Thermoelectric power of Ba(Fe1−x Co x )2As2 (0 ≤ x ≤ 0.05) and Ba(Fe1−x Rh x )2As2 (0 ≤ x ≤ 0.171)

Temperature-dependent, in-plane, thermoelectric power data are presented for single crystals of Ba(Fe_1?x Co _x )₂As₂ (0?≤?x?≤?0.05) and Ba(Fe_1?x Rh _x )₂As₂ (0?≤?x?≤?0.171). Given that previous thermoelectric power and angle resolved photoemission spectroscopy studies of Ba(Fe_1?x Co _x )₂As₂ delineated a rather large Co-concentration range for Lifshitz transitions to occur, and the underdoped side of the phase diagram is poorly explored, new measurements of thermoelectric power on tightly spaced concentrations of Co, 0?≤?x?≤?0.05, were carried out. The data suggest evidence of a Lifshitz transition, but instead of a discontinuous jump in thermoelectric power in the range 0?≤?x?≤?0.05, a more gradual evolution in the S(T) plots as x is increased was observed. The thermoelectric power data of Ba(Fe_1?x Rh _x )₂As₂ show very similar behavior to that of Co substituted BaFe₂As₂. The previously outlined T–x phase diagrams for both systems are further confirmed by these thermoelectric power data.     

Al,F-doped new perovskite lithium fast ion conductor Li3x La2/3−x□1/3−2x Ti1−y Al y O3−y F y (x=0.11)

Al, F-doped new perovskite lithium ion conductors (x=0.11) have been prepared by solid state reaction. It is found that a pure perovskite-structured phase with space group of P4mm(99) exits in the composition range of 0<y≤0.10. The sample with y=0.02 possesses the highest ionic conductivity of 1.06×10⁻³ S/cm at room temperature, and its decomposing voltage is 2.3 V. The factors affecting the conductivity of this system are discussed.     

Preparation and characterization of Al and La co-doped (Ce1−x−y Al x LayO2-(x+y)/2) ceria

Effect of co-doping of lanthanum and aluminum on ionic conductivity of CeO₂ for its use as a solid electrolyte in intermediate temperature solid oxide fuel cells has been studied. A few compositions in the system Ce_1???x???y Al _x La_yO_{2???(x?+?y)/2} (CAL) with x?=?0.05, 0.025, and 0.00 and y?=?0.00, 0.025, and 0.05 such that x?+?y?=?0.05 are prepared by auto-combustion method. X-ray diffraction patterns show that all the synthesized samples are ceria-based solid solutions. Microstructures of thermally etched samples have been studied by scanning electron microscope. To determine the contribution of grains, σ _g and grain boundaries, σ _gb to the total conductivity, σ _t impedance is measured in the frequency range 1–1 MHz at different steady temperatures in the range 250–500 °C. It has been found that conductivity of the co-doped composition is more than singly doped with Al but less than singly doped lanthanum composition.     

Hyperfine magnetic interactions in Tb(Fe1 − x Al x )2 alloys

The structural and magnetic characteristics of phase transformations in Tb(Fe_{1 ? x} Al _x )₂ alloys with concentrations x = 0?0.9 have been measured in the temperature range from 90 to 450 K. The temperature dependences of the hyperfine magnetic fields for each of local configurations of the nearest environment of iron atoms upon substitution of aluminum atoms for iron atoms have been found using Mössbauer spectroscopy.     

Martensitic transformation in La1−x Yb x Ag1−y In y

The structural phase transformation of La_1–x Yb _x Ag_1–y In _y has been studied on single crystals by low temperature Laue-technique. The martensitic transformation in this pseudobinary intermetallic alloy has to be characterized as a weak orthorhtombic distortion of a single I centered unit cell (c/a1.04;a/b1.006) and a collective slipping or twinning of these cells that gives a fixed orientation between the remaining cubic room temperature structure and the martensitic phase. Above room temperature exists an order-disorder transformation from the CsCl-B2 structure to an at room temperature metastable W-A2 structure. There is no dramatic change in the physical properties of this alloy by substituting La by Yb, so we may approximate our results to LaAg_1–y In _y .This paper is dedicated to Prof. Dr. S. Methfessel on the occasion of his 60^th birthday     

ODMR Study of Zn1−x Mn x Se/Zn1−y Be y Se and (Cd1−x ,Mn)Te/Cd1−y Mg y Te Diluted Magnetic Semiconductor Quantum Wells

The effects of microwave pumping with a frequency of 60 GHz on the magneto-optical properties of diluted magnetic semiconductors (DMSs) are studied in (Zn,Mn)Se/(Zn,Be)Se and (Cd,Mn)Te/(Cd,Mg)Te quantum wells. Resonant heating of the Mn²⁺ ions in the electron spin resonance conditions leads to an increase in the Mn-spin temperature, which exceeds the bath temperature by up to 5.2 K, as detected by the shift of exciton emission line and decrease of its integral intensity. Nonresonant heating mediated by free carriers is also observed through variation of the polarization degree of emission. Direct measurements of spin–lattice relaxation times for both materials using time-resolved optically detected magnetic resonance (ODMR) technique have been performed. The mechanisms of ODMR in nanostructures of DMSs are discussed.     

