Acesso aberto Acesso aberto  Acesso é fechado Acesso está concedido  Acesso é fechado Somente assinantes

Volume 52, Nº 3 (2018)

Article

Vapor–Liquid Equilibrium of Binary Components of the BrCF2COOCH3–CF3COOH–BrCF2COOH–CF3COOCH3 Quaternary System

Lupachev E., Zakhlevniy A., Kvashnin S., Lotkhov V., Kulov N.

Resumo

Vapor–liquid equilibria of binary components of the BrCF2COOCH3–CF3COOH–BrCF2COOH–CF3COOCH3 quaternary system have been studied experimentally at constant pressure. The experiments have been carried out on a modified Sventoslavskii ebulliometer. Using the Aspen Plus software package, the appropriate models have been selected and the vapor–liquid equilibria for six binary systems have been simulated.

Theoretical Foundations of Chemical Engineering. 2018;52(3):295-306
pages 295-306 views

Mathematical Modeling of the Cyclic Distillation of Binary Mixtures with a Continuous Supply of Streams to the Column

Krivosheev V., Anufriev A.

Resumo

A mathematical model for cyclic binary distillation in a sectioned column with a continuous supply of streams has been proposed. A method has been developed for organizing cyclic modes in a sectioned apparatus with the operation of one of the sections in the liquid flow mode and the other sections in the vapor flow mode. The effect of the parameters of the proposed model on separation in the column has been studied.

Theoretical Foundations of Chemical Engineering. 2018;52(3):307-315
pages 307-315 views

Mathematical Modeling and Control of the Mass-Transfer Process in Apparatuses with Continuous Phase Contact

Elizarov D., Shavaleev R., Elizarov V.

Resumo

The approximate solutions of the equations of steady- and unsteady-state mass transfer in apparatuses with continuous phase contact have been obtained and used as the basis of proposing a method for calculating packed apparatuses with turbulent liquid flow under gas displacement conditions. A method of estimating the longitudinal diffusion coefficient in a packed bed and a method of controlling the mass-transfer process in apparatuses with continuous phase contact have been developed.

Theoretical Foundations of Chemical Engineering. 2018;52(3):316-325
pages 316-325 views

Application of the Pulse Tracer Injection Method for Estimating the Mass Transfer Efficiency at Extremely Low Irrigation Densities for the Case of Structured CY Sulzer Packing

Bukin A., Ivanova A., Rozenkevich M., Pak Y., Marunich S.

Resumo

The liquid flow pattern of the countercurrent phase water isotope exchange process used for the removal of tritiated water vapor from gases has been studied via the pulse injection of a tracer into a liquid flow. A specific feature of this process is an extremely low water irrigation density in a column. Based on the performed experiments, the liquid holdups have been calculated and the liquid flow pattern has been determined. It has been demonstrated that the standard estimation of the longitudinal mixing effect on the masstransfer characteristics of this process has a limited character and may result in incorrect conclusions at a low irrigation density on packings.

Theoretical Foundations of Chemical Engineering. 2018;52(3):326-333
pages 326-333 views

Reaction-Diffusion Models with Delay: Some Properties, Equations, Problems, and Solutions

Polyanin A., Sorokin V., Vyazmin A.

Resumo

The delay reaction-diffusion models used in thermal physics, chemistry, biochemistry, biology, ecology, biomedicine, and control theory were reviewed. New exact solutions were obtained for several classes of one- and three-dimensional nonlinear equations with distributed parameters, in which the kinetic functions involve a delay. The qualitative features of these equations related to nonsmoothness and potential instability of solutions (these features should be taken into account in the mathematical modeling of the corresponding processes) were discussed. The properties of delay reaction-diffusion equations were described, which allow exact solutions to be obtained and multiplied. The key principles of construction, selection, and use of the test problems of the reaction-diffusion type were formulated, which can be used for evaluating the accuracy of rough analytical and numerical methods for solving the delay equations.

Theoretical Foundations of Chemical Engineering. 2018;52(3):334-348
pages 334-348 views

Mathematical Modeling of Methane Air Conversion on a Structured Porous Metal Catalyst

Shigarov A., Kirillov V., Kuzin N., Kireenkov V., Braiko A.

