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In recent years, A-site ordered half-doped double-perovskite manganites $\rm RBaMn_2O_6$ (R=rare earth) have attracted much attention due to their remarkable physical properties and a prospect of application as magnetoresistance,…

强关联电子 · 物理学 2022-05-20 Sergey V. Streltsov , R. E. Ryltsev , N. M. Chtchelkatchev

Double perovskites containing 4d--4f interactions provide a platform to study complex magnetic phenomena in correlated systems. Here, we investigate the magnetic ground state and quasiparticle excitations of the fascinating double…

Ruthenates, materials with a single magnetic Ruthenium (Ru) atom, often display an exotic array of ground states ranging from superconductivity to altermagnetism. In this work, we investigated the magnetic ground state of a least explored…

We report a comprehensive investigation of Ln2NiIrO6 (Ln = La, Pr, Nd) using thermodynamic and transport properties, neutron powder diffraction, resonant inelastic x-ray scattering, and density functional theory (DFT) calculations to…

强关联电子 · 物理学 2021-06-04 T. Ferreira , S. Calder , D. S. Parker , M. H. Upton , A. S. Sefat , H. -C. zur Loye

Sr$_2$FeOsO$_6$ is an insulating double perovskite compound which undergoes antiferromagnetic transitions at 140 K ($T_{N1}$) and 67 K ($T_{N2}$). To study the underlying electronic and magnetic interactions giving rise to this behavior we…

The ferromagnetic semiconductor Ba2NiOsO6 (Tmag ~100 K) was synthesized at 6 GPa and 1500 {\deg}C. It crystallizes into a double perovskite structure [Fm-3m; a = 8.0428(1) {\AA}], where the Ni2+ and Os6+ ions are perfectly ordered at the…

Transition metal oxides, in particular, 3d or 4d perovskites have provided diverse emergent physics that originates from the coupling of various degrees of freedom such as spin, lattice, charge, orbital, and also disorder. 5d perovskites…

强关联电子 · 物理学 2016-04-19 Abhijit Biswas , Ki-Seok Kim , Yoon Hee Jeong

To develop new devices based on synthetic ferrimagnetic heterostructures, understanding the material's physical properties is pivotal. Here, the induced magnetic moment (IMM), magnetic exchange coupling, and spin textures are investigated…

In 5d transition metal oxides such as the iridates, novel properties arise from the interplay of electron correlations and spin-orbit interactions. We investigate the electronic structure of the pyrochlore iridates, (such as…

强关联电子 · 物理学 2015-05-19 Xiangang Wan , Ari Turner , Ashvin Vishwanath , Sergey Y. Savrasov

We have performed magnetic susceptibility, heat capacity, neutron powder diffraction, and muon spin relaxation experiments to investigate the magnetic ground states of the 5$d^2$ double perovskites Sr$_2$YReO$_6$ and Sr$_2$InReO$_6$. We…

强关联电子 · 物理学 2016-06-15 A. A. Aczel , Z. Zhao , S. Calder , D. T. Adroja , P. J. Baker , J. -Q. Yan

We synthesize and study single crystals of a new double-perovskite Sr2YIrO6. Despite two strongly unfavorable conditions for magnetic order, namely, pentavalent Ir5+(5d4) ions which are anticipated to have Jeff=0 singlet ground states in…

强关联电子 · 物理学 2014-02-18 G. Cao , T. F. Qi , L. Li , J. Terzic , S. J. Yuan , L. E. DeLong , G. Murthy , R. K. Kaul

Materials with a 5d4 electronic configuration are generally considered to have a nonmagnetic ground state (J=0). Interestingly, Sr2YIrO6 (Ir5+ having 5d4 electronic configuration) was recently reported to exhibit long-range magnetic order…

The two-dimensional layered perovskite Sr2IrO4 was proposed to be a spin-orbit Mott insulator, where the effect of Hubbard interaction is amplified on a narrow J_{eff} = 1/2 band due to strong spin-orbit coupling. On the other hand, the…

强关联电子 · 物理学 2012-03-08 Jean-Michel Carter , V. Vijay Shankar , M. Ahsan Zeb , Hae-Young Kee

Recently, the iridate double perovskite Sr$_2$YIrO$_6$ has attracted considerable attention due to the report of unexpected magnetism in this Ir$^{5+}$ (5d$^4$) material, in which according to the J$_{eff}$ model, a non-magnetic ground…

In double perovskite oxides (A$_2$BB$^\prime$O$_6$), magnetism often arises from diluted magnetic lattices, created by combining a perovskite structure with localized 3$d$ magnetic elements (B) alongside another perovskite lattice…

强关联电子 · 物理学 2024-08-20 Sromona Nandi , Subhadip Pradhan , Ashis K. Nandy , Rudra Sekhar Manna

The electronic and magnetic properties of recently synthesized new perovskite phase of HgMnO$_3$ are studied. By means of $ab$ $initio$ DFT calculations this material was shown to be altermagnetic. We discuss features of its electronic…

强关联电子 · 物理学 2024-10-04 Danil A. Myakotnikov , Evgenia V. Komleva , Youwen Long , Sergey V. Streltsov

Cobaltates have rich spin-states and diverse properties. Using spin-state pictures and firstprinciples calculations, here we study the electronic structure and magnetism of the mixed-valent double perovskite YBaCo2O6. We find that YBaCo2O6…

材料科学 · 物理学 2021-08-13 Wentao Hu , Ke Yang , Xuan Wen , Hua Wu

Using Wannier functions to represent the density functional results we calculate the hybridization corrections to the orbital momentum operator in the Os 5d shell of Mott insulators Ba2NaOsO6 and Ba2YOsO6. The g-factors are obtained by…

强关联电子 · 物理学 2017-02-20 Kyo-Hoon Ahn , Karel Pajskr , Kwan-Woo Lee , Jan Kunes

We have performed a comprehensive, first-principles high-throughput study of the magnetic properties of halide double perovskites, $Cs_2BB^\prime Cl_6$, with magnetic ions occupying one or both B and B$^\prime$ sites. Our findings indicate…

材料科学 · 物理学 2023-06-16 Utkarsh Singh , Johan Klarbring , Igor A. Abrikosov , Sergei I. Simak

The 3$d$-5$d$ based double perovskites offer an ideal playground to study the interplay between electron correlation ($U$) and spin-orbit coupling (SOC) effect, showing exotic physics. The Sr$_2$FeIrO$_6$ is an interesting member in this…