Magnetic properties of R2Fe17−xGax (R=Y and Gd) compounds

The magnetic properties of Y₂Fe_17−xGa_x for 3≤x≤7 and Gd₂Fe_17−xGa_x for 5≤x≤7 have been investigated using ⁵⁷Fe Mössbauer spectroscopy. These compounds have the rhombohedral Th₂Zn₁₇ structure. X-ray diffraction analysis of aligned powders shows that the easy direction of magnetization is parallel to the c-axis in Y₂Fe₁₀Ga₇ and Gd₂Fe₁₀Ga₇ and is perpendicular to the c-axis in Y₂Fe₁₄Ga₃, Y₂Fe₁₂Ga₅, Gd₂Fe₁₂Ga₅ and Gd₂Fe₁₁Ga₆. Mössbauer studies indicate that those samples are ordered ferromagnetically. The ⁵⁷Fe hyperfine field decreases with increasing Ga content. This decrease results from the decreased magnetic exchange interactions resulting from Ga substitution. The average isomer shift, δ, for R₂Fe_17−xGa_x (R=Y and Gd) at room temperature is positive and the magnitude of δ increases with increasing Ga content.     

A correlation between the two ratios γ/χ(0) and |Jm|/TK in Kondo system

Using the approach based on molecular field calculations for resonant level model; a close relationship between the two ratios γ/χ(0) and |J_m|/T_K is obtained. Where γ represents the electronic contribution in the specific heat, χ(0) is the susceptibility at zero temperature, J_m is the molecular field parameter and T_K is the Kondo temperature.     

Magnetocaloric properties of DyCo2−xGax alloys

The influence of the substitution of Ga atoms for Co atoms in DyCo₂ compounds on magnetocaloric properties has been investigated. A series of DyCo_2−xGa_x alloys with x=0, 0.03, 0.06, 0.1, 0.15, and 0.2 was prepared by the arc-melting method for this investigation. Experimental results revealed that the Ga substitution for Co in DyCo₂ can form a single phase with the cubic Laves phase structure up to x=0.2. As the Ga content x increases, the lattice parameter and the Curie temperature T_c increases from 143 to 196 K linearly. The maximum magnetic entropy changes in a low field change of 0-1.5 T, increasing from 8.24 to 10.61 J/K kg when the Ga content x increases from 0 to 0.03, but decreasing gradually to 3.51 J/K kg as the Ga content further increases to x=0.2. All the samples show a relatively large magnetic entropy change with very small hysteresis loss.     

The first-principles studying LaOMnSe: A possible parent compound of superconductor

By the first-principles calculations, we studied the structure, electronic and magnetic properties of LaOMnSe. The band structure and Fermi surface of LaOMnSe are very similar to those of LaOFeAs, where there are three hole-like Fermi surfaces around Γ-point and two electron-like Fermi surfaces around M-point. The hole-like Fermi surfaces will strongly overlap with electron-like Fermi surfaces if they are shifted by the q vector (π,π,0). Such Fermi surfaces nesting will induce magnetic instability and spin density wave (SDW), which is similar to LaOFeAs. Because of so much similarity to LaOFeAs, LaOMnSe is expected to become superconductor with electron or hole doping.     

Effect of Cr on the electronic structure of Co3Al intermetallic compound: A first-principles study

The effect of doping with Cr on the electronic structure and magnetism of Co₃Al has been studied by density functional calculations. It has been found that the Cr atom has a strong site preference for the B-site in Co₃Al. With the substitution of Cr for Co, the total densities of states (DOS) change obviously: A DOS peak appears at E_F in the majority spin states and an energy gap is opened in the minority spin states. The effect of Cr in Co₃Al is mainly to push the antibonding peak of the Co (A,C) atoms high on the energy scale and to form the energy gap around E_F, and also to contribute to the large DOS peak at E_F in the majority spin direction. The calculations indicate a ferromagnetic alignment between the Co and Cr spin moments. The calculated total magnetic moment decreases and becomes closer to the Slater–Pauling curve with increasing Cr content. This is mainly due to the decrease of the Co (A,C) spin moments. At the same time, the moments of Co (B) and Cr (B) only change slightly.     

