594 research outputs found
New Candidates for Topological Insulators : Pb-based chalcogenide series
Here, we theoretically predict that the series of Pb-based layered
chalcogenides, PbBiSe and PbSbTe, are possible
new candidates for topological insulators. As increases, the phase
transition from a topological insulator to a band insulator is found to occur
between and 3 for both series. Significantly, among the new topological
insulators, we found a bulk band gap of 0.40eV in PbBiSe which is one
of the largest gap topological insulators, and that PbSbTe is
located in the immediate vicinity of the topological phase boundary, making its
topological phase easily tunable by changing external parameters such as
lattice constants. Due to the three-dimensional Dirac cone at the phase
boundary, massless Dirac fermions also may be easily accessible in
PbSbTe
Phase relations in K_xFe_{2-y}Se_2 and the structure of superconducting K_xFe_2Se_2 via high-resolution synchrotron diffraction
Superconductivity in iron selenides has experienced a rapid growth, but not
without major inconsistencies in the reported properties. For
alkali-intercalated iron selenides, even the structure of the superconducting
phase is a subject of debate, in part because the onset of superconductivity is
affected much more delicately by stoichiometry and preparation than in cuprate
or pnictide superconductors. If high-quality, pure, superconducting
intercalated iron selenides are ever to be made, the intertwined physics and
chemistry must be explained by systematic studies of how these materials form
and by and identifying the many coexisting phases. To that end, we prepared
pure K_2Fe_4Se_5 powder and superconductors in the K_xFe_{2-y}Se_2 system, and
examined differences in their structures by high-resolution synchrotron and
single-crystal x-ray diffraction. We found four distinct phases: semiconducting
K_2Fe_4Se_5, a metallic superconducting phase K_xFe_2Se_2 with x ranging from
0.38 to 0.58, an insulator KFe_{1.6}Se_2 with no vacancy ordering, and an
oxidized phase K_{0.51(5)}Fe_{0.70(2)}Se that forms the PbClF structure upon
exposure to moisture. We find that the vacancy-ordered phase K_2Fe_4Se_5 does
not become superconducting by doping, but the distinct iron-rich minority phase
K_xFe_2Se_2 precipitates from single crystals upon cooling from above the
vacancy ordering temperature. This coexistence of metallic and semiconducting
phases explains a broad maximum in resistivity around 100 K. Further studies to
understand the solubility of excess Fe in the K_xFe_{2-y}Se_2 structure will
shed light on the maximum fraction of superconducting K_xFe_2Se_2 that can be
obtained by solid state synthesis.Comment: 12 pages, 16 figures, supplemental materia
- …