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The spinel FeV2O4 is known to exhibit peculiar physical properties, which is generally ascribed to the unusual presence of two cations showing a pronounced interplay between spin, orbital and lattice degrees of freedom (Fe2+ and V3+ on the…

Materials Science · Physics 2012-02-16 Q. Zhang , K. Singh , F. Guillou , C. Simon , Y. Breard , V. Caignaert , V. Hardy

Considering spin-orbit coupling, the tetragonal crystal-field, and all relevant superexchange processes including quantum interference, we derive expressions for the energy levels of the vanadium ions in tetragonal Sr2VO4. The used…

Strongly Correlated Electrons · Physics 2015-06-03 M. V. Eremin , J. Deisenhofer , R. M. Eremina , J. Teyssier , D. van der Marel , A. Loidl

CaV$_2$O$_4$ is a spin-1 antiferromagnet, where the magnetic vanadium ions are arranged on quasi-one-dimensional (1D) zig-zag chains with potentially frustrated antiferromagnetic exchange interactions. High temperature susceptibility and…

We report detailed 51V NMR spectra in a single crystal of MnV2O4. The vanadium spectrum reveals two peaks in the orbitally ordered state, which arise from different internal hyperfine fields at two different V sublattices. These internal…

Strongly Correlated Electrons · Physics 2009-10-09 S. -H. Baek , N. J. Curro , K. -Y. Choi , A. P. Reyes , P. L. Kuhns , H. D. Zhou , C. R. Wiebe

The crystal and magnetic structures of the spinel compounds ZnCr$_2$S$_4$ and ZnCr$_2$Se$_4$ were investigated by high resolution powder synchrotron and neutron diffraction. ZnCr$_2$Se$_4$ exhibits a first order phase transition at $T_N=21$…

Strongly Correlated Electrons · Physics 2009-11-13 F. Yokaichiya , A. Krimmel , V. Tsurkan , I. Margiolaki , P. Thompson , H. N. Bordallo , A. Buchsteiner , N. Stüßer , D. N. Argyriou , A. Loidl

Dynamical properties of the lattice structure was studied by optical spectroscopy in ACr2O4 chromium spinel oxide magnetic semiconductors over a broad temperature region of T=10-335K. The systematic change of the A-site ions (A=Mn, Fe, Co,…

Strongly Correlated Electrons · Physics 2013-07-24 V. Kocsis , S. Bordács , D. Varjas , K. Penc , A. Abouelsayed , C. A. Kuntscher , K. Ohgushi , Y. Tokura , I. Kézsmárki

We present an analytical model of orbital ordering in vanadium spinel MnV2O4. The model is based on recent first-principles calculation indicating a strong trigonal distortion at the vanadium sites of this compound [Phys. Rev. Lett. 102,…

Strongly Correlated Electrons · Physics 2010-07-13 Gia-Wei Chern , Natalia Perkins , Zhihao Hao

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

We study the exchange constants of MnV$_2$O$_4$ using magnetic force theorem and local spin density approximation of density functional theory supplemented with a correction due to on-site Hubbard interaction U. We obtain the exchanges for…

Materials Science · Physics 2013-08-13 R. Nanguneri , S. Y. Savrasov

Metal-insulator transition was microscopically investigated by orbital-resolved nuclear magnetic resonance (OR-NMR) spectroscopy in a single crystal of vanadium dioxide VO$_2$. Observations of the anisotropic $^{51}$V Knight shift and the…

Strongly Correlated Electrons · Physics 2020-06-15 Yasuhiro Shimizu , Takaaki Jin-no , Fumitatsu Iwase , Masayuki Itoh , Yutaka Ueda

The effects of the spin and lattice degrees of freedom on the electronic structure of M1 vanadium dioxide are explored using a quasiparticle description. Contraction of the inter-vanadium spacing of the Peierls pairings stabilizes bonding…

Strongly Correlated Electrons · Physics 2014-10-27 Jamie Booth , Daniel Drumm , Phil Casey , Jackson Smith , Salvy Russo

We study quantum phase transitions induced by the on-site spin-orbit interaction lambda(L.S) in a toy model of vanadium chains. In the lambda->0 limit, the decoupled spin and orbital sectors are described by a Haldane and an Ising chain,…

Strongly Correlated Electrons · Physics 2011-02-15 Gia-Wei Chern , N. B. Perkins , G. I. Japaridze

Motivated by recent theoretical and experimental controversy, we present a theoretical study to clarify the orbital symmetry of the ground state of vanadium spinel oxides AV$_2$O$_4$ (A=Zn, Mg, Cd). The study is based on an effective…

Strongly Correlated Electrons · Physics 2007-05-23 S. Di Matteo , G. jackeli , N. B. Perkins

We investigate the highly frustrated spin and orbital superexchange interactions in cubic vanadates. The fluctuations of $t_{2g}$ orbitals trigger a {\it novel mechanism of ferromagnetic interactions} between spins S=1 of V$^{3+}$ ions…

Strongly Correlated Electrons · Physics 2009-11-07 G. Khaliullin , P. Horsch , A. M. Oles

Neutron and X-ray diffraction, magnetic susceptibility, and specific heat measurements have been used to investigate the magnetic and structural phase transitions of the spinel system Fe1+xCr2-xO4(0.0<=x<=1.0). The temperature versus Fe…

We study the magnetic ordering of Vanadium spinels by Quantum Monte Carlo simulations of a three-band Hubbard model. Vanadium spinels, AV$_2$O$_4$, exhibit a unique "up-up-down-down" spin ordering at low temperatures. While this magnetic…

Strongly Correlated Electrons · Physics 2012-11-22 Yasuyuki Kato

We demonstrate that the onset of complex spin orders in ACr$_2$O$_4$ spinels with magnetic A$=$Co, Fe and Cu ions lowers the lattice symmetry. This is clearly indicated by the emergence of anisotropic lattice dynamics -- as evidenced by the…

Strongly Correlated Electrons · Physics 2014-01-15 S. Bordacs , D. Varjas , I. Kezsmarki , G. Mihaly , L. Baldassarre , A. Abouelsayed , C. A. Kuntscher , K. Ohgushi , Y. Tokura

Electronic structure calculations for spinel vanadate ZnV$_2$O$_4$ show that partial electronic delocalization in this system leads to structural instabilities. These are a consequence of the proximity to the itinerant-electron boundary,…

Strongly Correlated Electrons · Physics 2009-11-13 V. Pardo , S. Blanco-Canosa , F. Rivadulla , D. I. Khomskii , D. Baldomir , Hua Wu , J. Rivas

In this work we apply the density matrices approach to orbital ordering (OO) in order to study the OO of the spinel vanadates AV$_{2}$O$_{4}$ (A $\equiv$ Zn, Cd and Mg), which is normally believed to be responsible for the structural…

Strongly Correlated Electrons · Physics 2017-04-24 Sohan Lal , Sudhir K. Pandey

At room temperature, the normal oxide spinels NiCr_2O_4 and CuCr_2O_4 are tetragonally distorted and crystallize in the I4_1/amd space group due to cooperative Jahn-Teller ordering driven by the orbital degeneracy of tetrahedral Ni$^{2+}$…

Materials Science · Physics 2012-09-11 Matthew R. Suchomel , Daniel P. Shoemaker , Lynn Ribaud , Moureen C. Kemei , Ram Seshadri