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Magnetic properties of the Sr-doped BaCoO$_3$ are explained on the basis of ab initio calculations and the analysis of experimental literature. Formation of magnetic clusters bigger than in the parent compound and increase in the blocking…

强关联电子 · 物理学 2009-11-11 V. Pardo , J. Rivas , D. Baldomir

The magnetic phases of electron-doped infinite-layer Sr$_{1-x}$La$_x$CuO$_2$ are elucidated by first-principles density functional calculations. The antiferromagnetic parent state, metallic transition, as well as lattice evolution with…

超导电性 · 物理学 2024-12-10 Alpin N. Tatan , Jun Haruyama , Osamu Sugino

We have prepared a series of polycrystalline samples La$_{0.5}$Sr$_{0.5}$CoO$_{3-\delta}$} with $0 < \delta \le 0.21$ and characterized their oxygen content, crystal structure, and magnetic properties. While the fully oxygenated samples are…

材料科学 · 物理学 2007-05-23 Ryan P. Haggerty , Ram Seshadri

First-principles calculations to study the electronic and magnetic properties of bulk, oxygen-deficient SrTiO$_3$ (STO) under different doping conditions and densities have been conducted. The appearance of magnetism in oxygen-deficient STO…

材料科学 · 物理学 2016-03-30 Alejandro Lopez-Bezanilla , P. Ganesh , Peter B. Littlewood

We investigate the evolution of magnetic properties as a function of hydrogen doping in iron based superconductor LaFeAsO$_{1-x}$H$_x$ using the dynamical mean-field theory combined with the density-functional theory. We find that two…

强关联电子 · 物理学 2017-01-04 Chang-Youn Moon , Hyowon Park , Kristjan Haule , Ji Hoon Shim

Using state-of-the-art first-principles calculations we have elucidated the complex magnetic and structural dependence of LaOFeAs upon doping. Our key findings are that (i) doping results in an orthorhombic ground state and (ii) there is a…

The effect of doping on the electronic structure at the Mn sites in the La_{1-x}Sr_{1+x}MnO_4 series (x=0, 0.3 and 0.5) was studied by means of non-resonant hard X- ray emission spectroscopy (XES). We observe a linear dichroism in the Mn…

The magnetism in the correlated metal CaRuO$_3$ is enigmatic as it is poised near a triple point among the ferromagnetic, antiferromagnetic, and paramagnetic ground states. Here we report a detailed work on structural, spectroscopic,…

强关联电子 · 物理学 2024-04-23 Pooja , Sachindra Nath Sarangi , D. Samal , Chanchal Sow

Spin-polarized band calculations for supercells of SrB$_{6}$, where a La-, In- or Al- impurity or a vacancy is replacing one Sr, are performed within the local spin density approximation. Moderately large cells with 8 formula units (56…

材料科学 · 物理学 2009-11-07 T. Jarlborg

Aliovalent doping of the two-dimensional dimer antiferromagnet SrCu$_2$(BO$_3$)$_2$ has long been proposed as a potential route toward realizing resonating valence bond (RVB) superconductivity in this system; however, experimental progress…

Some doped semiconductors have recently been shown to display superconductivity or weak ferromagnetism. Here we investigate the electronic structure and conditions for magnetism in a supercells of cubic XW_{26}O_{81}, where X=Nb,V and Re.…

材料科学 · 物理学 2016-08-31 T. Jarlborg

The nanoscopic magneto-electronic phase separation in doped La1-xSrxCoO3 perovskites was studied with local probes. The phase separation is directly observed by M\"ossbauer spectroscopy in the studied doping range of 0.05 <= x <= 0.25 both…

Recently, several experiments on La$_{2-x}$Sr$_x$CuO$_4$ (LSCO) challenged the Fermi liquid picture for overdoped cuprates, and stimulated intensive debates [1]. In this work, we study the magnetotransport phenomena in such systems based on…

超导电性 · 物理学 2021-07-08 Rui-Ying Mao , Da Wang , Congjun Wu , Qiang-Hua Wang

Epitaxial thin films of undoped LaCoO$_{3}$\@, of electron-doped La$_{0.7}$Ce$_{0.3}$CoO$_{3}$\@, and of hole-doped La$_{0.7}$Sr$_{0.3}$CoO$_{3}$\@ exhibit ferromagnetic order with a transition temperature $T_{\rm{C}}$ $\approx$ 85 K, 22 K,…

强关联电子 · 物理学 2013-06-19 M. Merz , P. Nagel , C. Pinta , A. Samartsev , H. v. Loehneysen , M. Wissinger , S. Uebe , A. Assmann , D. Fuchs , S. Schuppler

We report on structural, magnetic and electrical properties of Sr-doped LaMnO_3 single crystals for doping levels 0.4 < x < 0.85. The complex structural and magnetic phase diagram can only be explained assuming significant contributions…

Correlated band theory is employed to investigate the magnetic and electronic properties of different arrangements of oxygen di- and tri-vacancy clusters in SrTiO$_3$. Hole and electron doping of oxygen deficient SrTiO$_3$ yields various…

材料科学 · 物理学 2016-03-30 Alejandro Lopez-Bezanilla , P. Ganesh , Peter B. Littlewood

DyMn$_2$O$_5$ is an intriguing multiferroic material showing multiple magnetic, electric and structural transitions. We present here the systematic study on the effect of Sr doping at the Dy site of DyMn$_2$O$_5$ through magnetic and…

强关联电子 · 物理学 2020-04-22 P. Dutta , M. Das , S. Mukherjee , S. Chatterjee , S. Giri , S. Majumdar

In this work we revisit the phase diagram of Co-doped LaFeAsO using single crystals and thermodynamic methods. From magnetic susceptibility studies we track the doping evolution of the antiferromagnetic phase, revealing a continuous…

The electron-doping-driven collapse of the charge gap and staggered magnetization of the spin-orbit-assisted Mott insulator Sr$_{3}$Ir$_{2}$O$_{7}$ is explored via first-principles computational methods. In the antiferromagnetic phase, the…

强关联电子 · 物理学 2018-08-15 Michael W. Swift , Zach Porter , Stephen D. Wilson , Chris G. Van de Walle

The electronic structure of the magnetic semiconductor Ga$_{1-x}$Cr$_{x}$N and the effect of Si doping on it have been investigated by photoemission and soft x-ray absorption spectroscopy. We have confirmed that Cr in GaN is predominantly…

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