


Vol 43, No 2 (2017)
- Year: 2017
- Articles: 13
- URL: https://journals.rcsi.science/1087-6596/issue/view/13439
Article
Modeling of self-organization in crystal-forming systems: Symmetry and topology codes of cluster self-assembly of icosahedral structure Sc12B185C9 (P6/mmm, hP212)
Abstract
Modeling of the cluster self-assembly of icosahedral structure of Sc12B185C9 (P6/mmm, hP212, V = 1641.7 Å3) boride has been performed. The suprapolyhedral cluster-precursor of the crystal structure Sc12B185C9 containing 84 boron atoms that consists of the hexagonal antiprism apr-B12 (with the 6mm symmetry), which represents a template that links six В12 icosahedra followed by ring formation, has been determined for the first time. The symmetry and topology codes of the self-assembly of the crystal structure of nanoclusters-precursors represented by the primary chain S31→ microlayer S32→ microframework S33 have been rebuilt. The assembly of the primary chain from B84 clusters is characterized by their maximum possible degree of complementary binding corresponding to 18. There are 12 Sc atoms in the ring between clustersprecursors. The atoms of B (CN = 6) and C (CN = 4) bind the apr-B12 polyhedra to form В3 and С3 rings (with two equally likely variants of their arrangement). The double distance between the centers of B84 clusters-precursors determines the value of the translation vector c = 8.954 Å. Microlayer S32 is formed by binding parallel short chains with the participation of the Sc atoms; the B7 and C2 clusters are localized between the chains. The distances between the axes of the primary chains in the microlayer determine the magnitude of the translation vector a = 14.550 Å. The microframework is formed during the packing (with a shear) of microlayers according to the identical mechanism of the local binding of the primary chains. There are six equivalent primary chains in the macrocrystal structure in the local environment of the primary chain (a = b =14.550 Å). The predominant growth of monocrystals as rods and thin needles occurs on the direction of the assembly of the primary chain. The structural formula of Sc,C-boride with the precipitation of the framework- forming polyhedra and cluster structures that are formed in the voids is the following: Sc12B185C9 = Sc12[(ico-B12)12(apr-B12)2(B7)2(B3)(C3)(C2)3].



Development of works on creating coatings to protect carbon materials at high temperatures (a review of the works performed at Grebenshchikov Institute of Silicate Chemistry, Russian Academy of Sciences)
Abstract
The review is based on the works by employees of the Grebenshchikov Institute of Silicate Chemistry of the Russian Academy of Sciences (RAS). Approaches to the formation of glass-ceramic coatings on graphite have been considered from preliminarily molten glass and filler, from the mixture of initial components not containing glass during synthesis, and from silicon- and boron-containing compounds yielding a glass-forming melt upon thermal treatment in air. These works served as the basis for creating coatings of a new type.



Kinetics of stepwise bulk crystallization of AsSe1.5Snx (x ≤ 0.28) glasses
Abstract
The kinetics of stepwise transformations during bulk isothermal crystallization of semiconducting AsSe1.5Snx (x = 0.13, 0.20, 0.28) glasses has been studied in the temperature range of 210−310°С using 119Sn Mössbauer spectroscopy, XPA, and the density and microhardness measurements of the quenched specimens. The kinetics of the gross bulk crystallization of glasses have been analyzed according to the data on density measurement using the Kolmogorov–Avrami equation, which was generalized on stepwise and incomplete isothermal transformations.



Physical–chemical properties and conductivity of Na2O–SnO2–SiO2 glass systems
Abstract
The effect of tin(IV) oxide on the conductivity and chemical stability of sodium–silicate glass has been studied for five different glass compositions. Dilatometry and DSC were used to investigate the thermal behavior of the glass. The research into transport characteristics of the glass has shown that its conductivity is in the range of 2 × 10–8–5 × 10–7 S/cm at 25°C and 10–3 S/cm at 300°C.



Influence of gamma radiation and action of neutrons on photoluminescence and the microhardness of barium silicate glass
Abstract
The influence of nanocrystals on the optical centers of barium silicate glass has been studied experimentally. It is found that, when glass is irradiated in the thermal column of an atomic reactor or in a gammasource 60Cо, the phase transformation of SiO2 nanocrystals (crystoballite into tridymite) and BaO into BaO2 and BaSiO3 occurs, which creates a brown coloration, reduction in the microhardness, and weakening of the luminescence intensity.



