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The subtle interplay between competing degrees of freedom, crystal electric fields, and spin correlations can lead to exotic quantum states in 4f ion-based frustrated triangular lattice antiferromagnets. We present the crystal structure,…

Iridates have been providing a fertile ground for studying emergent phases of matter that arise from delicate interplay of various fundamental interactions with approximate energy scale. Among these highly focused quantum materials,…

材料科学 · 物理学 2023-09-19 Chengliang Lu , Jun-Ming Liu

The semi-metallic behavior of the perovskite iridate SrIrO3 shifts the end-member of the strongly spin-orbit (SO) coupled Ruddlesden-Popper series Srn+1IrnO3n+1 away from the Mott insulating regime and the half-filled pseudospin Jeff=1/2…

强关联电子 · 物理学 2025-02-06 Dirk Fuchs , Arun Kumar Jaiswal , Fabrice Wilhelm , Di Wang , Andre Rogalev , Matthieu Le Tacon

We report magnetic and thermodynamic properties of a $4d^1$ (Mo$^{5+}$) magnetic insulator MoOPO$_4$ single crystal, which realizes a $J_1$-$J_2$ Heisenberg spin-$1/2$ model on a stacked square lattice. The specific-heat measurements show a…

Sr$_2$IrO$_4$ has attracted a lot of attention due to its structural and electronic similarities to La$_2$CuO$_4$ which is the parent compound of high-T$_c$ superconducting cuprates. It was proposed to be a strong spin-orbit coupled…

The spin-orbit Mott insulator Sr3Ir2O7 provides a fascinating playground to explore insulator-metal transition driven by intertwined charge, spin, and lattice degrees of freedom. Here, we report high pressure electric resistance and…

Spin-orbit (SO) Mott insulators are regarded as a new paradigm of magnetic materials, whose properties are largely influenced by SO coupling and featured by highly anisotropic bond-dependent exchange interactions between the spin-orbital…

强关联电子 · 物理学 2018-11-14 S. A. Nikolaev , I. V. Solovyev , A. N. Ignatenko , V. Yu. Irkhin , S. V. Streltsov

We have investigated the effect of pressure on the electronic, magnetic, and structural properties on a single crystal of conducting, ferromagnet (T$_{C}$=157K) La$_{0.82}$Sr$_{0.18}$CoO$_{3}$ located near the boundary of the…

We establish the double perovskite Ba$_2$CeIrO$_6$ as a nearly ideal model system for j=1/2 moments, with resonant inelastic x-ray scattering indicating a deviation of less than 1% from the ideally cubic j=1/2 state. The local j=1/2 moments…

CuAl2O4 is a normal spinel oxide having quantum spin, S=1/2 for Cu2+. It is a rather unique feature that the Cu2+ ions of CuAl2O4 sit at a tetrahedral position, not like the usual octahedral position for many oxides. At low temperatures, it…

The Kitaev model of spin-1/2 on a honeycomb lattice supports degenerate topological ground states and may be useful in topological quantum computation. Na$_{2}$IrO$_{3}$ with honeycomb lattice of Ir ions have been extensively studied as…

材料科学 · 物理学 2018-10-03 Kaige Hu , Zhimou Zhou , Yi-Wen Wei , Chao-Kai Li , Ji Feng

In the context of correlated insulators, where electron-electron interactions (U) drive the localization of charge carriers, the metal-insulator transition (MIT) is described as either bandwidth (BC) or filling (FC) controlled. Motivated by…

We study the electronic structure of cubic phase uranium dioxide at different volumes using a combination of density functional theory and dynamical mean-field theory. The \emph{ab initio} calculations predict an orbital-selective Mott…

强关联电子 · 物理学 2017-11-22 Li Huang , Yilin Wang , Philipp Werner

Lacunar spinel GaTa$_4$Se$_8$ is a unique example of spin-orbit coupled Mott insulator described by molecular $j_{\text{eff}}\!=\!3/2$ states. It becomes superconducting at T$_c$=5.8K under pressure without doping. In this work, we show,…

强关联电子 · 物理学 2020-06-09 Moon Jip Park , GiBaik Sim , Min Yong Jeong , Archana Mishra , Myung Joon Han , SungBin Lee

By performing pressure simulations within density functional theory for the family of iron-based superconductors $Ae{}A$Fe$_4$As$_4$ with $Ae$ = Ca, Sr, Ba and $A$ = K, Rb, Cs we predict in these systems the appearance of two consecutive…

材料科学 · 物理学 2018-08-29 Vladislav Borisov , Paul C. Canfield , Roser Valenti

Using ab-initio methods for correlated electrons in solids, we investigate the metal-insulator transition across the Ruddlesden-Popper (RP) series of iridates and explore the robustness of the J_eff=1/2 state against band effects due to…

强关联电子 · 物理学 2014-01-10 Hongbin Zhang , Kristjan Haule , David Vanderbilt

We study theoretically low-temperature phases of a recently synthesized compound Sr$_2$CoO$_3$F under pressure. The analysis combining LDA+DMFT and a strong-coupling effective model points to the existence of not only normal paramagnetic…

强关联电子 · 物理学 2019-05-15 Juan Fernández Afonso , Andrii Sotnikov , Atsushi Hariki , Jan Kuneš

The double perovskite Ba$_{2}$NaOsO$_{6}$ (BNOO), an exotic example of a very high oxidation state (heptavalent) osmium $d^1$ compound and also uncommon by being a ferromagnetic Mott insulator without Jahn-Teller (JT) distortion, is modeled…

强关联电子 · 物理学 2015-06-23 Shruba Gangopadhyay , Warren E. Pickett

Structural properties of CuAl$_{2}$O$_{4}$, which was recently argued to show unusual suppression of the Jahn-Teller distortions by the spin-orbit coupling, are investigated under pressures up to 6 GPa. Analysis of X-ray powder diffraction…

强关联电子 · 物理学 2020-11-10 P. A. Agzamova , A. A. Belik , S. V. Streltsov

High-pressure optical-absorption measurements performed in CuWO4 up to 20 GPa provide experimental evidence of the persistence of the Jahn-Teller (JT) distortion in the whole pressure range both in the low-pressure triclinic and in the…

材料科学 · 物理学 2012-04-20 J. Ruiz-Fuertes , A. Segura , F. Rodriguez , D. Errandonea , M. N. Sanz-Ortiz