With the motive of unraveling the origin of native vacancy induced magnetization in ferroelectric perovskite oxide systems, here we explore the consequences of electronic structure modification in magnetic ordering of oxygen deficient epitaxial BaTiO 3−δ thin films. Our adapted methodology employs state-of-the-art experimental approaches viz. photoemission, photo-absorption spectroscopies, magnetometric measurements duly combined with first principles based theoretical methods within the frame work of density functional theory (DFT and DFT+U) calculations. Oxygen vacancy (O V ) is observed leading partial population of Ti 3d (t 2g ), which induces defect state in electronic structure near the Fermi level and reduces the band gap. The oxygen deficient BaTiO 2.75 film reveals Mott-Hubbard insulator characteristic, in contrast to the band gap insulating nature of the stoichiometric BaTiO 3 . The observed magnetic ordering is attributed to the asymmetric distribution of spin polarized charge density in the vicinity of O V site, which originates unequal magnetic moment values at first and second nearest neighboring Ti sites, respectively. Hereby, we present an exclusive method for maneuvering the band gap and on-site electron correlation energy with consequences on magnetic properties of BaTiO 3−δ system, which can open a gateway for designing novel single phase multiferroic system.
SmCrO3 undergoes a discontinuous Morin type spin reorientation process due to discrete flipping of Cr3+ ions from the high temperature Γ4 to low temperature Γ1 configuration.
We study the effect of impurities on the two types of spin-dimers in the hybrid chain-ladder spin 1/2 quantum magnet Sr 14 Cu 24 O 41 . Four different impurities were used, namely, the non-magnetic Zn (0.0025 and 0.01 per Cu) and Al (0.0025 and 0.01 per Cu), and magnetic Ni (0.0025 and 0.01 per Cu) and Co (0.01, 0.03, 0.05 and 0.1 per Cu). These impurities were doped in high-quality single-crystals synthesized by the floating-zone method. The magnetic susceptibility of pristine Sr 14 Cu 24 O 41 is analyzed rigorously to confirm that at low temperatures (T < 5 K), the 'free' spins in the chains undergo a long-distance dimerization as proposed in a recent study (Sahling et al 2015 Nat. Phys. 11 255). The effect of impurity on these dimers is analyzed by measuring the specific heat down to T = 0.06 K. We found that even at the lower impurity concentration, the long-distance dimers are significantly severed but the quantum entangled spin dimerized state of the chains persists. On the other hand, the other type of spin dimers that form at relatively higher temperatures via an intervening Zhang-Rice singlet are found to be practically unaffected at the lower impurity concentration; but at 1% doping these dimers are considerably severed. The effect of Co impurity turned out to be most unusual displaying a strongly anisotropic response, and with a dimerization gap that suppresses faster along the chain/ladder direction than perpendicular to it as a function of increasing Co concentration.
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