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Vol 55, No 1 (2019)

Article

Electronic Structure and Ferromagnetic Transition Temperature of Ga1– xMnxAs in the Nonempirical Local Exchange Method

Yarzhemsky V.G., Murashov S.V., Izotov A.D.

Abstract

spintronic materials, diluted magnetic semiconductor, GaAs, Mn, density functional method, density of states, band structure

Inorganic Materials. 2019;55(1):1-8
pages 1-8 views

High-Temperature Oxidation of Ti3SiC2-Based Materials Prepared by Spark Plasma Sintering

Sevost’yanov N.V., Basargin O.V., Maksimov V.G., Burkovskaya N.P.

Abstract

Materials based on the titanium carbosilicide Ti3SiC2 (MAX phase), prepared by spark plasma sintering (SPS), have been subjected to high-temperature tests. The high-temperature behavior of samples containing the carbosilicide phase and carbosilicide-free samples were studied. The results demonstrate that the presence of the MAX phase improves the heat resistance of the material, preventing oxidation. The oxidation products of the titanium carbosilicide-based materials are titanium dioxide, silicon monoxide, and carbon dioxide.

Inorganic Materials. 2019;55(1):9-13
pages 9-13 views

Effect of Initial Composition on the Liquid–Solid Phase Transition in Cr–W Alloy Nanoparticles

Shishulin A.V., Fedoseev V.B.

Abstract

Phase transformations in nanoscale systems are influenced by a variety of different factors. In this study, we use methods of equilibrium chemical thermodynamics to demonstrate that the initial composition of a nanosystem is among such factors and model the influence of initial composition on the phase diagram of Cr–W nanoparticles in the two-phase region between their liquidus and solidus temperatures. We show that the equilibrium compositions of the liquid and solid phases and phase transition temperatures depend on the initial composition of the nanoparticles. At any composition, the liquidus temperature of a nanoparticle is lower than that of a corresponding macroscopic system. The solidus temperature of a nanoparticle can be both lower and higher than that of a corresponding macroscopic system, depending on composition. As the particle size decreases to the nanometer range, the temperature range of the heterogeneous region narrows down.

Inorganic Materials. 2019;55(1):14-18
pages 14-18 views

Modeling of Structural Defects in Silicon Carbide

Sokolenko E.V., Slyusarev G.V.

Abstract

This paper reports DFT calculations of the electron density in pure and imperfect silicon carbide clusters. The local levels produced in the band gap by doping are shown to be determined predominantly by intrinsic states of the silicon and carbon.

Inorganic Materials. 2019;55(1):19-31
pages 19-31 views

High-Temperature Synthesis of Al–Zr–W Aluminum-Matrix Alloys

Gostishchev V.V., Kim E.D., Khimukhin S.N., Ri E.H.

Abstract

This paper reports the preparation of Al–Zr–W aluminum-matrix alloys containing reinforcing inclusions of various phases. The alloys have been produced by the aluminothermic reduction of starting mixtures consisting of zirconium and tungsten oxides in the first stage and of baddeleyite and scheelite mineral concentrates in a second stage. According to our experimental data, the use of baddeleyite and scheelite instead of zirconium and tungsten oxides in the starting mixture produces no significant changes in the elemental composition of the alloy: the total zirconium and tungsten content of the alloy is 31–32 wt %. Characterization of the alloy prepared using the mineral concentrates has shown that the aluminum matrix contains inclusions of the Al3Zr and Al4W intermetallic phases and a small amount of the ZrN nitride. The volume fraction of the inclusions in the alloy is 32–38%. Most of the structural constituents of the alloy contain a small amount of unwanted silicon and iron impurities (~3%), which originate from the mineral concentrates. In the future, to reduce the impurity concentration we plan to use technological approaches that will ensure preliminary purification of mineral concentrates.

Inorganic Materials. 2019;55(1):32-36
pages 32-36 views

Effect of Iron Oxalate Additions on the Phase Composition of Combustion Products of Silicon–Carbon Mixtures in Nitrogen

Barinova T.V., Barinov V.Y., Kovalev I.D.

Abstract

We have examined the effect of iron oxalate (Fe2(C2O4)3 · 5H2O) additions on the phase composition of combustion products of silicon–carbon mixtures in nitrogen. The phase composition of the combustion products has been determined as a function of starting-mixture composition and nitrogen pressure. We have investigated the microstructure of the synthesized powders. The addition of SiO2 to the starting mixture has been shown to increase the percentage of Si2N2O in the combustion products.