Resumo

A one-dimensional two-phase mathematical model of an ideal plug-flow reactor for methane air conversion on a Ni–MgO monolith catalyst on porous nickel was proposed. The model describes the methane air conversion as the result of three simultaneous reaction stages: methane deep oxidation, methane steam reforming, and reverse shift reaction. The effect of the external gas–solid mass transfer is taken into account in two variants: (i) independent diffusion and (ii) multicomponent diffusion for all mixture components. The results of modeling were used to analyze the experimental data (obtained in our previous work) on the dependence of the temperature of the front layer of the catalyst on the pressure and excess air coefficient. The best agreement between the calculation and experiment was obtained under conditions of complete external diffusion control of the exothermic stage for oxygen and the transition (between the kinetic and external diffusion) region of the endothermic stage, the kinetic effect of the endothermic stage being further limited by internal pore-diffusion resistance of the rate of this stage for methane.

Theoretical Foundations of Chemical Engineering. 2018;52(3):349-359
pages 349-359 views

Modeling of Separation of Granular Materials on Multiple-Deck Classifiers Using the Theory of Stochastic Processes

Akhmadiev F., Gizzyatov R.

Resumo

The mathematical model of the separation of granular materials on multiple-deck sieve classifiers has been constructed using the theory of Poisson processes and the model has been identified. The problem of the optimal implementation of the process in multicriterial setting has been formulated and solved; the engineering simulation of the classifier has been performed using this solution.

Theoretical Foundations of Chemical Engineering. 2018;52(3):360-370
pages 360-370 views

The Recovery of Hydrogen from Binary Gas Mixtures Using a Membrane Module Based on a Palladium Foil Taking into Account the Deactivation of the Membrane

Babak V., Didenko L., Kvurt Y., Sementsova L.

Resumo

The recovery of hydrogen from binary gas mixtures with active (deactivating the surface of the membrane) and passive impurities has been studied. Experiments have been carried out on a multifunctional membrane module, the operating area of which consists of gas chambers separated by a thin foil palladium membrane. A dimensionless coefficient of the deactivation of the surface of the membrane has been introduced. An analytical formula has been obtained for the hydrogen flux from binary mixtures at its preset pressures on the opposite sides of the membrane that takes into account adsorption–desorption, breaking to protons on the surface, the diffusion of the latter in the metal lattice, and the recombination of Н+. In the case when the condition are fulfilled, the Н2 flux can be calculated by the modifiable Sieverts equation. This equation and an assumption about the complete mixing of the mixtures in the chambers of the membrane module have made it possible to develop a theoretical model for the recovery of hydrogen from binary mixtures in the membrane module. An analytical dependence for the Н2 flux as a function of the fluxes of the mixtures at the inlet of the chambers, ratio of the pressures on the opposite sides of the membrane, initial composition of the hydrogen mixture, and the coefficient of deactivation has been found. Utilizing this dependence, a procedure for finding this coefficient using additional experiments has been proposed. As an example, the coefficients of deactivation for the products of steam reforming of methane (CO, СО2, СН4, and water vapor) have been calculated for a palladium membrane with a composition Pd–6%Ru. The theoretical model has been subjected to the experimental verification on Н2–5%CO and Н2–20%CO binary mixtures.

Theoretical Foundations of Chemical Engineering. 2018;52(3):371-385
pages 371-385 views

Optimal Process Parameters of the Synthesis of Lactic Acid by Continuous Fermentation

Gordeeva Y., Borodkin A., Gordeev L.

Resumo

A generalized mathematical model has been used to assess the technological parameters of the continuous fermentation process of preparation of lactic acid under optimal conditions. The model takes into account all types of inhibition, such as inhibition by the biomass, substrate, and product. Equations for calculating the process parameters have been obtained that are included in the calculation sequence algorithm. The algorithm peculiarities include the requirement of supplementing the raw data by the data obtained during the calculation process (interactive mode). The algorithm takes into account the necessary restrictions, noncompliance with which may lead to the results that do not meet the conditions required to implement the process. For the same value of the production efficiency with respect to the target product, there are multiple values of the S0s and M0s starting parameters (concentration values at the fermenter entry) under the optimal conditions. Limits of the multiplicity existence have been determined. The numerical values of the constants given in the scientific literature for studying the particular mathematical models have been used in the practical calculations.

