Teoretičeskie osnovy himičeskoj tehnologii

Media registration certificate: ПИ № ФС 77 - 83659 от 05.08.2022

Peer-review academic journal has been published since 1967.

Editor-in-chief

  • N.N. Kulov, Kurnakov Institute of General and Inorganic Chemistry of the Russian Academy of Sciences (Moscow).

Founders

  • Russian academy of sciences
  • Kurnakov Institute of General and Inorganic Chemistry of the Russian Academy of Sciences (Moscow)

Publisher

  • Russian academy of sciences

About the Journal

Theoretical Foundations of Chemical Engineering is a comprehensive journal covering all aspects of theoretical and applied research in chemical engineering, including transport phenomena; surface phenomena; processes of mixture separation; theory and methods of chemical reactor design; combined processes and multifunctional reactors; hydromechanic, thermal, diffusion, and chemical processes and apparatus, membrane processes and reactors; biotechnology; dispersed systems; nanotechnologies; process intensification; information modeling and analysis; energy- and resource-saving processes; environmentally clean processes and technologies.

Indexing: Russian Science Citation Index, CrossRef, Web of Science (translated version), Scopus (translated version).

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Volume 59, Nº 1 (2025)

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Articles

Experimental and theoretical bases of energy and resource efficient process of extraction of valuable component from natural matrix ores
Pochitalkina I., Kekin P., Vinokurova O., Meshalkin V., Kulov N.
Resumo

The material composition of nodule-type phosphorites is represented by the alpha-quartz ore rock of porous structure, phosphate matter with almost no pores, and admixture of layered aluminosilicates. As a result of sedimentary genesis of phosphate ores and matrix structure of alpha-quartz, its porous space is filled with the above components and their close mutual germination. The efficiency of known methods of phosphate ore beneficiation increases as the degree of their grinding increases and it is accompanied not only by the growth of energy consumption, but also by losses of fine fractions. The results of complex analysis of Bryansk phosphorite sample and, separated after completion of acid extraction of alpha-quartz, indicate the expediency of rational grinding of raw materials taking into account the technical characteristics of quartz sands used in the glass industry, which will provide energy and resource efficient processing. The revealed regularities of acid extraction of nodule-type phosphorite and mathematical processing of the data of the kinetic experiment indicate the possibility of using standard equipment of industrial schemes, with obtaining the main product – acid extract and the concomitant – alpha-quartz.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):3–9
pages 3–9 views
Anti-corrosion PEO-coatings impregnated with corrosion inhibitors on AMg3 alloy
Gnedenkov A., Sinebryukhov S., Kononenko Y., Gnedenkov S.
Resumo

Protective coating with microtubular structure was formed by plasma electrolytic oxidation on aluminum alloy AMg3 (Al–Mg system) in tartrate-fluoride electrolyte. This protective layer was additionally modified using azole group corrosion inhibitors (1,2,4-triazole, benzotriazole) and polymer (polyvinylidene fluoride). The morphology, composition, corrosion mechanism and protective properties of the formed coatings were studied.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):10–22
pages 10–22 views
Modeling of the processing of alkanthiols into disulfides using ionic liquids
Shinkar E., Tishkov A., Okhlobystin A., Berberova N.
Resumo

A functional model of environmentally safe and energy-saving technology for removal of toxic alcanthiols for their processing into practically useful disulfides using ionic liquids is proposed. The process is based on mediator electrooxidation of alcanthiols removed from liquid fuels by extraction with ionic liquids. The developed method of indirect electrosynthesis of symmetrical disulfides is realized under mild conditions, in the environment of electrically conductive ionic liquids, acting as a solvent and background electrolyte. The use of mediator contributes to the increase of electrosynthesis efficiency and reduction of energy consumption for its realization in comparison with the direct electrochemical oxidative transformation of alcanthiols into disulfides.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):23–33
pages 23–33 views
Optimization of plasma reactor for efficient generation of reactive oxygen species during water treatment for irrigation of plants
Mikhalev E., Morachevskaya E., Kamler A., Bayazitov V., Nikonov R.
Resumo

At present, there is a growing interest in the study of possible applications of plasma discharge water treatment technology in various industrial fields. The equipment considered in this work is based on the combined effect on water of plasma discharge and cavitation in flowing mode. The optimal design of the installation was determined. Many authors note the possibility of regulating the growth and development of plants of various crops as one of the promising applications of this technology. Previously, physicochemical processes occurring in water during plasma discharge treatment have been investigated, and the formation of reactive oxygen species (ROS), including hydrogen peroxide, in treated water has been noted. ROSs are actively involved in regulation of plant growth and development. Adjustment of the power of electric pulses supplied to the reactor of the plant allows controlling the generation of hydrogen peroxide. The aim of the work was to determine the most effective mode of water treatment to regulate the growth of lettuce variety “Tuscan” of the genus Lettuce of the Aster family (Lactuca sativa L.). When watering lettuce with water treated in the most effective mode, the dry weight of lettuce increased more than 2 times, and the ascorbic acid content increased by 40%.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):34–40
pages 34–40 views
Determination of velocity of constrainedconstrained motion of dispersed particles in sedimentation and bubbling processes
Trushin A., Ravichev L., Nosyrev M., Yashin V.
Resumo

