Thermal expansion of hydroxyapatite between − 100 °C and 50 °C

Hydroxy apatite (HAp) ceramic was synthesized using traditional sintering. Dilatometric and lattice thermal expansion properties of a HAp ceramic were evaluated at temperatures of ? 100–50 °C. In that temperature range, the dilatometric thermal expansion coefficient and the lattice thermal expansion coefficient of the HAp ceramic were, respectively, 10.6 × 10^? 6/°C and 9.9 × 10^? 6/°C. Furthermore, thermal expansion properties of a human tooth were measured. The thermal expansion coefficient of the horizontal direction perpendicular to the growing direction of a tooth was 15.5 × 10^? 6/°C; that of the vertical direction along with the direction of tooth growth was 18.9 × 10^? 6/°C at the temperature range described above.     

Thermoelectric properties of Re6GaxSeyTe15−y (0 ≤ x ≤ 2; 0 ≤ y ≤ 7.5)

Thermoelectric properties of Re₆Ga_xSe_yTe_15?y (0 ≤ x ≤ 2; 0 ≤ y ≤ 7.5) were studied in the temperature range 90–320 K. The measurements revealed p-type semi-conductivity in all samples. Relatively high values of the Seebeck coefficients, α, were obtained in all samples. The electrical resistivities and room temperature Seebeck coefficients increased as selenium concentrations increased, for each value of x. The room temperature Seebeck coefficients and resistivities decreased as gallium content increased, for each value of y. Low carrier concentrations were found at room temperatures, in agreement with large Seebeck coefficient values. Measurements suggested hopping conduction between 150 K and 280 K for all samples. Temperature dependences of the Seebeck coefficient below 150 K were accounted for by phonon drag effect. The power factors for the samples were calculated. Theoretical discussions of dependences of the measured quantities on temperature and composition are given. Usefulness of these materials as thermoelectrics is also discussed.     

Beneficial effect of minor Al substitution on the magnetocaloric effect of Mn1 − xAlxAs

Magnetocaloric effect near room temperature is enhanced by minor Al substitution in Mn_1 ? xAl_xAs compounds (x = 0, 0.015, 0.03). The Curie temperature and magnetic entropy change can be tuned by Al concentration. Under a field change of 2 T, which is below the critical field of metamagnetic transition and easy to reach in applications, a large reversible magnetic entropy change 28.5 J kg^? 1 K^? 1, and a huge magnetic entropy change 65.7 J kg^? 1 K^? 1 under a field change of 5 T is obtained at x = 0.015 near room temperature. Compared with that of MnAs mother alloy, it is concluded that minor Al substitution is beneficial for enhancing the magnetic entropy in Mn_1 ? xAl_xAs alloys.     

Thermo-optical properties of LaMg1 − xNixAl11O19 (0 ≤ x ≤ 1) hexaaluminates for metallic thermal protection system

LaMg_1 ? xNi_xAl₁₁O₁₉ (x = 0, 0.25, 0.5, 0.75, 1) ceramics are fabricated by pressureless-sintering method at 1700 °C for 10 h in air. The microstructure and thermo-optical properties of LaMg_1 ? xNi_xAl₁₁O₁₉ ceramics are investigated by the X-ray diffraction, scanning electron microscopy and Fourier transform infrared spectroscopy measurements. The influence of NiO doping on structure and thermo-optical properties of LaMg_1 ? xNi_xAl₁₁O₁₉ ceramics is investigated. The partial substitution of Ni²⁺ for Mg²⁺ results in a significant increase in emissivity at low wavelengths as compared with unmodified LaMgAl₁₁O₁₉. When the Ni²⁺ content increases to x = 0.75 or above, LaMg_1 ? xNi_xAl₁₁O₁₉ ceramics have a high emissivity value above 0.70 at low wavelengths at 500 °C. The measured emissivity of all LaMg_1 ? xNi_xAl₁₁O₁₉ ceramics shows a similar trend in the wavelength range of 6 to 14 μm.     

Density functional theories study on the properties of Ga1 − xCrxAs

The structural, electronic, magnetic and optical properties of Ga_1 − xCr_xAs (x = 0, 6.25%, 12.5%) have been studied by first-principles calculations based on the HSE hybrid density functional theories. The optical properties, including the complex dielectric function, optical refractive index, extinction coefficient and absorption coefficient are discussed for radiation up to 15 eV. The results predicate that the system of Ga_1 − xCr_xAs exhibits typical half-metallic properties, in which Cr forms deep levels in the forbidden band and reduces the energy gap, increases static dielectric constant and obviously red-shifts the absorption edge. With the increase of the fraction of Cr, the material gradually exhibits noticeable anisotropy in the photon energy range of 0–5 eV. In addition, the p-d hybridization reduces the magnetic moment of Cr from its free space charge value of 3 μ_B and a smaller atomic magnetic moments of As and Ga atoms are generated.     

