New high-pressure phase and equation of state of Ce2Zr2O8

In this paper we report a new high-pressure rhombohedral phase of Ce2Zr2O8 observed from high-pressure angle-dispersive x-ray diffraction and Raman spectroscopy studies up to nearly 12 GPa. The ambient-pressure cubic phase of Ce2Zr2O8 transforms to a rhombohedral structure beyond 5 GPa with a feeble distortion in the lattice. Pressure evolution of unit-cell volume showed a change in compressibility above 5 GPa. The unit-cell parameters of the high-pressure rhombohedral phase at 12.1 GPa are ah = 14.6791(3) {\AA}, ch = 17.9421(5) {\AA}, V = 3348.1(1) {\AA}3. The structure relation between the parent cubic (P2_13) and rhombohedral (P3_2) phases were obtained by group-subgroup relations. All the Raman modes of the cubic phase showed linear evolution with pressure with the hardest one at 197 cm-1. Some Raman modes of the high-pressure phase have a non-linear evolution with pressure and softening of one low-frequency mode with pressure is found. The compressibility, equation of state, and pressure coefficients of Raman modes of Ce2Zr2O8 are also reported.Comment: 33 pages, 8 figures, 6 table

Properties of the ferrimagnetic double-perovskite A_{2}FeReO_{6} (A=Ba and Ca)

Ceramics of A_{2}FeReO_{6} double-perovskite have been prepared and studied for A=Ba and Ca. Ba_{2}FeReO_{6} has a cubic structure (Fm3m) with $a\approx$8.0854(1) \AA whereas Ca_{2}FeReO_{6} has a distorted monoclinic symmetry with $a\approx 5.396(1) \AA, b\approx 5.522(1) \AA, c\approx 7.688(2) \AA$ and $\beta =90.4^{\circ} (P21/n)$. The barium compound is metallic from 5 K to 385 K, i.e. no metal-insulator transition has been seen up to 385 K, and the calcium compound is semiconducting from 5 K to 385 K. Magnetization measurements show a ferrimagnetic behavior for both materials, with T_{c}=315 K for Ba_{2}FeReO_{6} and above 385 K for Ca_{2}FeReO_{6}. A specific heat measurement on the barium compound gave an electron density of states at the Fermi level, N(E_{F}) equal to 6.1$\times 10^{24} eV^{-1}mole^{-1}$. At 5 K, we observed a negative magnetoresistance of 10 % in a magnetic field of 5 T, but only for Ba_{2}FeReO_{6}. Electrical, thermal and magnetic properties are discussed and compared to the analogous compounds Sr_{2}Fe(Mo,Re)O_{6}.Comment: 5 pages REVTeX, 7 figures included, submitted to PR

Structures and Design Phase I Summary for the NASA Composite Cryotank Technology Demonstration Project

A description of the Phase I structures and design work of the Composite Cryotank Technology Demonstration (CCTD) Project is in this paper. The goal of the CCTD Project in the Game Changing Development (GCD) Program is to design and build a composite liquid-hydrogen cryogenic tank that can save 30% in weight and 25% in cost compared to state-of-the-art aluminum metallic cryogenic tank technology when the wetted composite skin wall is at an allowable strain of 5000 in/in. Three Industry teams developed composite cryogenic tank concepts that are compared for weight to an aluminum-lithium (Al-Li) cryogenic tank designed by NASA in Phase I of the CCTD Project. The requirements used to design all of the cryogenic tanks in Phase I will be discussed and the resulting designs, analyses, and weight of the concepts developed by NASA and Industry will be reviewed and compared

Structural Design and Sizing of a Metallic Cryotank Concept

This paper presents the structural design and sizing details of a 33-foot (10 m) metallic cryotank concept used as the reference design to compare with the composite cryotank concepts developed by industry as part of NASA s Composite Cryotank Technology Development (CCTD) Project. The structural design methodology and analysis results for the metallic cryotank concept are reported in the paper. The paper describes the details of the metallic cryotank sizing assumptions for the baseline and reference tank designs. In particular, the paper discusses the details of the cryotank weld land design and analyses performed to obtain a reduced weight metallic cryotank design using current materials and manufacturing techniques. The paper also discusses advanced manufacturing techniques to spin-form the cryotank domes and compares the potential mass savings to current friction stir-welded technology

Metallic and nonmetallic double perovskites: A case study of A2_2FeReO6_6 (A= Ca, Sr, Ba)