Mössbauer Study of La1−x Ca x Mn1−y 57Fe y O3 with x=0,0.25; y=0.01

Temperature dependent Mössbauer measurements are done on the samples of La_1–x Ca _x Mn_1–y ⁵⁷Fe _y O₃ with x=0 and 0.25, and y=0.01. With decreasing temperature, the specimen with x=0.25 shows a paramagnetic to ferromagnetic transition around 175 K. In the specimen x=0.0, the temperature dependence of both the center shift () and the recoilless fraction (f) can be fitted very well with the Debye theory with a _D=320±50 K. But for the specimens with x=0.25, f and show distinct deviations from the Debye behavior in the temperature range in which the resistivity shows a sharp decrease. Dips observed in both the f and around the transition temperature suggest that the Jahn–Teller distortion observed in these systems is dynamic in nature.     

Single crystal growth and superconductivity of Ca(Fe1−x Co x )2As2

We report the single crystal growth of Ca(Fe_1?x Co _x )₂As₂ (0?≤?x?≤?0.082) from Sn flux. The temperature–composition phase diagram is mapped out based on the magnetic susceptibility and electrical transport measurements. The phase diagram of Ca(Fe_1?x Co _x )₂As₂ is qualitatively different from those of Sr and Ba; this could be due to both the charge doping and structural tuning effects associated with Co substitution.     

Morphology and magnetic properties of Fe x Co1−x /Co y Fe3−y O4 nanocomposites prepared by surfactants-assisted-hydrothermal process

Recently, we have demonstrated the successful synthesis of Fe _x Co_1−x /Co _y Fe_3−y O₄ nanocomposites with various alkaline solutions by using surfactants-assisted-hydrothermal (SAH) process. In this article, the synthesis of Fe _x Co_1−x /Co_yFe_3−y O₄ nanocomposites with their sizes varying between 20 nm and 2 μm was reported. X-ray powder diffraction (XRD) analyses showed that the surfactants, pH, precipitator, and temperature of the system play important roles in the nucleation and growth processes. The magnetic properties tested by vibrating sample magnetometer (VSM) at room temperature exhibit ferromagnetic behavior of the nanocomposites. These Fe _x Co_1−x /Co _y Fe_3−y O₄ nanocomposites may have a potential application as magnetic carriers for drug targeting because of their excellent soft-magnetic properties.     

Optical coefficients of Hg1 − x − y Cd x Eu y Se crystals

Optical properties of Hg_{1 ? x ? y} Cd _x Eu _y Se crystals grown by the Bridgman method have been investigated based on the independent reflectance and transmittance measurements, which were performed on a Nicolet 6700 spectrometer at T = 300 K in the wavelength range 0.9 ≤ λ ≤ 26.6 μm. The values of refractive index n, absorption index k, and absorption coefficient α have been determined for the crystals studied. Based on the dependences α = f(hν), the presence of direct allowed interband optical transitions in the crystals is established and the band-gap values are determined. The influence of temperature on the transmittance and band gap are investigated in the range T = 114–300 K.     

Calcium doping effects in57Fe : La2−x Ca x CuO4−y oxides

La_2–x Ca _x Cu_0.99Fe_0.01O_4–y samples with 0.00 x 0.30 were studied by X-ray diffraction and Mössbauer spectroscopy after heat treatment under different atmospheres (air, oxygen and helium). The variation of the relative population and the hyperfine interactions of the sites as well as the change in the lattice parameters were obtained.On leave from National Center for Scientific Research, PO Box 6990, Havana, Cuba.     

Local atomic arrangement in mechanosynthesized Co x Fe1−x−y Ni y alloys studied by Mössbauer spectroscopy

Mechanosynthesized Co _x Fe_1?x?y Ni _y alloys were examined using X-ray diffraction (XRD) and Mössbauer spectroscopy. In order to explain the shape of hyperfine magnetic field (HMF) distributions for the alloys, a local environment model based on a multinomial distribution was proposed. The model was in agreement with the XRD data and confirmed that the studied alloys were disordered solid solutions. It was successfully applied to describe the samples with bcc and fcc crystalline lattice type within the relatively broad range of components concentration. The results showed that the change of the crystalline lattice type does not cause an abrupt change of the HMF value. Moreover, a mean number of unpaired spins for the first coordination sphere may be used as a parameter to describe the HMF value experienced by ⁵⁷Fe nucleus. Finally, a set of the most probable atomic configurations and their corresponding contributions to the HMF distribution were obtained.     