Based on the models of effective viscosity and drift flow, semi-empirical dependences of the velocity of constrained motion of solid and gaseous particles on the volume fraction of dispersed phase at small values of Reynolds number were obtained, which have a high correlation coefficient with empirical data.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):41–46
pages 41–46 views
Non-stationarynon-stationarynon-stationary mass transfer in gel systems with graphene oxide as applied to 3d-bioprinting technologies
Khramtsov D., Moshin A., Pokusaev B., Nekrasov D., Zakharov N.
Resumo

The pattern of diffusion front propagation in pure agarose hydrogels as well as with the addition of graphene oxide was compared by the methods of moving boundaries and optical sensing, and the mass-transfer properties of the gel systems were measured. It was found that graphene oxide has high surface activity, becomes part of the mesh structure of the gel, increasing its porosity and thus affecting the diffusion rate and efficiency. In addition, graphene oxide contributes to the ordering of the gel structure or reduces light scattering within the gel. The combination of hydrogels with graphene oxide enables the creation of systems with controllable optical properties, which in turn opens up new opportunities for improving 3D-bioprinting technologies. Based on the random walk method, a numerical model is proposed that is well suited to describe the structures of hydrogels with graphene oxide. This model will help to determine the quality of materials in 3D-bioprinting technologies in terms of nutrient delivery efficiency for living microorganisms located inside the gel. The comparison of experimental data and numerical modeling demonstrated a good agreement between them.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):47–56
pages 47–56 views
Research into the possibility of gas utilization with different nitrogen content for ammonia production
Sosna M., Kovaleva D., Maksimova D., Kozlov A.
Resumo

The paper studies the possibility of ammonia production from natural gases ballasted with inert components on the example of nitrogen-methane mixture with nitrogen content from 0 to 43 vol. %. The processes of steam, autothermal conversion, steps of nitrogen-hydrogen mixture preparation and the process of ammonia synthesis on the basis of thermodynamic data are considered.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):57–61
pages 57–61 views
Ethane dehydrogenation in a membrane reactor with palladium alloy foil Pd–Ru with alumina-chromium catalyst at high temperatures
Babak V., Didenko L., Sementsova L., Kvurt Y., Zakiev S.
Resumo

Ethane dehydrogenation is one of the most important processes for ethylene production. The main regularities of this process have been studied in a membrane reactor with an industrial alumina-chromium catalyst and a Pd-6%Ru palladium alloy foil. The working part of the reactor consists of two cylindrical chambers separated by a membrane partition. The upper chamber is vacuumed and the lower chamber is kept at atmospheric pressure. It is known that hydrogen additives at the inlet prevent the formation of carbon deposits on the catalyst, so in this work the effect of these additives on the process was investigated. With uniform feedstock supply (ethane and hydrogen) along the outer perimeter of the lower chamber, the problem is reduced to finding the fluxes of ethane, ethylene, hydrogen and methane from the solution of a system of nonlinear ordinary differential equations. The temperature interval 600 K < T < 1000 K at small values of hydrogen and ethane flux ratios at the inlet is considered. The conditions under which hydrogen yield and ethane conversion reach 100% at maximum flux H2 through the membrane are found. Calculations are compared with experimental data.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):62–76
pages 62–76 views
Influence of diesel fraction feed rate on silicon removal by the protective layer catalyst
Petrov R., Reshetnikov S., Dick P., Golubev I., Noskov A.
Resumo

The influence of diesel fuel feed rate on silicon adsorption on NiMo/Al2O3-protecting layer catalyst during hydrotreating was studied. Straight-run diesel fraction containing decamethylcyclopentasiloxane additive in the amount of 200 million–1 as an additional source of silicon was used as a feedstock Three series of experiments of 60 hours duration each were carried out at specific feed rates equal to 0.75, 1.5 and 3.0 h–1. It was found that as the specific feed rate increases, the silicon content in the protective layer catalyst increases. To evaluate the efficiency of the adsorption process, the silicon recovery factor was used, which is equal to the ratio of the amount of adsorbed (extracted from the feedstock) silicon to the supplied during the time of the experiment. In the rate range of 0.75–3.0 h–1 , the silicon recovery factor decreased from 0.93 to 0.61 due to more intensive filling of active centers on the catalyst surface. The influence of external mass transfer on the silicon adsorption process was evaluated.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):77–85
pages 77–85 views
Crystallization and solubility of KSc(SO4)2 for improving the efficiency of scandium extraction
Medyankina I., Pasechnik L.
Resumo

