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  • Articles  (6,507)
  • Chemistry  (6,507)
  • Polymer and Materials Science  (2,524)
  • Wiley-Blackwell  (6,507)
  • Blackwell Publishing Ltd
  • 1990-1994  (6,507)
  • Process Engineering, Biotechnology, Nutrition Technology  (6,507)
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  • Articles  (6,507)
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  • Wiley-Blackwell  (6,507)
  • Blackwell Publishing Ltd
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  • 1
    Electronic Resource
    Electronic Resource
    Hoboken, NJ : Wiley-Blackwell
    AIChE Journal 36 (1990) 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 2
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    Hoboken, NJ : Wiley-Blackwell
    AIChE Journal 36 (1990), S. 13-18 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Flow-induced crystallization experiments are made in a capillary apparatus modified with a downstream reservoir under pressure. Capillary length, diameter, and entrance angle are changed, as well as flow rate. The results show that the crystallization temperature is influenced both by the elongational flow at the capillary entrance and by the shear flow along the capillary. The independent effect of the pressure equals that obtained under static conditions. The effect of shear is correlated in terms of shearing work.
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  • 3
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    AIChE Journal 36 (1990), S. 3-12 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A method to calculate the compression zone height in continuous thickeners is presented. With this method, it is necessary to know the variations of the pulp-supernatant interface and the sediment height vs. time in a batch test. This method is discussed considering the following aspects: relationship between the settling rate of solids and their concentration in the settling zone; and the compression of solids due to the squeeze transmitted by the upper layers - unbuoyed weight of particles minus force of friction due to the Darcian flow. When the variation of the sediment height vs. time becomes linear, it is possible to calculate the maximum solids concentration which can be reached by sedimentation. The change of the solids matrix permeability and its influence on the method proposed are also analyzed.
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  • 4
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    Hoboken, NJ : Wiley-Blackwell
    AIChE Journal 36 (1990), S. 29-38 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A kinetic model is developed for the drying of solids in fluidized beds, assuming a falling rate period following a constant rate period. Experimental data obtained using batch and continuous single and spiral fluidized beds are satisfactorily matched with the assumed drying kinetics and the residence time distribution of solids appropriate for the type of dryer.
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  • 5
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    AIChE Journal 36 (1990), S. 53-65 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The backfill cycle in the pressure swing adsorption (PSA) separation of air to produce an enriched oxygen product using a zeolite 5A molecular sieve was studied theoretically and experimentally. The effects of the backfill cycle, cycle configuration, backfill rate, pressurisation rate, and product rate were studied. The theory agreed well with the experimental results in predicting the product oxygen concentration over a wide range of backfill pressures, thus giving a basic understanding of the bed dynamics of the backfill cycle. The theory showed that the backfill rate and adsorption capacity of the adsorbent were the most important parameters governing the efficiency of the PSA process. We showed that, given an adequate backfill pressure, a separate pressurization step could be omitted by incorporating it with the product release step with no detrimental effect on the product oxygen concentrations while increasing adsorbent productivity.
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  • 6
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    AIChE Journal 36 (1990), S. 93-105 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Bubble sizes were measured for molten wax-nitrogen systems using photography and dynamic gas disengagement. The effects of operating conditions, system geometry and wax type were studied in 0.05- and 0.23-m-diameter by 3-m-tall bubble columns. Both techniques were used with FT-300 wax, while only the dynamic gas disengagement technique could be used with reactor waxes due to their dark color. For FT-300 wax, Sauter mean diameters obtained from photographs taken near the column wall were significantly lower than those obtained from photographs taken near the center. The ds values obtained from dynamic gas disengagement and photographic (near the column center) methods, for this noncoalescing medium, were in the range 0.5-1.6 mm in the large-diameter column. For reactor waxes, ds values were significantly higher (1-2 mm for Sasol and 1-5.5 mm for Mobil's reactor wax) and are in agreement with results reported in earlier studies with similar waxes (ds = 2-4 mm), where different experimental techniques (light transmission or hot wire anemometry) were employed.
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  • 7
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    AIChE Journal 36 (1990), S. 132-136 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 8
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 9
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    AIChE Journal 36 (1990), S. 175-186 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A model has been developed for steady polymer melt blowing. This model includes the dominant effect that the forwarding air has upon the process. Inertial, gravitational and heat transfer effects are also included. The model equations are solved numerically with both Newtonian and viscoelastic (Phan-Thien and Tanner) constitutive equations. The predicted results compare favorably with actual experimental data.
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  • 10
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    AIChE Journal 36 (1990), S. 227-232 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Instantaneous chemical reactions, either themselves or together with chemical indicators, have previously been used as probes of turbulent micromixing. Both methods obtain statistics of the micromixing from measurement of time mean quantities. The mean reactant concentration, which is the quantity measured in the instantaneous reaction method, is shown here to be the integral with respect to feed concentration ratio of the mean color density, which is the quantity measured in the chemical indicator method. Differentiation of the mean color density gives the scalar probability density while integration gives the mean reactant concentration. Measurements of the color density of bromothymol blue at the centerline of a turbulent jet of base mixing with acid are used as an example.
