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Periodic and cluster density-functional theory (DFT) calculations, including DFT+U and hybrid functionals, are applied to study magnetostructural correlations in spin-1/2 frustrated chain compounds CuX2: CuCl2, CuBr2, and a fictitious chain…

Strongly Correlated Electrons · Physics 2013-07-02 S. Lebernegg , M. Schmitt , A. A. Tsirlin , O. Janson , H. Rosner

Bi-based cuprate superconductors are important materials for both fundamental research and applications. As in other cuprates, the superconducting phase in the Bi compounds lies close to an antiferromagnetic phase. Our density functional…

Superconductivity · Physics 2020-07-07 J. Nokelainen , C. Lane , R. S. Markiewicz , B. Barbiellini , A. Pulkkinen , B. Singh , J. Sun , K. Pussi , A. Bansil

We have performed a symmetry analysis of the properties of the recently discovered quasi-one-dimensional compound BaCu_2Si_2O_7. The existence of the unusual spin-reorientation transitions is explained as an effect of the unusually strong…

Strongly Correlated Electrons · Physics 2009-11-07 Vasiliy N. Glazkov , H. -A. Krug von Nidda

Neutron scattering experiments reveal that a diagonal spin modulation, which is a one-dimensional modulation rotated away by 45$^\circ$ from that in the superconducting phase, occurs universally across the insulating spin-glass phase in…

Superconductivity · Physics 2009-10-31 M. Matsuda , M. Fujita , K. Yamada , R. J. Birgeneau , M. A. Kastner , H. Hiraka , Y. Endoh , S. Wakimoto , G. Shirane

The magnetic behaviour of the low-dimensional Vanadium-oxides Sr2V3O9 and Ba2V3O9 was investigated by means of magnetic susceptibility and specific heat measurements. In both compounds, the results can be very well described by an S=1/2…

Condensed Matter · Physics 2009-11-07 E. E. Kaul , H. Rosner , V. Yushankhai , J. Sichelschmidt , R. V. Shpanchenko , C. Geibel

An effective Hamiltonian is constructed for an insulating cuprate with edge-sharing chains Li2CuO2.The Hamiltonian contains the nearest and next-nearest neighboring intrachain and zigzag-type interchain interactions.The values of the…

Condensed Matter · Physics 2009-10-31 Y. Mizuno , T. Tohyama , S. Maekawa

We present a microscopic model of the spin-gap quantum magnet (CuCl)LaNb2O7 that was previously suggested as a realization of the spin-1/2 frustrated square lattice. Taking advantage of the precise atomic positions from recent crystal…

Strongly Correlated Electrons · Physics 2010-08-30 Alexander A. Tsirlin , Helge Rosner

The atomic and magnetic structures of (Cu$X$)LaNb$_2$O$_7$ ($X$=Cl and Br) are investigated using the density-functional calculations. Among several dozens of examined structures, an orthorhombic distorted $2\times 2$ structure, in which…

Strongly Correlated Electrons · Physics 2015-05-14 Chung-Yuan Ren , Ching Cheng

The superconductive and magnetic properties of charge$-$compensated (Ca$_x$La$_{1-x}$)(Ba$_{1.75-x}$La$_{0.25+x}$)Cu$_3$O$_y$ (normally denoted as CLBLCO) are considered through quantitative examination of data for electrical resistivity,…

Superconductivity · Physics 2012-11-07 Dale R. Harshman , Anthony T. Fiory

We study theoretically the ultrafast spin dynamics of II-VI diluted magnetic semiconductors in the presence of spin-orbit interaction. Our goal is to explore the interplay or competition between the exchange $sd$-coupling and the spin-orbit…

Mesoscale and Nanoscale Physics · Physics 2015-05-14 Florian Ungar , Moritz Cygorek , Pablo I. Tamborenea , Vollrath Martin Axt

We demonstrate the occurrence of compensated spin configurations in Fe clusters and monolayers on Ru(0001) and Rh(111) by a combination of X-ray magnetic circular dichroism experiments and first-principles calculations. Our results reveal…

Materials Science · Physics 2014-03-18 V. Sessi , F. Otte , S. Krotzky , C. Tieg , M. Wasniowska , P. Ferriani , S. Heinze , J. Honolka , K. Kern

Light transition metals have recently emerged as a sustainable material class for efficient spin-charge interconversion. We report measurements of current-induced spin-orbit torques generated by Ni$_{1-x}$Cu$_{x}$ alloys in perpendicularly…

We investigate the magnetic properties of the multiferroic quantum-spin system LiCu$_2$O$_2$ by electron spin resonance (ESR) measurements at $X$- and $Q$-band frequencies in a wide temperature range $(T_{\rm N1} \leq T \leq 300$\,K). The…

We report the signatures of dynamic spin fluctuations in the layered honeycomb Li$_3$Cu$_2$SbO$_6$ compound, with a 3$d$ S = 1/2 $d^9$ Cu$^{2+}$ configuration, through muon spin rotation and relaxation ($\mu$SR) and neutron scattering…

We synthesized single crystals of composition Ba$_2$CuSi$_2$O$_6$Cl$_2$ and investigated its quantum magnetic properties. The crystal structure is closely related to that of the quasi-two-dimensional (2D) dimerized magnet BaCuSi$_2$O$_6$…

This paper describes high-energy neutron inelastic scattering measurements of propagating magnetic excitations in PrBa2Cu3O6+x (x approx 0.2 and 0.93). The measurements probe the acoustic and optic modes of the antiferromagnetically-ordered…

Strongly Correlated Electrons · Physics 2009-11-11 A. T. Boothroyd , N. H. Andersen , B. H. Larsen , A. A. Zhokhov , C. D. Frost , D. T. Adroja

The impurities of exchange couplings, external magnetic fields and Dzyaloshinskii--Moriya (DM) interaction considered as Gaussian distribution, the entanglement in one-dimensional random $XY$ spin systems is investigated by the method of…

Quantum Physics · Physics 2009-11-13 C. J. Shan , W. W. Cheng , T. K. Liu , Y. X. Huang , H. Li

Here we report a study of the spin dynamics in the ferromagnetic chain compound $Li_{2}CuO_{2}$. Inelastic neutron scattering measurements allow for the spin Hamiltonian to be determined using a $J_{1}-J_{2}$ $XXZ$-Heisenberg spin chain…

Strongly Correlated Electrons · Physics 2023-08-10 Eli Zoghlin , Matthew B. Stone , Stephen D. Wilson

The dispersion of the low-energy magnetic excitations of the Pr sublattice in PrBa2Cu3O6.2 is determined by inelastic neutron scattering measurements on a single crystal. The dispersion, which shows the effect of interactions with the Cu…

The mechanism for the ferromagnetic order of (Ga,Mn)As and (Ga,Mn)N is extensively studied over a vast range of Mn concentrations. We calculate the electronic structures of these materials using density functional theory in both the local…

Materials Science · Physics 2009-11-10 Malgorzata Wierzbowska , Daniel Sanchez-Portal , Stefano Sanvito
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