Effects of metallic spacer in layered superconducting Sr2(MgTi)O3FeAs
arXiv:1208.2774 · doi:10.1007/s10948-012-2066-3
Abstract
The highly two-dimensional superconducting system Sr2(MgTi)O3FeAs, recently synthesized in the range of 0.2 < y < 0.5, shows an Mg concentration-dependent . Reducing the Mg concentration from y=0.5 leads to a sudden increase in , with a maximum ~40 K at y=0.2. Using first principles calculations, the unsynthesized stoichiometric y=0 and the substoichiometric y=0.5 compounds have been investigated. For the 50% Mg-doped phase (y=0.5), Sr2(MgTi)O3 layers are completely insulating spacers between FeAs layers, leading to the fermiology such as that found for other Fe pnictides. At y=0, representing a phase with metallic Sr2TiO3 layers, the -centered Fe-derived Fermi surfaces (FSs) considerably shrink or disappear. Instead, three -centered Ti FSs appear, and in particular two of them have similar size, like in MgB2. Interestingly, FSs have very low Fermi velocity in large fractions: the lowest being 0.6 cm/s. Furthermore, our fixed spin moment calculations suggest the possibility of magnetic ordering, with magnetic Ti and nearly nonmagnetic Fe ions. These results indicate a crucial role of Sr2(MgTi)O3 layers in this superconductivity.
7 pages; Proceedings of ICSM-2012
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