Oscillations in magnetocaloric effect and magnetic properties of RE2Al3Si2 (for RE=Dy,Ho and Er) and REAlSi (for RE=Ce and Pr)

We present the magnetic and thermal properties of a series of compounds RE₂Al₃Si₂ for RE=Dy, Ho, Er, and REAlSi for RE=Pr, Ce. The 2–3–2 family crystallizes with themonoclinic Y₂Al₃Si₂-type structure while the 1–1–1 family crystallizes in the body-centered tetragonal α-ThSi₂-type structure. The measurements were done on single crystals, grown using high-temperature flux technique and molten Al as a solvent . Susceptibility and heat capacity data were taken from 1.8 to 200 K, from the heat capacity data, the isothermal magnetic entropy change was obtained. Our results indicate signal oscillations in magnetocaloric properties for those compounds, in particular, Dy₂Al₃Si₂ that shows an anomaly that can be associated with a spin reorientation. Similar results are known for some Dy discilicides and dialluminades.     

Magnetic coupling between Gd and Pr ions and magnetocaloric effect in Gd0.5Pr0.5Al2 compound

In this work, we report the theoretical and experimental investigations on the magnetic and magnetocaloric properties for Gd_0.5Pr_0.5Al₂ compound in different magnetic fields. The magnetization features indicate that Gd_0.5Pr_0.5Al₂ is ferrimagnetic at low temperatures. We also present data from X-ray magnetic circular dichroism (XMCD) experiments for this compound, with which we have confirmed that the magnetic moments of the Pr ions are antiparallel to the magnetic moments of the Gd ions. The magnetocaloric parameters, ΔT_S and ΔS_T, were obtained from calorimetric data and both curves present normal and inverse magnetocaloric effect. A theoretical model for ferrimagnetic coupling, including the crystalline electrical field anisotropy, was used to describe the ΔT_S and ΔS_T experimental results.     

Superconductivity in Mg-Doped Layered Intermetallic Compound NbB2

We have performed low temperature resistivity p（T） and specific heat C（T） measurements on a superconducting polycrystalline Nb0.75Mg0.25B2 sample. The results indicate that the superconducting transition temperature is -4.6 K. The zero temperature upper critical field determined from the resistivity and specific heat is 3123 Oe. The electronic coefficient of specific heat γn=4.51 mJmol^-1K^2 and the Debye temperature θD=419 K are obtained by fitting the zero-field specific heat data in the normal state. At low temperatures, the electronic specific heat in the superconducting state follows Ces/γnTc = 2.84 exp（-1.21Tc/T）. This indicates that the superconducting pairing in Nb0.75Mg0.25B2 has s-wave symmetry.     

Superconductivity in compressed potassium and rubidium

Calculations of the electron-phonon interaction in the alkali metals, potassium and rubidium, using the results of band theory and BCS theory-based techniques suggest that at high pressures K and Rb would be superconductors with transition temperatures approaching 10 K.     

Structure of intermetallic phases in Al-free galvannealed zinc coatings

Galvannealed coatings of thickness of (20–40) μm were prepared on the ultra low carbon (ULC) steel substrate. Metalography analysis was carried out to obtain the phase composition of coatings. Coatings were then transfered onto a polyacrylate foil. Transmission spectra yielding all the positions of iron within the coating thickness were measured. The doublet of zeta phase occured only after short annealing times, lower annealing temperatures and longer dipping times. Parameters of three sites of delta phase were observed to approach equilibrium values at higher annealing temperatures and longer annealing times. These changes are ascribed to diffusion transformations in the coatings during annelaing. Presented at International Colloquium “M?ssbauer Spectroscopy in Materials Science”, Všemina, Czech Republic, June 1–4, 2004.     

Thermodynamics of a quasi-one-dimensional spin system for molecule-based ferrimagnets

A physical picture of electron spin alignments in organic molecule-based ferrimagnets is given from numerical calculations of magnetic specific heat (C) and magnetic susceptibility (χ) as functions of temperature and static magnetic field (B) in terms of an Ising Hamiltonian for an alternating spin chain. The double-peak structure of specific heat appears for different parameter ratios and different magnetic field B, indicating that one peak originates from the ferromagnetic nature and the other from the antiferromagnetic nature. Meanwhile, we study successively the influence of intermolecular and intramolecular interaction on the magnetic susceptibility, showing that the ferromagnetic spin alignment in the alternating molecular chains of biradicals and monoradicals is equivalent to the ferromagnetic alignment of the effective S=1/2 spins. Our results are consistent with those of the Quantum Monte Carlo simulations and the exact diagonalization method and in qualitative agreement with the experimental ones.     

