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Related papers: Stress Induced Charge-Ordering Process in LiMn2O4

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Exotic quantum phenomena often emerge near an electronic delocalization transition (EDT) from an antiferromagnetic insulating phase to a strongly correlated metallic state under pressure. We report the pressure-induced structural and…

Strongly Correlated Electrons · Physics 2026-03-13 Matt Boswell , Antonio M. dos Santos , Mingyu Xu , Madalynn Marshall , Su-Yang Xu , Weiwei Xie

The electrochemical performance of the spinel LiNi0.5Mn1.5O4, a high-voltage positive electrode material for Li-ion batteries, is influenced by the transition metal arrangement in the octahedral network, leading to disordered (Fd m S.G.)…

The high-pressure behaviour of Na$_2$CuF$_4$ is explored by powder neutron diffraction and density functional theory (DFT) calculations. A first-order phase transition is observed to take place between 2.4 - 2.9 GPa, involving a…

Rare earth perovskites ($R^{3+}$M$^{3+}$O$_3$), with $e_g^1$ electronic occupation of the M $d$ states, display different types of metal-insulator transition. For manganites (M=Mn), metal-insulator transition is usually induced by the…

Strongly Correlated Electrons · Physics 2025-04-04 Subhadeep Bandyopadhyay , Philippe Ghosez

Lithium ion batteries often contain transition metal oxides like Li$_{x}$Mn$_2$O$_4$ ($0\leq x\leq2$). Depending on the Li content different ratios of Mn$^\text{III}$ to Mn$^\text{IV}$ ions are present. In combination with electron hopping…

Materials Science · Physics 2022-01-25 Marco Eckhoff , Knut Nikolas Lausch , Peter E. Blöchl , Jörg Behler

Spinel lithium manganese oxide (LixMn2O4) is used as an active material in battery cathodes. It is a relatively inexpensive and environmentally friendly material, but suffers from capacity fade during use. The capacity losses are generally…

Materials Science · Physics 2020-02-13 Torben Erichsen , Björn Pfeiffer , Vladimir Roddatis , Cynthia A. Volkert

Combined effects of electron correlations and lattice distortions are investigated on the charge ordering in \theta-(BEDT-TTF)2RbZn(SCN)4 theoretically in a two-dimensional 3/4-filled extended Hubbard model with electron-lattice couplings.…

Strongly Correlated Electrons · Physics 2009-11-13 Satoshi Miyashita , Kenji Yonemitsu

The Jahn-Teller effect in the charge-ordered (CO) state for La1-xCaxMnO3 (0.5<x<0.87) was studied by measuring the low-temperature powder x-ray diffraction, internal friction, and shear modulus. We find that the electron-lattice interaction…

Strongly Correlated Electrons · Physics 2009-11-07 R. K. Zheng , R. X. Huang , A. N. Tang , G. Li , X. G. Li , J. N. Wei , J. P. Shui , Z. Yao

Dielectric and magnetic phenomena in spin and charge frustrated system RFe2O4 (R is a rare-earth metal ion) are studied. An electronic model for charge, spin and orbital degrees in a pair of triangular-lattice planes is derived. We analyze…

Strongly Correlated Electrons · Physics 2009-11-13 Makoto Naka , Aya Nagano , Sumio Ishihara

We investigated the series of temperature and field-driven transitions in LuFe$_2$O$_4$ by optical and M\"{o}ssbauer spectroscopies, magnetization, and x-ray scattering in order to understand the interplay between charge, structure, and…

Strongly Correlated Electrons · Physics 2008-11-28 X. S. Xu , M. Angst , T. V. Brinzari , R. P. Hermann , J. L. Musfeldt , A. D. Christianson , D. Mandrus , B. C. Sales , S. McGill , J. -W. Kim , Z. Islam

We present evidence that the insulator to metal transition in (La,Ca)MnO3 near x~0.2 is driven by the suppression of coherent Jahn-Teller distortions, originating from d type orbital ordering. The orbital ordered state is characterised by…

Materials Science · Physics 2009-11-07 Bas B. Van Aken , Auke Meetsma , Y. Tomioka , Y. Tokura , Thomas T. M. Palstra

Using the multiband $d-p$ model and unrestricted Hartree-Fock approximation we investigate the electronic structure and spin-orbital order in three-dimensional MnO$_3$ lattice such as realized in LaMnO$_3$. The orbital order is induced and…

Strongly Correlated Electrons · Physics 2019-04-04 Krzysztof Rościszewski , Andrzej M. Oleś

By means of first-principles electronic structure calculations, we hereby investigate the structural transitions induced by epitaxial strain in (111)-oriented (LaMnO$_3$)$_{2n}|$(SrMnO$_3$)$_n$ superlattices, with $n=2,4,6$. All…

Materials Science · Physics 2026-03-04 Imran Ahamed , Shivalika Sharma , Fabrizio Cossu , Igor Di Marco

We report an investigation of charge, spin and lattice effects in the spin-Peierls state of the organic compound MEM(TCNQ)$_2$. The 16.5 GHz dielectric function along the chain axis shows an enhancement below the spin-Peierls transition…

Strongly Correlated Electrons · Physics 2015-06-17 M. Poirier , M. de Lafontaine , C. Bourbonnais , J. -P. Pouget

The multi-order Raman scattering is studied up to a fourth order for a detwinned LaMnO_3 crystal. Based on a comprehensive data analysis of the polarisation-dependent Raman spectra, we show that the anomalous features in the multi-order…

The spinel-structured lithium manganese oxide (LiMn$_2$O$_4$) is a material currently used as cathode for secondary lithium-ion batteries, but whose properties are not yet fully understood. Here, we report a computational investigation of…

Materials Science · Physics 2018-03-14 David Santos-Carballal , Phuti E. Ngoepe , Nora H. de Leeuw

Spin-charge-orbital ordered structures in doped layered manganites are investigated using an orbital-degenerate double-exchange model tightly coupled to Jahn-Teller distortions. In the ferromagnetic phase, unexpected diagonal stripes at…

Strongly Correlated Electrons · Physics 2009-10-31 Takashi Hotta , Adrian Feiguin , Elbio Dagotto

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,…

Materials Science · Physics 2009-11-13 Y. Zhang , H. X. Yang , C. Ma , H. F. Tian , J. Q. Li *

We report an inelastic light scattering study of the effects of charge-ordering on the spin-, charge-, and lattice-dynamics in ${\rm Bi}_{1-x}{\rm Ca}_{x}{\rm MnO}_3$ $(x>0.5)$. We find that charge-ordering results in anomalous phonon…

Strongly Correlated Electrons · Physics 2009-10-31 S. Yoon , M. Rubhausen , S. L. Cooper , K. H. Kim , S-W. Cheong

We report a detailed neutron scattering study of the ordering of spins and holes in oxygen-doped La(2)NiO(4.133). The single-crystal sample exhibits the same oxygen-interstitial order but better defined charge-stripe order than that studied…

Strongly Correlated Electrons · Physics 2009-10-30 P. Wochner , J. M. Tranquada , D. J. Buttrey , V. Sachan