Properties of the Nearly Free Electron Superconductor Ag5Pb2O6 Inferred from Fermi Surface Measurements

We measured the Fermi surface of the recently discovered superconductor Ag5Pb2O6 via a de Haas-van Alphen rotation study. Two frequency branches were observed and identified with the neck and belly orbits of a very simple, nearly free electron Fermi surface. We use the observed Fermi surface geometry to quantitatively deduce superconducting properties such as the in-plane and out-of-plane penetration depths, the coherence length in the clean limit, and the critical field; as well as normal state properties such as the specific heat and the resistivity anisotropy.Comment: 2 pages, 1 figure, submitted to Physica C (M2S Proceedings

Electronic Structures of CaAlSi with Different Stacking AlSi Layers by First-Principles Calculations

The full-potential linear augmented plane-wave calculations have been applied to investigate the systematic change of electronic structures in CaAlSi due to different stacking sequences of AlSi layers. The present ab-initio calculations have revealed that the multistacking, buckling and 60 degrees rotation of AlSi layer affect the electronic band structure in this system. In particular, such a structural perturbation gives rise to the disconnected and cylindrical Fermi surface along the M-L lines of the hexagonal Brillouin zone. This means that multistacked CaAlSi with the buckling AlSi layers increases degree of two-dimensional electronic characters, and it gives us qualitative understanding for the quite different upper critical field anisotropy between specimens with and without superstructure as reported previously.Comment: 4 pages, 4 figures, to be published in J. Phys. Soc. Jp

Electronic band structure, Fermi surface, and elastic properties of new 4.2K superconductor SrPtAs from first-principles calculations

The hexagonal phase SrPtAs (s.g. P6/mmm; #194) with a honeycomb lattice structure very recently was declared as a new low-temperature (TC ~ 4.2K) superconductor. Here by means of first-principles calculations the optimized structural parameters, electronic bands, Fermi surface, total and partial densities of states, inter-atomic bonding picture, independent elastic constants, bulk and shear moduli for SrPtAs were obtained for the first time and analyzed in comparison with the related layered superconductor SrPt2As2.Comment: 8 pages, 4 figure

Contrasting Pressure Effects in Sr2VFeAsO3 and Sr2ScFePO3

We report the resistivity measurements under pressure of two Fe-based superconductors with a thick perovskite oxide layer, Sr2VFeAsO3 and Sr2ScFePO3. The superconducting transition temperature Tc of Sr2VFeAsO3 markedly increases with increasing pressure. Its onset value, which was Tc{onset}=36.4 K at ambient pressure, increases to Tc{onset}=46.0 K at ~4 GPa, ensuring the potential of the "21113" system as a high-Tc material. However, the superconductivity of Sr2ScFePO3 is strongly suppressed under pressure. The Tc{onset} of ~16 K decreases to ~5 K at ~4 GPa, and the zero-resistance state is almost lost. We discuss the factor that induces this contrasting pressure effect.Comment: 5 pages, 4 figures, to be published in J. Phys. Soc. Jpn. No.12 (2009

Anatomy of the band structure of the newest apparent near-ambient superconductor LuH3−x_{3-x}Nx_x

Recently it was claimed that nitrogen-doped lutetium hydride exhibited a near-ambient superconducting transition with a temperature of 294 K at a pressure of only 10 kbar, this pressure being several orders of magnitude lower than previously demonstrated for hydrides under pressure. In this paper, we investigate within DFT+U the electronic structure of both parent lutetium hydride LuH$_3$ and nitrogen doped lutetium hydride LuH$_{2.75}$N$_{0.25}$. We calculated corresponding bands, density of states and Fermi surfaces. It is shown that in the stoichiometric system the Lu-5d states cross the Fermi level while the H-1s states make almost no contribution at the Fermi level. However, with nitrogen doping, the N-2p states enter the Fermi level in large quantities and bring together a significant contribution from the H-1s states. The presence of N-2p and H-1s states at the Fermi level in a doped compound can facilitate the emergence of superconductivity. For instance, nitrogen doping almost doubles the value of DOS at the Fermi level. Simple BCS analysis shows that the nitrogen doping of LuH$_3$ can provide T$_c$ more than 100K and even increase it with further hole doping.Comment: 7 pages, 5 figure

