phenomena in KCuF3 are investigated by means of LDA+U calculations, based on ab-initio pseudopotentials.We examine the Cu-3d orbital ordering and the associated Jahn-Teller distortion in several…

Strongly Correlated Electrons · Physics 2009-11-10 N. Binggeli , M. Altarelli

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…

Strongly Correlated Electrons · Physics 2011-12-06 A. S. Botana , V. Pardo , D. Baldomir , A. V. Ushakov , D. I. Khomskii

Basic mechanisms controlling orbital order and orbital fluctuations in transition metal oxides are discussed. The lattice driven classical orbital picture, e.g. like in manganites LaMnO$_3$, is contrasted to the quantum behavior of orbitals…

Strongly Correlated Electrons · Physics 2009-11-11 Giniyat Khaliullin

The interactions between charge and orbitally ordered $d$-electrons are important in many transition metal oxides. We propose an effective energy model for such interactions, parameterized with DFT+U calculations, so that energy…

Strongly Correlated Electrons · Physics 2015-11-17 Fei Zhou , Gerbrand Ceder

Besides superconductivity, copper-oxide high temperature superconductors are susceptible to other types of ordering. We use scanning tunneling microscopy and resonant elastic x-ray scattering measurements to establish the formation of…

The standard way to find the orbital occupation of Jahn-Teller (JT) ions is to use structural data, with the assumption of a one-to-one correspondence between the orbital occupation and the associated JT distortion, e.g. in O6 octahedron.…

Strongly Correlated Electrons · Physics 2011-10-19 Hua Wu , C. F. Chang , O. Schumann , Z. Hu , J. C. Cezar , T. Burnus , N. Hollmann , N. B. Brookes , A. Tanaka , M. Braden , L. H. Tjeng , D. I. Khomskii

Motivated by recent experimental progress in transition metal oxides with the K$_2$NiF$_4$ structure, we investigate the magnetic and orbital ordering in $\alpha$-Sr$_2$CrO$_4$. Using first principles calculations, first we derive a…

Strongly Correlated Electrons · Physics 2021-01-20 Bradraj Pandey , Yang Zhang , Nitin Kaushal , Rahul Soni , Ling-Fang Lin , Wen-Jun Hu , Gonzalo Alvarez , Elbio Dagotto