Measuring spectral transmission and refractive index of AgCl1−xBrx (0 ⩽ x ⩽ 1) and Ag1−xTlxBr1−xIx (0 ⩽ x ⩽ 0.05) at the wavelength of 10.6 μm

We measured the complex refractive index at the wavelength of 10.6 μm with the help of Fourier transform infrared spectroscopy for polycrystalline plates of the following compositions AgCl_1−xBr_x (0 ⩽ x ⩽ 1) and Ag_1−xTl_xBr_1−xI_x, where x varied from 0 to 0.05. In order to do it we chose a segment of the spectrum, which was recorded with a high resolution (0.5 cm⁻¹) using the HgCdTe detector and which had a set of 10 identical peaks. It is shown that the real part of the refractive index rises along with increasing the substituting component fraction in the solid solution from 1.99 to 2.17 for AgCl_1−xBr_x and from 2.17 to 2.24 within the range of TlI mole fraction up to 0.05 for Ag_1−xTl_xBr_1−xI_x. We considered errors introduced by the spectrometer resolution and the accuracy rating of the micrometer, which was used to measure sample thickness. It is seen in the spectra, recorded for the second system with a lower resolution and using a deuterated and l-alanine doped triglycine sulfate detector, that increasing the thallium monoiodide fraction results in widening the transmission range towards bigger wavelengths. We also plan to use the obtained refractive index values for simulating mid-infrared optical fibers, the polycrystalline structure of which is close to the structure of the plates under investigation.     

Multiferroic properties of Ba(FexTi1 − x)O3 nanorods

Multiferroic Ba(Fe_xTi_1 ? x)O₃ (BFT) nanorods were prepared by a chemical route using polyvinyl alcohol as surfactant. The presence of PVA in excess is responsible to convert cubic or spherical shaped nanoparticles into rodlike structure. Tetragonal phase and nano dimensions in the form of rods of BFT specimens are identified. These BFT nanorods show improvement in the coexistence of ferroelectricity and ferromagnetism of multiferroic properties than their nanoparticles. The effect of low dimensions of BFT rods to control dielectric constant with low loss up to higher frequency region has been observed. With 1% of Fe-doping BFT shows higher value of spontaneous polarization, saturation magnetization and dielectric constant than with other dopants.     

Magnetisation studies of phase co-existence in Gd1 − xCaxBaCo2O5.5

Magnetic properties of hole doped, oxygen deficient double perovskite compounds, Gd_1 ? xCa_xBaCo₂O_5.5, have been investigated. Ferromagnetic transition temperatures increase and the anti-ferromagnetic transition temperatures decrease with Ca substitution leading to stabilisation of ferromagnetisim for x ≥ 0.05. A detailed study of the ferromagnetic phase indicates the presence of double hysterisis loops for Ca fractions, 0.05 ≤ x ≤ 0.2 in the 50–200 K temperature range, suggestive of the co-existence of two ferromagnetic phases with different co-ercivities. Based on the magnetisation and transport measurements a phase diagram is proposed for Ca doped GdBaCo₂O_5.5.     

Physical and optical properties of Co2+, Ni2+ doped 20ZnO + xLi2O + (30 − x)K2O + 50B2O3 (5 ≤ x ≤ 25) glasses: Observation of mixed alkali effect

Co²⁺ and Ni²⁺ ions doped 20ZnO + xLi₂O + (30 ? x) K₂O + 50B₂O₃ (5 ≤ x ≤ 25) mol% glasses are prepared using melt quenching technique. Structural changes of the prepared glasses by addition of transition metal oxides, CoO and NiO are investigated by UV–vis–NIR, FT-IR spectroscopy and XRD. The XRD pattern indicates the amorphous nature of prepared glasses. FT-IR measurements of the all glasses revealed that the network structure of the glasses are mainly based on BO₃ and BO₄ units placed in different structural groups in which the BO₃ units being dominant. The optical absorption spectra suggest the site symmetry of Co²⁺ and Ni²⁺ ions in the glasses are near octahedral. Crystal field and inter-electronic repulsion parameters are also evaluated. The optical band gap and Urbach energies exhibited the mixed alkali effect. Various physical parameters such as density, refractive index, optical dielectric constant, polaron radius, electronic polarizability and inter-ionic distance are also determined.     