Full Relativistic Electronic Structure and Fermi Surface Sheets of the First Honeycomb-Lattice Pnictide Superconductor SrPtAs

We report full-potential density functional theory (DFT)-based {\it ab initio} band structure calculations to investigate electronic structure properties of the first pnictide superconductor with a honeycomb-lattice structure: SrPtAs. As a result, electronic bands, density of states, Fermi velocities and the topology of the Fermi surface for SrPtAs are obtained. These quantities are discussed in comparison to the first available experimental data. Predictions for future measurements are provided

Magnetic Ordering in V-Layers of the Superconducting System of Sr2VFeAsO3

Results of transport, magnetic, thermal, and 75As-NMR measurements are presented for superconducting Sr2VFeAsO3 with an alternating stack of FeAs and perovskite-like block layers. Although apparent anomalies in magnetic and thermal properties have been observed at ~150 K, no anomaly in transport behaviors has been observed at around the same temperature. These results indicate that V ions in the Sr2VO3-block layers have localized magnetic moments and that V-electrons do not contribute to the Fermi surface. The electronic characteristics of Sr2VFeAsO3 are considered to be common to those of other superconducting systems with Fe-pnictogen layers.Comment: 4 pages, 4 figures, To appear in JPSJ 79 (2010) 12371

Band structure of new superconducting AlB_2-like ternary silicides M(Al_{0.5}Si_{0.5})_2 and M(Ga_{0.5}Si_{0.5})_2 (M= Ca, Sr and Ba)

The electronic band structures of the new superconducting (with T_c up to 7.7K) ternary silicides M(A_{0.5}Si_{0.5})_2 (M= Ca, Sr, Ba; A= Al, Ga) in the AlB_2-type structure have been investigated using the full-potential LMTO method. The calculations showed that the trend in transition temperatures doesn't follow the changes in the density d-states at the Fermi level and probably is associated with phonon-mode frequencies.Comment: 7 pagers, 1 table, 7 figure

Electron transport, penetration depth and upper critical magnetic field of ZrB12 and MgB2

We report on the synthesis and measurements of the temperature dependence of resistivity, R(T), the penetration depth, l(T), and upper critical magnetic field, Hc2(T), for polycrystalline samples of dodecaboride ZrB12 and diboride MgB2. We conclude that ZrB12 as well as MgB2 behave like simple metals in the normal state with usual Bloch-Gruneisen temperature dependence of resistivity and with rather low resistive Debye temperature, TR=280 K, for ZrB12 (as compared to MgB2 with TR=900 K). The R(T) and l(T) dependencies of ZrB12 reveal a superconducting transition at Tc=6.0 K. Although a clear exponential l(T)dependence in MgB2 thin films and ceramic pellets was observed at low temperatures, this dependence was almost linear for ZrB12 below Tc/2. These features indicate s-wave pairing state in MgB2, whereas a d-wave pairing state is possible in ZrB12. A fit to the data gives a reduced energy gap 2D(0)/kTc=1.6 for MgB2 films and pellets, in good agreement with published data for 3D \pi - sheets of the Fermi surface. Contrary to conventional theories we found a linear temperature dependence of Hc2(T) for ZrB12 (Hc2(0)=0.15 T).Comment: 8 pages, 10 figures, submitted to JET

The mechanical relaxation study of polycrystalline MgCNi3

The mechanical relaxation spectra of a superconducting and a non-superconducting MgCNi3 samples were measured from liquid nitrogen temperature to room temperature at frequency of kilohertz. There are two internal friction peaks (at 300 K labeled as P1 and 125 K as P2) for the superconducting sample. For the non-superconducting one, the position of P1 shifts to 250 K, while P2 is almost completely depressed. It is found that the peak position of P2 shifts towards higher temperature under higher measuring frequency. The calculated activation energy is 0.13eV. We propose an explanation relating P2 to the carbon atom jumping among the off-center positions. And further we expect that the behaviors of carbon atoms maybe correspond to the normal state crossovers around 150 K and 50 K observed by many other experiments.Comment: 4 figure