Inorganic Materials. 2019;55(1):37-41
pages 37-41 views

Epitaxial Growth of Fe3O4 Layers on the C-Plane of Sapphire by Pulsed Laser Deposition

Malikov I.V., Berezin V.A., Fomin L.A., Mikhailov G.M.

Abstract

We have studied the effect of substrate temperature and molecular oxygen pressure on the growth of thin (<180 nm) epitaxial Fe3O4(111) films on the C-plane of single-crystal sapphire (Al2O3(0001)) via pulsed laser evaporation. We have investigated the electrical properties, morphology, and structure of magnetite films grown under various conditions and the magnetic-field and temperature dependences of their resistivity. Fe3O4 has been shown to have a stable growth plateau (SGP) at pressures in the range (3–9) × 10–5 Torr and growth temperatures from 300 to 550°C. With increasing growth temperature, the SGP shifts to higher oxygen pressures. Analysis of the effect of film growth temperature indicates that optimal electrical characteristics and a more perfect crystal structure are ensured by elevated growth temperatures, above 400°C, whereas growth temperatures below 350°C make it possible to minimize the surface roughness of the films and improve their surface homogeneity. Annealing magnetite films under high vacuum above the growth temperature allows all of these requirements to be met.

Inorganic Materials. 2019;55(1):42-48
pages 42-48 views

Effect of Process Conditions on the Structure and Optical Properties of MoO3 Produced by Vapor Transport Deposition

Domashevskaya E.P., Ivkov S.A., Dambos a.H., Ryabtsev S.V.

Abstract

MoO3 samples have been prepared by vapor transport deposition under different process conditions: at two distinct hot-zone temperatures in a tube furnace (800 and 1100°C) and with different additives to argon as a major carrier gas: O2, H2O vapor, or N2O gas. According to X-ray diffraction, electron-microscopic, and optical characterization results, the layered structure of microcrystals and band gap of MoO3 are sensitive to not only vapor transport deposition conditions (synthesis temperature and vapor phase composition) but also mechanical treatment (grinding). At a synthesis temperature of 800°C, the distortion of the MoO3 crystal lattice by incorporated H2O molecules causes MoO3 to transform from the major, orthorhombic α-phase (space group Pbnm) into a monoclinic phase (P21/n), which is accompanied by a reduction in band gap from 2.85 to 2.68 eV. At a higher synthesis temperature of 1100°C, neither hydrogen or oxygen impurities originating from water (H2O) vapor nor nitrogen or oxygen impurities originating from N2O change the layered orthorhombic structure of the microcrystals, but the addition of N2O to the vapor transport medium reduces the band gap of MoO3 to 2.51 eV. Mechanical treatment (grinding) of the MoO3 microcrystals synthesized at the higher temperature (1100°C) with the addition of water vapor or N2O to argon carrier gas produces a monoclinic phase (space group P21/n) in addition to the major, stable, orthorhombic phase (Pbnm). The MoO3 microcrystals synthesized at a temperature of 800°C are more resistant to mechanical treatment: after grinding, they consist of only one phase: orthorhombic (Pbnm) in the case of synthesis in an argon–oxygen vapor transport medium or monoclinic (P21/n) in the case of the addition of water vapor to argon as a major carrier gas.

Inorganic Materials. 2019;55(1):49-58
pages 49-58 views

Synthesis of a LiZnSc(MoO4)3:Eu3+-Based Red Phosphor

Kozhevnikova N.M., Batueva S.Y.

Abstract

Abstract—Phase relations in the Li2MoO4–ZnMoO4–Sc2(MoO4)3 system have been studied by X-ray diffraction and differential thermal analysis. We have synthesized the ternary molybdate LiZnSc(MoO4)3, which crystallizes in triclinic symmetry (sp. gr. \(P\bar {1}\)). A continuous series of solid solutions with an orthorhombic structure (sp. gr. Pnma) has been shown to exist on the Li2Zn2(MoO4)3–Li3Sc(MoO4)3 join. A luminescent material based on the ternary molybdate doped with europium ions, LiZnSc(MoO4)3:Eu3+, has been prepared by solid-state reaction, and its photoluminescence (excitation and emission) spectra have been measured.

Inorganic Materials. 2019;55(1):59-63
pages 59-63 views

Effect of Synthesis Conditions on the Luminescence of Europium-Containing Materials Based on Yttria and Yttrium Oxyfluorides

Smagin V.P., Khudyakov A.P.