237Np Mössbauer Investigations of (U1−x Np x )2Rh2Sn

Surprisingly, Np₂Rh₂Sn does not order magnetically whereas the uranium counterpart U₂Rh₂Sn orders antiferromagnetically at 24 K with a 5f moment μ _U ≈0.38μ _B . We have investigated the magnetic and electronic properties of (U_1−x Np _x )₂Rh₂Sn solid solutions. For x=0.25 and 0.5, the ordering temperature decreases to 11 K whereas the Np-rich compound (x=0.75) shows the onset of magnetic order around T≈6 K. The average Np magnetic moment amounts to 0.84 μ _B ,0.83μ _B and 0.25 μ _B respectively. The isomer shift slightly decreases, from −9.6 mm/s to −10.4 mm/s (versus NpAl₂) as x increases. The values of the quadrupole interaction parameter in the ordered and paramagnetic state suggest that Np moments are parallel to c for x=0.25 and then rotate to the basal plane for higher x. This revised version was published online in September 2006 with corrections to the Cover Date.     

LDA’+DMFT investigation of electronic structure of K1 − x Fe2 − y Se2 superconductor

We investigate electronic structure of the new iron chalcogenide high temperature superconductor K_1?x Fe_2?y Se₂ (hole doped case with x = 0.24, y = 0.28) in the normal phase using the novel LDA’+DMFT computational approach. We show that this iron chalcogenide is more correlated in a sense of bandwidth renormalization (energy scale compression by factor about 5 in the interval ±1.5 eV), than typical iron pnictides (compression factor about 2), though the Coulomb interaction strength is almost the same in both families. Our results for spectral densities are in general agreement with recent ARPES data on this system. It is found that all Fe-3d(t _2g ) bands crossing the Fermi level have equal renormalization, in contrast to some previous interpretations. Electronic states at the Fermi level are of predominantly xy symmetry. Also we show that LDA’+DMFT results are in better agreement with experimental spectral function maps, than the results of conventional LDA+DMFT. Finally we make predictions for photoemission spectra lineshape for K_0.76Fe_1.72Se₂.     

Magnetic phases in quasi-binary (Fe1−x Cox)Ge2 intermetallic compounds

Magnetic neutron diffractometry revealed the existence in (Fe_1−x Co_x)Ge₂ solid solutions (x<0.5) with C16 structure of only two magnetic phases, namely, low-temperature (AFI) and high-temperature (AFII). A third magnetic phase, AFIII, suggested by earlier magnetic measurements, has not been found. The AFI and AFII phases have a commensurate and an incommensurate antiferromagnetic structure with the wave vectors k ₀=2π/a (1,0,0) and k=k ₀+δ k, respectively. The regions of their existence are shown in the magnetic phase diagram. Neutron diffraction measurements yielded the concentration dependence of the average magnetic moment per atom in the antiferromagnetic sublattice of a 3d metal, which, similarly to the dependence of the Néel point on x, was found to be nonlinear. An analysis of these dependences suggests that substitution of cobalt for iron is accompanied, on the one hand, by a decrease of the local spin density on the iron atoms in the nearest environment of a cobalt atom and, on the other hand, by an increase of the effective exchange integral between the nearest-neighbor iron atoms located along the tetragonal axis. Fiz. Tverd. Tela (St. Petersburg) 41, 283–289 (February 1999)     

Incomplete magnetic ordering in Fe2(1−y)Mg1+y Ti y O4 spinels with intermediate compositiony

Static magnetization measurements on the ferrimagnetic spinels Fe_2(1?y)Mg_1+y Ti _y O₄ withy=0.3, 0.4, 0.5, and 0.6 show that these compounds have no well-defined orderdisorder transition temperature and that their ferrimagnetism may not be described in terms of the Néel theory. From the Mössbauer spectra we conclude that a temperature dependent number of the ferric ions does not participate in the ferrimagnetism of those compounds with compositiony≧0.4. The explanation of the observed magnetic and Mössbauer properties is based on the assumption that each ferric ion must have at least two magnetic linkages of the type Fe _A ³⁺ ?O^2??Fe _B ³⁺ in order to couple its magnetic moment to the neighbouring ones over the entire temperature interval between 0 K and the respective Néel temperature.     