Influence of Al2O3 on low-field spin-polarized tunneling magnetoresistance of (1 − x) La0.7Ca0.3MnO3 + x Al2O3 composites

In this study we report the effect of Al₂O₃ on the low field magnetoresistance (LFMR) of (1 ? x) La_0.7Ca_0.3MnO₃ + x Al₂O₃ composite synthesized through a solid-state reaction method combined with an energy milling method. Based upon a spin-polarized tunneling of conduction electrons at the grain boundaries, we have proposed a phenomenological model to explain the observed electrical transport behavior over the whole temperature range (5  300 K), especially the gradual drop of metal-insulator transition temperature (T_p = T_max) as a function of increasing Al₂O₃ content, while the ferromagnetic–paramagnetic transition temperature (T_C) remains almost constant (T_C = 250 K).     

Microwave-assisted synthesis and characterization of Ti1 − xVxO2 (x = 0.0–0.10) nanopowders

Ti_1 ? xV_xO₂ (x = 0.0–0.10) nanopowders were successfully synthesized by a microwave-assisted sol–gel technique and their crystal structure and electronic structure were investigated. The products were characterized using X-ray diffraction (XRD), scanning electron microscopy (SEM), Raman and UV–Vis spectroscopy. The results revealed that TiO₂ powders maintained the anatase phase for calcination temperature below 600 °C, but gradually changed to the rutile phase above 800 °C. The formation of the rutile phase was completed at 1000 °C. For Ti_1 ? xV_xO₂ (x = 0.05) powders, the phase transformation appeared at 600 °C. The absorption edge of Ti_1 ? xV_xO₂ (x > 0) powders broadened to the visible region with increasing V concentration and a strong visible light absorption was obtained with 10% V doping. V doping and subsequent coexistence of both anatase and rutile phases in our Ti_1 ? xV_xO₂ nanoparticles are considered to be responsible for the enhanced absorption of visible light up to 800 nm.     

Electronic structure of Cu100−xZrx (x = 40, 50, 60) metallic glasses

The electronic structure of Cu_100−xZr_x (x = 40, 50, 60) metallic glasses was investigated by ultraviolet photoelectron spectroscopy and X-ray photoemission spectroscopy, the valence band spectra of these alloys were analyzed by a large shift of the Cu d-band peaks to higher binding energies upon increasing Cu content. Photoemission experiments and first-principles calculations prove that the values of density of states at Fermi level of Cu_100−xZr_x metallic glasses are mainly dominated by Zr rather than Cu. This work will enlighten further research on understanding the inheritance of metallic glasses and designing new metallic glasses with unique properties.     

Features of nanostructuring in LaMnO3 + δ (polydisperse and monodisperse structures)

The formation of polydisperse and monodisperse structures in LaMnO_3 + δ has been investigated by X-ray diffraction (XRD) analysis and transmitting electron microscopy (TEM). The sizes of LaMnO_3 + δ particles have been evaluated for different types and conditions of synthesis (solid-phase synthesis and sol–gel method) and subsequent heat treatment in the controlled atmosphere. The effect of the size distribution on the correctness in the determination of particle sizes has been analyzed.     

Effect of (α + β) heat treatment on microstructure and mechanical properties of (TiB + TiC)/Ti–B20 matrix composite

For the first stage, a metastable β titanium alloy, Ti–3.5Al–5Mo–4V–2Cr–2Sn–2Zr–1Fe reinforced with trace amounts of TiB whiskers and TiC particles was fabricated by vacuum arc melting process and hot forging followed by heat treatment at 780 °C/740 °C, then by aging at 500 °C, 550 °C, 570 °C and 600 °C. For the second stage, the unreinforced titanium alloy was also fabricated by the same process. The microstructural characteristics were investigated by scanning electron microscopy (SEM) and transmission electron microscopy (TEM). Traces of TiB whiskers and TiC particles (2.2 vol.%) with a volume ratio of 2:3 synthesized in situ exerted a hybrid reinforcing effect on the β titanium alloy. The reinforcements were uniformly distributed in the matrix and the elastic modulus was improved about 25 GPa. Ultimate tensile strength and yield strength achieves about 1625 MPa and 1500MPa respectively, with ductility at 7% when the aging temperature is 500 °C. The ductility of (TiB + TiC)/(Ti–3.5Al–5Mo–4 V–2Cr–2Sn–2Zr–1Fe) matrix composite could be enhanced by increasing the aging temperatures. After 780 °C followed by aging at 570 °C, excellent strength and plasticity properties were obtained (ultimate tensile strength of matrix alloy is 1350 MPa with elongation of 18% and ultimate tensile strength of composite is 1500 MPa with elongation of 13%).     

