We present a study of the anisotropic transport properties ͑electrical resistivity, thermoelectric power, Hall coefficient, and thermal conductivity͒ of a single-crystalline Al 80 Cr 15 Fe 5 complex metallic alloy that is an excellent approximant to the decagonal quasicrystal with six atomic layers in one periodic unit. Temperaturedependent electrical resistivity along the b and c crystalline directions shows a nonmetallic behavior with a broad maximum, whereas it shows a metallic positive temperature coefficient along the a direction perpendicular to the ͑b , c͒ atomic planes. Ab initio calculations of the electronic density of states reveal that the nonmetallic transport occurs in the presence of a high density of charge carriers. The very different temperature-dependent electrical resistivities along the three crystalline directions can all be treated within the same physical model of slow charge carriers due to weak dispersion of the electronic bands, where the increased electron-phonon scattering upon raising the temperature induces transition from dominant Boltzmann ͑metallic͒ to dominant non-Boltzmann ͑insulatinglike͒ regime. The temperature dependence of the resistivity is governed predominantly by the temperature dependence of the electronic diffusion constant D and the transition has no resemblance to the Anderson-type metal-to-insulator transition based on the gradual electron localization. Structural considerations of the Al 80 Cr 15 Fe 5 phase show that the anisotropy of the transport properties is a consequence of anisotropic atomic order on the scale of nearest-neighbor atoms, suggesting that the role of quasiperiodicity in the anisotropic transport of decagonal quasicrystals is marginal. We also present a relaxed version of the Al 4 ͑Cr, Fe͒ structural model by Deng et al.
The PdGa intermetallic compound is a highly selective and stable heterogeneous hydrogenation catalyst for the semi-hydrogenation of acetylene. We have studied single crystals of PdGa grown by the Czochralski technique. The (69)Ga electric-field-gradient (EFG) tensor was determined by means of NMR spectroscopy, giving experimental confirmation of both the recently refined structural model of PdGa and the theoretically predicted Pd-Ga covalent bonding scheme. The hydrogenation experiment has detected no hydrogen uptake in the PdGa, thus preventing in situ hydride formation that leads to a reduction of the catalytic selectivity. We have also determined bulk physical properties (the magnetic susceptibility, the electrical resistivity, the thermoelectric power, the Hall coefficient, the thermal conductivity and the specific heat) of single-crystalline PdGa. The results show that PdGa is a diamagnet with metallic electrical resistivity and moderately high thermal conductivity. The thermoelectric power is negative with complicated temperature dependence, whereas the Hall coefficient is positive and temperature-dependent, indicating complexity of the Fermi surface. Partial fulfillment of the NMR Korringa relation reveals that the charge carriers are weakly correlated. Specific heat measurements show that the density of electronic states (DOS) at the Fermi energy of PdGa is reduced to 15% of the DOS of the elemental Pd metal.
We have investigated anisotropic physical properties ͑magnetic susceptibility, electrical resistivity, thermoelectric power, Hall coefficient, and thermal conductivity͒ of the o-Al 13 Co 4 , an orthorhombic approximant to the decagonal phase. The crystallographic-direction-dependent measurements were performed along the a, b, and c directions of the orthorhombic unit cell, where ͑b , c͒ atomic planes are stacked along the perpendicular a direction. Magnetic susceptibility is predominantly determined by the Pauli-spin paramagnetism of conduction electrons. The in-plane magnetism is stronger than that along the stacking a direction. Anisotropic electrical and thermal conductivities are the highest along the stacking a direction. The anisotropic thermoelectric power changes sign with the crystallographic direction and so does the anisotropic Hall coefficient which changes from negative electronlike to positive holelike for different combinations of the electric current and magnetic-field directions. The investigated anisotropic electrical and thermal transport coefficients were reproduced theoretically by ab initio calculation using Boltzmann transport theory and the calculated anisotropic Fermi surface. The calculations were performed for two structural models of the o-Al 13 Co 4 phase, where the more recent model gave better agreement, though still qualitative only, to the experiments.
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