Abstract

We have studied the luminescence of europium(III)-doped materials based on yttria and yttrium oxyfluorides. The materials were prepared through heat treatment of fluorine-containing yttrium and europium(III) thioacetamide complexes at temperatures of 400, 600, and 800°C for 2 to 6 h. The products were shown to consist of (EuхY1 –х)F3, (EuхY1 –х)5O4F7, (EuхY1 –х)OF, and (EuхY1 –х)2O3 phases. We have proposed a scheme that reflects the formation sequence of the main components of the materials in the above temperature range. Narrow-band luminescence of the materials has been shown to arise from Eu3+5D07Fj electronic transitions. The origin of the observed broad luminescence band peaking in the range 480–500 nm can be understood in terms of surface structural defects, the particle size, and the broad particle size distribution. The luminescence spectrum has been shown to be influenced by the starting-mixture composition, synthesis conditions, host composition, and excitation wavelength. Some of the observed luminescence features have been shown to be due to the effect of S2– ions in the composition of europium-containing activator centers.

Inorganic Materials. 2019;55(1):64-76
pages 64-76 views

Correlation between Refractive Index Dispersion Parameters and Cation Coordination Numbers in Fluoride Crystals

Sorokin N.I.

Abstract

Refractive index dispersion parameters of optical crystals of MFn (Mn+ = Na+, K+, Ca2+, Sr2+, Ba2+, Cd2+, Pb2+, La3+, Ce3+, Pr3+, Nd3+) binary fluorides have been shown to correlate with the cation coordination numbers in their structures. Using this correlation, I have demonstrated that, with increasing LaF3 concentration, the cation coordination number in Sr1 −xLaxF2 +x ternary fluoride crystals (fluorite structure) increases from 8 to 11.

Inorganic Materials. 2019;55(1):77-80
pages 77-80 views

Distribution of Silica Particles in a Bilayer Arsenic Sulfide Fiber during Double-Crucible Drawing

Shabarova L.V., Snopatin G.E., Ketkova L.A., Kirillov Y.P., Churbanov M.F.

Abstract

This paper presents results of physical and computational experiments aimed at gaining insight into the behavior of silica impurity particles in two flowing contacting glass melts (core and cladding melts in the arsenic sulfide fiber drawing process). It has been shown that the particles present in the cladding melt are uniformly distributed, without passing into the core melt or concentrating at the interface between the two layers of the fiber. Theoretical calculations have been confirmed by experimental data.

Inorganic Materials. 2019;55(1):81-84
pages 81-84 views

Characteristic Features of Multilayer Photonic Bandgap Fiber Fabrication

Salganskii M.Y., Khopin V.F., Guryanov A.N., Bubnov M.M., Likhachev M.E.

Abstract

We have demonstrated a modified chemical vapor deposition (MCVD) process for the fabrication of multilayer photonic bandgap fiber based on high-purity silica glass. Sequential growth of layers differing in melting point has been shown to lead to distortion of the layers in the resulting photonic bandgap structure and a sharp rise in optical loss as a result of deviations from Bragg’s reflection conditions. By optimizing the chemical composition of the layers in the photonic bandgap structure, we were able to suppress excessive optical losses and reach the optical loss limit, which is only determined by the guidance properties of the photonic bandgap structure itself.

Inorganic Materials. 2019;55(1):85-89
pages 85-89 views

Delocalized-Atom Model and Properties of Sulfophosphate Glasses

Sanditov D.S., Badmaev S.S.

Abstract

The basic concepts of the delocalized-atom model have been shown to be applicable to low-melting-point sulfophosphate glasses and parameters of the model have been calculated. The parameters have been used to gain insight into the “atom delocalization” process in the glasses and assess their properties (viscosity, microhardness, glass transition temperature, and internal pressure). The results demonstrate that there is a linear correlation between the atom delocalization energy and glass transition temperature. The melt–glass transition is accompanied by the freezing of the atom delocalization process.

Inorganic Materials. 2019;55(1):90-95
pages 90-95 views

High-Pressure Magnetic and Transport Properties of Zn0.1Cd0.9GeAs2 + n wt % MnAs (n = 10 or 15) Nanocomposites

Arslanov R.K., Arslanov T.R., Zalibekov U.Z., Fedorchenko I.V.

Abstract

The magnetic susceptibility χ(T) of Zn0.1Cd0.9GeAs2 + n wt % MnAs (n = 10 or 15) ferromagnetic nanocomposites with a Curie temperature TC = 310 K has been measured as a function of temperature in the temperature range 270–350 K, and their resistivity ρ(p), Hall coefficient RH(p), and magnetization M(p) have been measured as functions of pressure near room temperature. The materials have been shown to undergo a pressure-induced ferromagnetic-to-paramagnetic phase transition, accompanied by a semiconductor–metal phase transition, at a hydrostatic pressure p ≈ 3.2 GPa and room temperature.

Inorganic Materials. 2019;55(1):96-100
pages 96-100 views

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