Enhanced Orbital Degeneracy in Momentum Space for LaOFeAs

The Fermi surfaces （FS） of LaOFeAs （in kz = 0 plane） consist of two hole-type circles around F point, which do not touch each other, and two electron-type co-centred ellipses around the M point, which are degenerate along the M - X line. By first-principles calculations, here we show that additional degeneracy exists for the two electron-type FS, and the crucial role ofF-doping and pressure is to enhance this orbital degeneracy. It is therefore suggested that the inter-orbital fluctuation is important to understand the unconventional superconductivity in these materials.     

Effect of carbon doping on thermodynamic behavior of MgB2

The thermodynamic behavior of carbon doped MgB₂ has been studied using a rigid ion model (RIM). The model potential consists of the long-range Coulomb, the short-range repulsive and the van der Waals interactions. This model has successfully explained the cohesive and thermodynamic properties of Mg(B_1−xC_x)₂ (x=0.0, 0.02, 0.05, 0.075, 0.1, 0.2). The properties studied are the cohesive energy, molecular force constant, Restrahlen frequency, compressibility, Debye temperature and Gruneisen parameter. Our results on Restrahlen frequency and Debye temperature are in reasonably good agreement with the available experimental data. In addition, we have computed the specific heat C_p for Mg(B_1−xC_x)₂ (x=0.2) as a function of temperature T in the range 16 K?T?1000 K. We have also shown the variation of specific heat C_p with doping concentration at room temperature (300 K). The calculated specific heat C_p for Mg(B_1−xC_x)₂ (x=0.2) in the temperature range 16 K?T?22 K for which experimental results are available, agrees pretty well with the experimental data.     

Magnetocaloric effect of GdCo2−xAlx compounds

The structure, magnetic property and magnetocaloric effect of GdCo_2−xAl_x (x=0, 0.06, 0.12, 0.18, 0.24, 0.4) compounds have been investigated by X-ray diffraction (XRD) and magnetic measurement techniques. The experimental results show that the GdCo_2−xAl_x (x≤0.4) compounds are single phase with a Laves-phase MgCu₂-type structure. The Curie temperature T_c initially increases, and then decreases with increasing Al content. The maximum value of T_c, 418 K, is reached for the compound with x=0.06. The magnetic entropy change, which is determined from the temperature and field dependence of the magnetization by the Maxwell relation, decreases almost linearly with increasing Al content.     

Superconductivity coexisting with ferromagnetism in mixed-valence Mn doped La1.85−(4/3)xSr0.15+(4/3)xCu1−xMnxO4

The effect of Mn substitution for Cu in mixed-valence Mn doped La_{1.85−(4/3)x}Sr_0.15+(4/3)xCu_1−xMn_xO₄ (x=0.06) has been investigated by electric resistivity, magnetization and electron spin resonance experiments. Coexistence of superconductivity and ferromagnetism was observed.     

Magnetic properties in Fe-doped NiO synthesized by co-precipitation

The magnetic properties of 1.5 at% Fe-doped NiO bulk samples were investigated. The samples were prepared by sintering the corresponding precursor in air at temperatures between 400 and 800 °C for 6 h. The synthesis was by a chemical co-precipitation and post-thermal decomposition method. In order to allow a comparison, a NiO/0.76 at% NiFe₂O₄ mixture was also prepared. The X-ray diffraction pattern shows that the samples that were sintered at 400 and 600 °C remain single phase. As the sintering temperature increased to 800 °C, however, the sample becomes a mixture of NiO and NiFe₂O₄ ferrite phases. The samples were investigated by measuring their magnetization as a function of magnetic field. The samples sintered between 400 and 800 °C and the one mixed directly with NiFe₂O₄ nanoparticles show a coercivity value of H_c≈200, 325, 350 and 110 Oe, respectively. The magnetic properties of the samples depend strongly on the sintering temperature. Simultaneously, the field-cooling hysteresis loop shift also observed after cooling the sample sintered at 600 °C to low temperature suggests the possibility of the existence of a ferromagnetic/antiferromagnetic exchange coupling.