Solidification microstructures of the undercooled Co–24 at%Sn eutectic alloy containing 0.5 at%Mn

Solidification samples of undercooled Co–24 at%Sn eutectic alloy containing a small amount of Mn (<1.0 at%) were prepared by the glass fluxing technique. The surface and internal solidification microstructures of the samples were observed by a scanning electron microscope (SEM) and an optical microscope (OM), respectively. The experiment results revealed that the addition of 0.5 at%Mn remarkably changed the solidification behaviors of the undercooled Co–24 at%Sn eutectic alloy. The addition of 0.5 at%Mn influenced the morphological selection of eutectic growth interface by increasing the interface energy anisotropy during the solidification of the undercooled Co–24 at%Sn eutectic melt. As undercooling increases, the coupled eutectic growth interface morphology successively experienced dendritic pattern, factual seaweed pattern and compact seaweed pattern. Besides, the addition of 0.5 at%Mn decreased the critical undercooling for the formation of anomalous eutectic by introducing a new formation mechanism of anomalous eutectic, i.e. divorce eutectic mechanism.     

Atomic diffusion in the Fe [0 0 1] ∑ = 5 (3 1 0) and (2 1 0) symmetric tilt grain boundary

Both the formation and diffusion activation energies of single vacancy migrating intra-layer and inter-layer near the Fe [0 0 1] Σ = 5 (3 1 0) and (2 1 0) symmetric tilt grain boundaries have been calculated by using the MAEAM and a MD method. From energy minimization, the vacancy concentration in the second layer is higher than the one in the other layers for both (3 1 0) and (2 1 0) STGBs. By the diffusion activation energies of the vacancies migrating intra-layer and inter-layer, the vacancies located from the first to the eighth layers of (3 1 0) STGB as well as the ones located from the first to the tenth layers of (2 1 0) STGB are favorably migrated to the second layer. Thus there is a vacancy aggregation tendency to the second layer near the grain boundary. For the vacancy migrating intra-layer and inter-layer, the influences of the grain boundary are respectively as far as to the fifth and eighth layers for (3 1 0) STGB as well as to the sixth and tenth layers for (2 1 0) STGB.     

One-step preparation of dense TiC1 − xNx–Ni3Ti cermet by combustion synthesis

TiC_1 − xN_x-based cermets are attractive for high-speed cutting operations, and are usually produced by powder sintering at high temperatures and for a long time. In this paper, dense TiC_1 − xN_x–Ni₃Ti cermet is directly prepared in one step by combustion synthesis in 2 MPa N₂ atmosphere, from the reactant of (Ti + C + Ni) with a molar ratio of Ti:C:Ni = 1:0.7:0.4. The as-prepared TiC_1 − xN_x–Ni₃Ti cermet shows a homogeneous microstructure, in which equiaxed TiC_1 − xN_x grains of a few microns are bounded by Ni₃Ti grain-boundary phase, and a Vickers hardness of 12.1 ± 0.3 GPa. It is proposed that the deficiency of C in the starting reactant plays a key role in simultaneous densification during combustion synthesis. Compared with the conventional powder sintering approach, combustion synthesis may provide a one-step, ultrafast, and furnace-free way to prepare TiC_1 − xN_x-based cermets with reduced time and energy consumption.     

Multicolor-emitting Ca3 -x-ySry(PO4)2:xEu2 + (0 ≤ x ≤ 0.075, 0 ≤ y ≤ 2.2) phosphors for light-emitting diodes

In this paper, a series of Ca_3 -x-ySr_y(PO₄)₂:xEu^2 +, (0 ≤ x ≤ 0.075, 0 ≤ y ≤ 2.2) phosphors were prepared by flux assisted solid-state reaction method, and their photoluminescence properties were investigated. The β- to β′-phase transition of Ca_3 -ySr_y(PO₄)₂ for high Sr^2 + content was observed from the XRD patterns, and the corresponding optical bandgaps were obtained experimentally. Various Eu^2 + emission centers were found, which generate tunable emission depending on the Sr^2 + concentration. Broad and intense excitation bands exist in Eu^2 + activated Ca₃(PO₄)₂, and the introduction of Sr^2 + further extends and enhances the excitation bands beyond 350 nm, which is beneficial to the applications on near ultraviolet LEDs. The morphology measurement reveals that the average size of particles with smooth surface is about 11.2 μm, which is suitable for the practical applications. These results indicate that the Ca_3 -x-ySr_y(PO₄)₂:xEu^2 + phosphors could be promising candidates for LEDs.