We have investigated the structure and electronic properties of ferrimagnetic double perovskites, A2FeReO6 (A= Ca, Sr, Ba). The A=Ba phase is cubic (Fm3m) and metallic, while the A=Ca phase is monoclinic (P21/n) and nonmetallic. 57Fe Mossbauer spectroscopy shows that iron is present mainly in the high-spin (S=5/2) Fe3+ state in the Ca compound, while it occurs in an intermediate state between high-spin Fe2+ and Fe3+ in the Ba compound. It is argued that a direct Re t2g - Re t2g interaction is the main cause for the metallic character of the Ba compound; the high covalency of Ca-O bonds and the monoclinic distortion (which lifts the degeneracy of t2g states) seem to disrupt the Re-Re interaction in the case of the Ca compound, making it non-metallic for the same electron count.Comment: 1 eps fil

Theory of Transition Temperature of Magnetic Double Perovskites

We formulate a theory of double perovskite coumpounds such as Sr$_2$FeReO$_6$ and Sr$_2$FeMoO$_6$ which have attracted recent attention for their possible uses as spin valves and sources of spin polarized electrons. We solve the theory in the dynamical mean field approximation to find the magnetic transition temperature $T_c$. We find that $T_c$ is determined by a subtle interplay between carrier density and the Fe-Mo/Re site energy difference, and that the non-Fe same-sublattice hopping acts to reduce $T_c$. Our results suggest that presently existing materials do not optimize $T_c$

Superconducting to spin glass state transformation in {\ss}-pyrochlore KxOs2O6

{\ss}-pyrochore KOs2O6, which shows superconductivity below ~ 9.7K, has been converted into KxOs2O6 (x < 2/3 - 1/2) electrochemically to show spin glass-like behavior below ~ 6.1K. Room temperature sample surface potential versus charge transfer scan indicates that there are at least two two-phase regions for x between 1 and 0.5. Rattling model of superconductivity for the title compound has been examined using electrochemical potassium de-intercalation. The significant reduction of superconducting volume fraction due to minor potassium reduction suggests the importance of defect and phase coherence in the rattling model. Magnetic susceptibility, resistivity, and specific heat measurement results have been compared between the superconducting and spin glass-like samples.Comment: 8 pages, 7 figures, 1 tabl

Anomalous magnetic phase in an undistorted pyrochlore oxide Cd2Os2O7 induced by geometrical frustration

We report on the muon spin rotation/relaxation study of a pyrochlore oxide, Cd2Os2O7, which exhibits a metal-insulator (MI) transition at T_{MI}~225 K without structural phase transition. It reveals strong spin fluctuation (>10^8/s) below the MI transition, suggesting a predominant role of geometrical spin frustration amongst Os^{5+} ions. Meanwhile, upon further cooling, a static spin density wave discontinuously develops below T_{SDW}~150 K. These observations strongly suggest the occurrence of an anomalous magnetic transition and associated change in the local spin dynamics in undistorted pyrochlore antiferromagnet.Comment: 5 pages, 4 figure

Solid Solution Studies of Layered Honeycomb-Ordered Phases O3-Na3M2SbO6 (M = Cu, Mg, Ni, Zn)

Complete solid solutions with the composition Na₃M₂₋ₓM’ₓSbO₆ where M, M’ = Cu, Mg, Ni, Zn have been synthesized by conventional solid state techniques and were investigated using X-ray diffraction, magnetism and optical measurements. All compositions crystallize in a monoclinic unit cell and exhibit a layered structure with a honeycomb cationic ordering within the slabs. These compounds also exhibit Curie-Weiss behavior at high temperatures and the magnetic moment values verify the presence of Cu²⁺ and/or Ni²⁺. The antiferromagnetic order of Na₃Ni₂SbO₆ is suppressed upon substitution of Ni²⁺ with Mg²⁺ or Zn²⁺. The spin gap observed in Na₃Cu₂SbO₆ is also suppressed by substitution of Cu²⁺ with Mg²⁺ or Zn²⁺. The Na₃Ni₂₋ₓCuₓSbO₆ compositions follow an expected transition from an antiferromagnetic ordering to the spin gap of the copper end member. The estimated band gaps for these compounds have been estimated from diffuse reflectance measurements.Keywords: Spin-gap behavior, Layered compound, Solid solution, X-ray diffraction, Honeycomb orderin

Dynamical Mean Field Theory of Double Perovskite Ferrimagnets

The dynamical mean field method is used to analyze the magnetic transition temperature and optical conductivity of a model for the ferrimagnetic double perovskites such as $Sr_2FeMoO_6$. The calculated transition temperatures and optical conductivities are found to depend sensitively on the band structure. For parameters consistent with local spin density approximation band calculations, the computed transition temperatures are lower than observed, and in particular decrease dramatically as band filling is increased, in contradiction to experiment. Band parameters which would increase the transition temperature are identified.Comment: Supercedes cond-mat/000628 (PRB64 024424/1-4 (2001