Theoretical Foundations of Chemical Engineering. 2018;52(3):386-392
pages 386-392 views

Flow Modes of Non-Newtonian Fluids with Power-Law Rheology in a T-Shaped Micromixer

Lobasov A., Minakov A., Rudyak V.

Resumo

The flow and mixing modes of non-Newtonian fluids in a T-shaped micromixer were studied by numerical simulation in the range of Reynolds numbers 1–250. The non-Newtonian fluid was described using the power-law model. The exponent n was varied: 0.3, 0.5, and 0.8. The mixing efficiency and pressure drop in the channel were correlated with the exponent n and Reynolds number. The exponent n was shown to significantly affect the flow structure before and especially after the transition from symmetric to asymmetric flow modes.

Theoretical Foundations of Chemical Engineering. 2018;52(3):393-403
pages 393-403 views

Viscosity of Structured Disperse Systems

Kelbaliyev G., Rasulov S., Mustafayeva G.

Resumo

A generalized viscosity equation has been proposed for structured disperse systems with their peculiar rheological properties. Some characteristic features of the viscosity curve have been revealed at the beginning of structuration. Different variants of viscosity equations for structured disperse systems have been considered, and their comparison with the experimental data has been performed. The possibilities of estimating the porosity and shear viscosity of structured media with a fixed layer of particles have been demonstrated.

Theoretical Foundations of Chemical Engineering. 2018;52(3):404-411
pages 404-411 views

State-Of-The-Art Review of Papers Presented at the Symposium “Modern Energy- and Resource-Saving Technologies MERST-2017” Held within the International Scientific and Technical Forum “First International Kosygin Readings “Current Topics in Engineering Sciences””

Gulyaev Y., Belgorodskii V., Kosheleva M.

Resumo

This review analyzes papers presented at the symposium “Modern Energy- and Resource-Saving Technologies MERST-2017,” which was held within the International Scientific and Technical Forum “First International Kosygin Readings “Current Topics in Engineering Sciences.”” The presented papers have considered the key problems of energy and resource conservation in modern chemical, thermal, and mass-transfer processes, the priority directions of the implementation of energy-efficient and resource-saving environmentally safe technologies, innovations in energy and resource conservation, alternative energy, current topics in import substitution, the quality of the target products, and other issues. The place, role, and tasks of engineering sciences in the modern Russian society have also been discussed.

Theoretical Foundations of Chemical Engineering. 2018;52(3):412-415
pages 412-415 views

Enhancement of Hydrogen Production by Fluidization in Industrial-Scale Steam Reformers

Abbasi M., Farniaei M., Abbasi S.

Resumo

In this paper, the effect of the fluidization concept on the performance of methane steam reforming has been investigated by comparing a fluidized-bed steam reformer (FBSR) with an industrial-scale conventional steam reformer (CSR). Also, a fluidized-bed thermally coupled steam reformer (TCFBSR) and a fixed-bed thermally coupled steam reformer (TCSR) have been compared. In thermally coupled reactors, the hydrogenation of nitrobenzene to aniline exothermic reaction is employed. A steady state one dimensional heterogeneous model is applied to analyze methane conversion and hydrogen production for steam reforming of methane in different reactors (CSR, FBSR, TCSR, and TCFBSR). The modeling results show that, in FBSR, hydrogen production and methane conversion are increased by 2.13 and 0.52%, respectively, in comparison with CSR. Also, by using fluidized catalysts instead of fixed ones in TCSR, methane conversion and hydrogen yield are increased from 0.2776 to 0.2934 and from 0.9649 to 0.9836, respectively. These improvements represent the appropriate effect of the fluidization concept on the enhancement of hydrogen production in different steam reformers.

Theoretical Foundations of Chemical Engineering. 2018;52(3):416-428
pages 416-428 views

Neural Network Modeling and Experimental Study of Radon Separation from Water

Mirzaie M.

Resumo

Against the improvement of science and technology, earthquake is one of natural disasters that human cannot predict. Researchers indicated that there are many earthquake precursors. One of these precursors is a change in radon concentration in thermal waters about of active faults. Most of radon monitors cannot detect radon concentration in water directly, and they can detect radon concentration in air. Therefore, radon molecules should be separated from water and transferred to air. In this study, a bubbling system was used for the transfer of radon from water to air. Mathematical and neural network modeling of this system has been performed. The time constant parameter as an indicator of the separation rate was less than 20 min in most of experimental conditions. After validation of the models with experimental data, the effects of water and air flow rates and water temperature on the speed response of this system have been studied.