Calculation of the electronic structure and hyperfine fields for Fe1 − x Co x B and (Fe1 − x Co x )2B compounds by the Korringa-Kohn-Rostoker method

The magnetic properties of Fe_{1 ? x} Co _x B and (Fe_{1 ? x} Co _x )₂B disordered compounds were investigated using first-principles calculations of the electronic structure in the framework of the density functional theory with the Korringa-Kohn-Rostoker method. The concentration dependences of the magnetic moments and the electron density were calculated for the Fe_{1 ? x} Co _x B solid solutions. The results obtained were used to analyze in detail and to interpret the transition from a magnetic phase to a nonmagnetic phase, which was previously revealed from the experiments in the compounds under investigation. The performed analysis of the calculated hyperfine fields induced by the electronic shells at the iron and cobalt atoms in the (Fe_{1 ? x} Co _x )₂B borides made it possible to explain the experimentally observed magnetic anisotropy.     

Electron paramagnetic resonance of Gd3+ ions in Ca1 − x − y Y x Gd y F2 + x + y crystals

Electron paramagnetic resonance of Ca_{1 ? x ? y} Y _x Gd _y F_{2 + x + y} single crystals has revealed spectra that are not typical of gadolinium-doped CaF₂ crystals. These spectra have a nearly tetragonal symmetry and are most probably caused by Gd³⁺ ions localized in yttrium clusters. Weak spectra of tetragonal Gd³⁺ centers, whose parameters are close to those of a cubic gadolinium center caused by an isolated Gd³⁺ ion, have been also detected. These centers are attributed to isolated Gd³⁺ ions localized near octahedral rare-earth clusters or their associations.     

Magnetic properties of (Mn1 − x Fe x )1.68Sn solid solutions

Solid solutions in the (Mn_{1 ? x} Fe _x )_1.68Sn system (x ≤ 0.5) with a Ni₂In-type structure are synthesized by the solid-phase reaction method in a stepwise temperature regime. The unit cell parameters a and c decrease with an increase in the iron concentration in the alloys and become equal to a = 0.430 nm and c = 0.538 nm for the (Mn_0.5Fe_0.5)_1.68Sn alloy. A superstructure with the unit cell parameters a _ss = 3a and c _ss = c is revealed in alloys of the system under investigation. The specific magnetization of the alloys increases nonlinearly from 53 G cm³ g^?1 in the Mn_1.68Sn alloy to 72 G cm³ g^?1 in the (Mn_0.5Fe_0.5)_1.68Sn solid solution. The Curie temperature changes from 270 K in the initial alloy of the composition Mn_1.68Sn to 365 K in the alloy of the composition (Mn_0.5Fe_0.5)_1.68Sn. All solid solutions in the (Mn_{1 ? x} Fe _x )_1.68Sn (x ≤ 0.5) system exhibit metallic conductivity in the temperature range from 77 to 450 K.     

Synthesis and characterization of (Bi2O3)1−x−y−z(Gd2O3)x (Sm2O3)y(Eu2O3)z quaternary solid solutions for solid oxide fuel cell

Sm₂O₃, Gd₂O₃, Eu₂O₃ triple-doped Bi₂O₃ based quaternary solid solutions were synthesized as a candidate electrolyte material using the solid-state reaction technique. The structural, thermal and electrical conductivity features of the ceramic samples were examined and compared by using X-ray powder diffraction (XRD), thermal gravimetry/differantial thermal analysis (TG/DTA) and the four-point probe technique (4PPT). The result of XRD measurements indicated that the (Bi₂O₃)_{(1−x−y−z)}(Gd₂O₃)_x(Sm₂O₃)_y(Eu₂O₃)_z (x = 10/y = 10/z = 5, 15, 20 mol % and x = 10/y = 5, 10, 15, 20/z = 10 mol %) samples have a stable face-centered cubic δ-phase and mixed phase crystallographic structure. The phase stability was also checked by the DTA evaluations results. The temperature dependent electrical conductivity measurements showed that the highest electrical conductivity was observed for the sample of the (Bi₂O₃)_0.75(Gd₂O₃)_0.10(Sm₂O₃)_0.05(Eu₂O₃)_0.10 system which has a stable and δ-phase was found as 6.67 × 10⁻³ (Ω cm)⁻¹ at 650 °C. This sample can be used as an electrolyte material in the solid oxide fuel cells (SOFCs) which is possible to operate at intermediate temperature ranges. The activation energy was also calculated at a low temperature range (350–650 °C) and high temperature range (above 650 °C). The values for the samples vary from 0.63 eV to 1.08 eV at low temperature and at high temperature they vary from 0.43 eV to 0.75 eV.