Electron exchange between dopant iron sites in glass films of arsenic selenide
Abstract
Using the method of Mössbauer spectroscopy, the electron exchange between the neutral and ionized iron dopant sites in glass films of arsenic selenide modified by iron, which gives rise to changes in both the electronic density and the tensor of the electric field gradient on the nuclei of the iron atoms, is investigated.



Features of the formation of nanoporous membranes based on alumina from foil and new fields of applications
Abstract
The peculiarities of the formation of porous membranes based on aluminum oxide obtained by the electrochemical anodization of aluminum foil with the preset topological parameters of pores-capillares (20–220 nm) have been studied. The methods to study the membranes based on nanoporous aluminum oxide are proposed. The developed nanoporous material possesses the properties of screening IR radiation in a spectral range of 8–14 μm (corresponds to the spectral region of thermal radiation of bioobjecs). The membranes based on anodized aluminum foil provide the fulfilling the functions of channeling a high-flow helium ions with an energy of 1.5–2 MeV with the experimentally found coefficient of transmission of more than 60%.



Effect of the thermal treatment on the phase composition of the surface of coatings based on Si–B–ZrB2 and modified with ZrO2 fibers
Abstract
Coatings on graphite that are stable to oxidation and based on the silicon–boron–zirconium boride composite containing from 5 to 50% of fibrous zirconium dioxide as a modifying dopant have been produced by the suspension–annealing method. A nonporous layer is formed at the zirconium dioxide content ranging from 5 to 15%, while a porous layer is formed at its 50% content. A glass-forming melt, as well as zirconium dioxide and silicate, is formed during thermal treatment as a result of the chemical reactions with the oxygen in air. The zirconium silicate content increases, along with the modifier’s concentration and temperature.



Highly porous thermal insulation material based on liquid glass
Abstract
The studies show that liquid glass, due to its high adsorption capacity and low bloating temperature, can be used to manufacture thermal insulation materials. The synthesis methods for highly porous materials by the low-temperature bloating of liquid glass and a filler were proposed for the first time. The proposed techniques contribute to the uniform bloating throughout the volume and the homogeneity of the thermal insulation material for the equipment and pipelines.



Aromatic polyamidoimides modified with hydrosilicate nanoparticles of different structure and morphology for membrane technologies
Abstract
New organic–inorganic composites based on aromatic polyamidoimide with ribbon-like particles of fibrous triple chain Na2Mg4Si6O16(OH)2 hydrosilicate have been obtained with the subsequent characterization of their structure, morphology, and transport properties. A comparative analysis of polyimide composites with ribbon-like Na2Mg4Si6O16(OH)2 hydrosilicates and tubular Mg3Si2O5(OH)4 hydrosilicate nanoparticles has been implemented.



Short Communications
Specifics of light scattering and optical anisotropy of boron oxide melt
Abstract
It is shown that the relaxation of the isotropic light scattering intensity by boron oxide melt, which is connected with a decrease in its magnitude after a temperature jump, is synchronized with the effect of changing the polarization state of the excitation light beam passed through the sample under investigation. The formation of macroscopic elastic stresses in the sample bulk could be one of the possible reasons for the development of the detected phenomenon.



Structural heterogeneity of SiO2–Na2O–Al2O3 glass
Abstract
It is shown that the phase heterogeneity of SiO2–Na2O–Al2O3 glass has a liquation and crystallization nature, the balance between which is determined by the conditions of their synthesis. An increase in the aluminum oxide content decreases the number of liquation and crystallization sites, and also the linear sizes of the crystalline formations without eliminating the phase separation due to the liquation. The area of metastable immiscibility in the SiO2–Na2O–Al2O3 system, which is determined by scanning electron microscopy, is probably wider than the area detected by the optical methods.



Electron microscopical study of lead(II) sulfide implanted into a glassy biopolymer matrix
Abstract
Thin-layer glassy biopolymer matrix implants obtained as a result of the contact of lead(II) hexacyanoferrate( II) Pb2[Fe(CN)6] with an aqueous alkaline solution of ethanedithioamide (dithiooxamide) H2N—C(=S)—C(=S)—NH2 have been studied by high-resolution scanning electron microscopy. It is shown that lead (II) sulfide PbS nanoparticles with sizes of up to 50 nm are formed in accordance with the theoretical hypotheses.


