Chemical Engineering / Kimya Mühendisliği
Permanent URI for this collectionhttps://hdl.handle.net/11147/14
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Article Citation - WoS: 8Citation - Scopus: 8Phase Equilibrium and Diffusion of Solvents in Polybutadiene: a Capillary-Column Inverse Gas Chromatography Study(John Wiley and Sons Inc., 2002) Cai, W. D.; Ramesh, N.; Tıhmınlıoğlu, Funda; Danner, Ronald P.; Duda, John Larry; De Haan, A.The capillary-column inverse gas chromatography method was used to measure the diffusion and partition coefficients of ethylbenzene, styrene, and acrylonitrile in polybutadiene (PBD) at infinite dilution of the solvents. Experiments were performed over a temperature range of 50-125°C. At temperatures well above the glass-transition temperature of PBD, the diffusivities were correlated using an Arrhenius expression. The Arrhenius parameters in turn were intercorrelated and shown to be a function of the occupied volume, thus providing a method for predicting the diffusion of other solvents in the same polymer. Further, the activation energy was predicted using the Duda-Vrentas free-volume approach. The activation energy thus obtained was compared with the activation energy of the Arrhenius approach. The weight-fraction activity coefficient data were compared to the predictions of the group contribution, lattice-fluid equation-of-state, and the UNIquac Functional-group Activity Coefficient (UNIFAC) free-volume models.Article Citation - WoS: 11Citation - Scopus: 13Sorption and Diffusion of Water Vapour on Edible Films(Springer Verlag, 2008) Berkün, Didem; Balköse, Devrim; Tıhmınlıoğlu, Funda; Alsoy Altınkaya, SacideTwo types of films consisting of sodium salt of carboxymethyl cellulose (NaCMC) and hydroxypropyl cellulose (HPC) as film forming materials and glycerin as plasticizer were prepared, characterized and their water vapour sorption properties were determined. The water sorption isotherms of the films were measured using a magnetic suspension balance. Results show that diffusion of water vapour in NaCMC based film is faster than that in HPC based films, due to the heterogeneous structure and larger pore dimensions of the NaCMC films.Article Citation - WoS: 18Citation - Scopus: 21Predicting Emission Characteristics of Volatile Organic Compounds From Wet Surface Coatings(Elsevier Ltd., 2009) Alsoy Altınkaya, SacideA mathematical model is developed to describe the emission characteristics of VOCs from homogeneous wet coating materials deposited on impermeable substrates. The model considers mass transfer in the material and in air, boundary layer resistance and the change in the coating thickness with time due to emission of VOC. Key features of the model are incorporation of concentration dependent VOC diffusion coefficients predicted from a physical model and nonlinear equilibrium isotherm at the coating/air interface. The model is applied to predict emission characteristics of MMA from acrylic based surface coatings. In an attempt to investigate the influences of equilibrium isotherm type and diffusion formalism on the predictions, simulations are performed with either constant or concentration dependent diffusivities and linear or nonlinear equilibrium isotherms. The lowest MMA concentration in air is predicted by incorporating the concentration dependent diffusivity and nonlinear equilibrium isotherm. The results suggest that assuming the diffusivity of MMA constant or equilibrium isotherm linear may lead to wrong conclusions about the emission rates from wet coatings. The model is general, fully predictive and can be used to predict emission rates of different VOCs from different coating materials if diffusion and thermodynamic parameters are available.Article Citation - WoS: 12Citation - Scopus: 17Diffusion Mechanism of Water Vapour in a Zeolitic Tuff Rich in Clinoptilolite(Springer Verlag, 2008) Çakıcıoğlu Özkan, Seher Fehime; Ülkü, SemraThe adsorption kinetics of H2O in a clinoptilolite rich zeolitic tuff was experimentally investigated at 18°C. In the identification of the diffusion mechanism the isothermal adsorption model equation was used. It was found out that the intraparticle mass transfer becomes more dominant over the heat transfer with increase in particle size and the adsorptive dose pressure. Although initially intraparticle mass transfer was the controlling resistance later external heat transfer also contributes to the transfer mechanism.Article Citation - WoS: 5Citation - Scopus: 5Solvent Sorption in a Polymer-Solvent System - Importance of Swelling and Heat Effects(Elsevier Ltd., 2006) Alsoy Altınkaya, Sacide; Ramesh, Narayan; Duda, John LarrySorption experiments are often conducted in gravimetric sorption columns where several deviations from ideal conditions could potentially occur. For example, heat effects due to solvent sorption, errors introduced due to concentration dependent diffusion coefficients and swelling are unavoidable. In this study, we develop a model to study the importance of the combination of these effects in obtaining diffusion coefficients from sorption experiments. The model is used to explore a wide range of operating conditions and physical parameters.Article Citation - WoS: 6Citation - Scopus: 7Solubility and Diffusivity of Methylmethacrylate and Butylacrylate Monomers in a Mma-Ba Copolymer(John Wiley and Sons Inc., 2007) Yürekli, Yılmaz; Alsoy Altınkaya, Sacide; Zielinski, John M.Mutual diffusion coefficients and sorption isotherms of methyl methacrylate (MMA) and butyl acrylate (BA) monomers in methyl methacrylate-butyl acrylate copolymer (MMA-BA) have been measured by gravimetric sorption. MMA is found to have higher solubility and diffusion rates in the copolymer than BA. Sorption data for MMA were interpreted using classical Flory-Huggins thermodynamic theory with a constant interaction parameter (χ). A modified version of this theory has been applied to correlate the sorption data of BA, which exhibit a temperature and concentration-dependent χ parameter. For MMA, the isotherm data reveal enhanced polymer-solvent interactions with increasing temperature, while for BA the data indicate a drive toward phase separation with increasing temperature. Despite the difference in thermodynamic behavior, both monomers are found to exhibit Fickian diffusion and the diffusivity data are correlated reasonably well with the Vrentas-Duda free volume theory. Some deviation between the free-volume correlation and the experimental data is observed at the lowest temperature and BA concentration examined.Article Citation - WoS: 2Citation - Scopus: 1Errors Associated With Swelling in the Analysis of Polymer-Solvent Diffusion Measurements(Elsevier Ltd., 2005) Alsoy Altınkaya, SacideSorption curves are generated from a mathematical model which includes the influence of the polymer swelling for unsteady-state sorption of a vapor or liquid by a polymer. To investigate the simultaneous effects of the specific volumes of the polymer-penetrant pair and the difference between the final and initial equilibrium concentrations on the sorption curves, statistical experimental design approach is used. Simulation results obtained from the numerical solution of model equations are utilized to estimate the error that would occur if one simply evaluates the diffusion coefficient using the traditional formulas derived from the analytical solution of the sorption equation. An empirical expression is developed that describes the effects of the difference between the final and initial equilibrium concentrations and the specific volumes of the polymer and the penetrant on the magnitude of error in diffusivity associated with the use of one of these traditional formulas so called the initial slope method. The predictive ability of the regression model is tested by performing additional simulations not used in the regression analysis.Article Citation - WoS: 4Citation - Scopus: 4A Chromatographic Study of Carbon Monoxide Adsorption on a Clinoptilolite-Containing Natural Zeolitic Material(Taylor and Francis Ltd., 2004) Narin, Güler; Yılmaz, Selahattin; Ülkü, SemraIn this study, the equilibrium and kinetic parameters for CO adsorption on clinoptilolite-rich natural zeolitic material were determined by the concentration pulse chromatography technique. Experiments were carried out at different column temperatures (60-120°C) and interstitial carrier gas velocities (3.1-16.3 cm/s) using a clinoptilolite-rich natural zeolitic material packed column. The equilibrium and kinetic parameters were determined by matching the moments of the experimentally obtained response curves to the parameters in the mathematical model. The Henry's Law constants were found to decrease from 700 to 49 with increasing temperature. The heat of adsorption at low coverage was found to be 50.73 kJ/molK. The contributions from external film, macropore, and micropore diffusion resistances to mass transfer were determined, and the micropore diffusion resistance was found to be the major contributor. The micropore diffusivity as a function of crystal radius (Dc/rc 2) was determined and found to change between 5.72 × 10-4 and 1.34 × 10-2 s-1 in the temperature range studied.Article Citation - WoS: 26Citation - Scopus: 28Influence of Swelling and Diffusion-Induced Convection on Polymer Sorption Processes(John Wiley and Sons Inc., 2002) Alsoy Altınkaya, Sacide; Duda, John LarryUnsteady-state sorption of a vapor or liquid by a polymer is modeled to include the influence of the moving phase boundary associated with the polymer swelling and diffusion-induced convection. A formulation presented clearly elucidates the influence of these two effects on the overall sorption process. Numerical solutions of the model equations indicate the errors that can be induced when swelling or convection are neglected. For most polymer-solvent systems, the influence of the diffusion-induced convection associated with volume changes in mixing can be neglected in the analysis of sorption processes. In contrast, the correction for the moving boundary or swelling of the polymer phase can be quite significant, particularly when a large step change in solvent concentration is considered.Article Citation - WoS: 17Citation - Scopus: 18Solvent Diffusion in Amorphous Polymers: Polystyrene-Solvent Systems(John Wiley and Sons Inc., 2000) Tıhmınlıoğlu, Funda; Danner, Ronald P.The inverse gas chromatography (IGC) technique was used to obtain the partition and diffusion coefficients of solvents in polystyrene over a wide range of temperatures. Infinite dilution experiments were performed with three solvents: toluene, benzene, and hexane. Finite concentration data were measured for the polystyrene-toluene system at various concentrations from 110 to 180 °C. For the finite concentration region, the modified capillary column model used by Tihminlioglu and Danner (J Chromatogr A 1999, 845, 93-101) was used to calculate diffusion and thermodynamic data. Finite concentration thermodynamic data were also calculated with the retention theory approach and compared with the capillary column model. The experimental IGC results are in good agreement with data from other experimental techniques.