Theoretical Foundations of Chemical Engineering. 2018;52(3):429-437
pages 429-437 views

Prediction of the Phase Behavior of Hyperbranched Polymer Solutions by the Group Contribution Method

Ebrahimizadeh J., Pazuki G.

Resumo

The purpose of this study is to predict the phase behavior of systems containing hyperbranched polymers by using a thermodynamic model based on the group contribution method, UNIFAC-FV, and considering an association term for the hydrogen bonding effect. After checking the validation of the model vapor-liquid equilibrium (VLE), bubble-point and liquid-liquid equilibrium (LLE), the cloud points for binary and ternary systems with different solvents were estimated from the proposed model. Furthermore, the activity of solvents in infinite dilution was predicted by this model. The results showed that the proposed model can estimate the phase behavior of solutions containing hyperbranched polymers with a good accuracy.

Theoretical Foundations of Chemical Engineering. 2018;52(3):447-458
pages 447-458 views

Velocity Evolution for the Coalescence of Two In-Line Bubbles Rising in Non-Newtonian Fluids

Zhu C., Li S., Fu T., Ma Y.

Resumo

This study experimentally investigates velocity evolution for the coalescence of two in-line bubbles rising in non-Newtonian fluids by using a high speed camera. Due to the wake of the leading bubble and the shear-thinning effect of non-Newtonian fluids, the following bubble is accelerated to approach the leading bubble, leading to the coalescence of the two bubbles. Based on the Newton’s second law and Schlichting’s wake theory, a theoretical model was developed to estimate the instantaneous rising velocity of the following bubble in the coalescence process of the two bubbles. The predicted values by the present model showed a good agreement with the experimental data.

Theoretical Foundations of Chemical Engineering. 2018;52(3):459-464
pages 459-464 views

Thermodynamic Analysis of Single Reservoir Filling Process of Hydrogen Vehicle

Deymi-Dashtebayaz M., Farzaneh-Gord M., Rahbari H.

Resumo

The accurate modeling of the fast-fill dynamics occurring in hydrogen fueled vehicle storage cylinders is a complex process, and to date those dynamics have not been thoroughly studied. In this paper, based on the first and second laws of thermodynamics, conservation of mass and real gas assumptions, a numerical method has been developed to study the fast filling process of the hydrogen vehicle’s cylinder. Thermodynamic properties' table has been employed for the case of the real gas model. The model has been applied for a single reservoir tank. The results indicate that there is a temperature rise on the order of 100 K or more during the charging process. The results also indicate that ambient temperature has a strong effect on the filling process and final hydrogen cylinder conditions.

Theoretical Foundations of Chemical Engineering. 2018;52(3):465-472
pages 465-472 views

Performance Improvement of Various Kinetic Hydrate Inhibitors Using 2-Butoxyethanol for Simple Gas Hydrate Formation in a Flow Mini-Loop Apparatus

Talaghat M., Bahmani A.

Resumo

The effect of 2-butoxyethanol as an additive on simple gas hydrate formation in the presence of kinetic hydrate inhibitors such as modified starch, polyvinylcaprolactam, and Gaffix VC-713 under various conditions in a flow mini-loop apparatus has been studied. A laboratory flow mini-loop apparatus has been designed and manufactured to measure the induction time of simple gas hydrate formation. Hydrate formers (such as C1, C2, C3, i-C4, and CO2) are contacted with water containing dissolved inhibitor in the presence of 2-butoxyethanol as an additive at desired temperature and pressure. The effect of 2-butoxyethanol on the induction time during gas hydrate formation was investigated in the presence and absence of modified starch, polyvinylcaprolactam, and Gaffix VC-713 as kinetic inhibitors. Results show that the induction time is prolonged in the presence of Gaffix VC-713 compared to polyvinylcaprolactam and modified starch as inhibitors. Moreover, the induction time in the presence of 2-butoxyethanol is greater than in the absence of this additive for simple gas hydrate formation. As a result, the performance of kinetic hydrate inhibitors was enhanced in the presence of 2-butoxyethanol for natural gas components during gas hydrate formation.

Theoretical Foundations of Chemical Engineering. 2018;52(3):438-446
pages 438-446 views