In the development of methods for the efficient extraction and concentration of rare earth elements (REE), as well as for the removal of impurities of related metals, the solubility of salts, in particular sulfates, often used in hydrometallurgy as intermediates, is of great importance. In this work, the precipitation of complex potassium scandium sulfate KSc(SO4)2, whose crystals are elongated hexagonal prisms 5–10 μm wide and 20–50 μm long, was proposed for the extraction of scandium from sulfate solutions. The absence of crystallization water and the presence of a reversible phase transition around 447°C are shown by DTA method. The solubility of KSc(SO4)2 in water at 25°C was 0.28±0.01 wt.% Sc. A decrease in the solubility of KSc(SO4)2 was achieved by increasing the concentration of sulfuric acid (H2SO4) over 3–4 mol/L. Additional introduction of 0.5 mol/L K2SO4 reduces the solubility of scandium as a complex compound by an order of magnitude and increases the efficiency of scandium extraction from sulfate solutions. Experimental results on the solubility of KSc(SO4)2 are described by the change in the ionic strength of the solution in the presence of homonymous ions (K+ and HSO4). The degree of scandium extraction from sulfate solutions with the addition of 0.5 mol/L K2SO4 is more than 99%. The principal technological scheme of scandium extraction from red slimes with crystallization of KSc(SO4)2 is proposed. The results will be useful for the development of methods of metal separation at sulfuric acid processing of raw materials and expansion of methods for obtaining concentrates and pure metal oxides, as well as for studying the behavior of REE compounds close in properties.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):86–93
pages 86–93 views
Hydrodynamics and heat transfer on disk atomizer
Balchugov A., Sablina I., Antonov D., Kramarenko А.
Resumo

Experimental studies of new disk atomizers designed for water cooling by atmospheric air are carried out. Criterion equations for calculation of hydrodynamic and heat transfer characteristics of atomizers were obtained: radius, height and volume of atomizing torch, volumetric heat transfer coefficient. Efficiency of atomization on a disk with beads (disk No. 3) is greater than the volume of atomizing torch on a flat disk (disk № 1) in the whole investigated range of criteria Re and Kn. The conditions under which the atomizing disk with nozzles (disk No. 2) provides the most effective atomization of liquid and high intensity of heat transfer have been established. At Kn = 50 the critical value of Reynolds criterion will be Re = 277. The diagram for graphical determination of the area of values of criteria Re and Kn, in which the heat transfer intensity on disk No. 2 is higher than on disk No. 1, is proposed.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):94–101
pages 94–101 views
Cost-effective reconstruction of existing two-stream heat exchanger systems
Ulyev L., Gil T., Norin V., Kuvardina Е., Kondrashev D.
Resumo

This paper proposes a method for optimizing a two-stream heat exchange system, taking into account the technical limitations imposed by the heat exchange equipment and cost-effectiveness of the reconstruction project. Optimization of the heat exchanger network is performed taking into account the need for industrial safety expertise in case the design temperatures for the heat exchangers are exceeded by the process flows. This method was applied to optimize energy consumption at a real hydrocracking unit. Two types of heat exchangers were considered – shell-and-tube and plate heat exchangers for possible increase of heat exchange surface area in the existing heat recovery system. For shell-and-tube heat exchangers, the minimum present value of the reconstruction project is observed when the heat exchange surface is increased by 500 m2, which corresponds to the installation of a two-section heat exchanger. It allows to reduce specific consumption of hot utilities by 51%, and cold utilities – by 31%. However, the simple payback period of such a project is ~ 1.5 years. At the same time for plate heat exchangers the minimum annual costs are observed when the heat exchange surface is increased by 400 m2. The cost of such a modernization project is 18% less than for shell-and-tube heat exchangers, and the reduction of specific consumption of hot and cold utilities is 66% and 40%, respectively.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):102–117
pages 102–117 views
Vapor capture of molybdenum and tellurium oxides and their mixtures on ceramic block-cellular contact elements of optimized compositions
Salnikova O., Gasparyan M., Grunsky V., Davidkhanova M., Tsareva E.
Resumo

The efficiency of capture of individual molybdenum and tellurium oxides and their mixtures in a high-temperature oxidizing environment during chemisorption on ceramic highly porous block-cellular contact elements of optimized compositions is investigated. The dynamic sorption capacity of the contact elements with calcium oxide introduced into the composition of an aluminosilicate ceramic base, with an active layer of calcium oxide applied and without the use of calcium oxide, is determined. The chemisorption products of MoO3 and TeO2 by contact elements of all developed compositions were identified by X-ray phase analysis.

Teoretičeskie osnovy himičeskoj tehnologii. 2025;59(1):118–130
pages 118–130 views