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  • 11
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    AIChE Journal 36 (1990), S. 287-290 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 12
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    AIChE Journal 37 (1991), S. 111-122 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The time-averaged void fraction, pressure drop and flow regime transition behavior of horizontal air-water two-phase flows is studied experimentally and numerically for 2-cm-inner-diameter tubes with various flow dividing junctions at its end. The time-average void and pressure drop behavior along the channel is simulated using a two fluid separated flow model. The results show that two-phase behavior (flow regime, void fraction, and pressure drop) is affected strongly by the presence of a flow division in the system. These effects extend far upstream of the junction for low-momentum flows and far downstream for high-momentum flows. Both numerical and experimental results show that there occurs a large increase in void just downstream of the junction owing to the halving of the fluid volume flow rates and the liquid deceleration.
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  • 13
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    Hoboken, NJ : Wiley-Blackwell
    AIChE Journal 37 (1991), S. 137-141 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 14
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    Hoboken, NJ : Wiley-Blackwell
    AIChE Journal 37 (1991) 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 15
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    AIChE Journal 37 (1991), S. 169-181 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Nonequilibrium diffusion behavior in nonionic and ionic surfactant microemulsion systems has been studied experimentally using the open-ended capillary method. Experimental results for these systems have been compared with a drop theory of diffusion for microemulsions under conditions where large concentration and electrostatic gradients exist. The results show good agreement in concentration profiles between theory and experiment for the microemulsion components - water, benzene, and phenol. Furthermore, under certain conditions the theory predicts that over a limited time interval phenol will diffuse from low-concentration regions to regions of higher concentration. This phenomenon has been observed.
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  • 16
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    AIChE Journal 37 (1991), S. 225-232 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Three parametric sensitivity criteria were examined for application to a pseudohomogeneous tubular reactor system, in which both methanol dehydration (exothermic) and methanol dissociation (endothermic) were catalyzed. The addition of the endothermic reaction was shown to lead to a desensitized reactor. It was illustrated, however, that the relative activities of the two catalysts should be somewhat similar to maintain the overall conversion of the resulting reactor for a given residence time.The three criteria investigated tended to disagree with one another more, as the system was made less sensitive by the addition of more endothermic catalyst. A potential application of the resulting nonsensitive reactor design would be in methanol-fueled vehicles.
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  • 17
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    AIChE Journal 36 (1990), S. 473-477 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: No Absract.
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  • 18
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    AIChE Journal 36 (1990), S. 523-538 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Detailed knowledge of solids circulation, bubble motion, and frequencies of porosity oscillations is needed for a better understanding of tube erosion in fluidized bed combustors. A predictive two-phase flow model was derived starting with the Boltzman equation for velocity distribution of particles. The model is a generalization of the Navier-Stokes equations of the type proposed by R. Jackson, except that the solids viscosities and stresses are computed by simultaneously solving a fluctuating energy equation for the particulate phase. The model predictions agree with time-averaged and instantaneous porosities measured in two-dimensional fluidized beds. Observed flow patterns and bubbles were also predicted.
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  • 19
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    AIChE Journal 36 (1990), S. 559-564 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The diffusion of 1,3,5 tri-tert-butylbenzene (TTB) into cylindrical γ-alumina extrudates of varying micropore diameter and macropore volume has been studied by NMR spectroscopy. The proton NMR signal of the methyl proton of TTB in the micropores of the alumina extrudate was found to be well resolved and shifted upfield relative to that in the bulk liquid by 0.55 ppm. The area under the shifted peak is proportional to the liquid concentration of TTB in the micropores. The change in the intensity of this peak as a function of time and measurements of the amount of TTB absorbed on the surface alumina at equilibrium were used to calculate the effective diffusivity of TTB in each extrudate. Measured values of the effective diffusivity are in reasonable agreement with predictions using correlations in the literature. These observations suggest a new method for measuring the liquid-phase effective diffusivity in porous materials.
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  • 20
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    Hoboken, NJ : Wiley-Blackwell
    AIChE Journal 36 (1990), S. 623-626 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 21
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    AIChE Journal 36 (1990), S. 630-632 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 22
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 23
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    AIChE Journal 36 (1990), S. 665-676 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Growth and dissolution of succinic acid crystals have been studied in an isothermal stirred tank crystallizer. Seeded desupersaturation and deundersaturation experiments have been performed. Parameters of a desired growth rate equation are estimated by fitting the supersaturation balance equation directly to the supersaturation measurements. The procedure is based on nonlinear optimization techniques. Thus, uncertainties in the traditional approximation of the concentration vs. time curve are circumvented. The growth process for succinic acid crystals in an aqueous solution is found to be controlled by a significant resistance in both the volume diffusion step and in the surface integration step. An implicit equation is given to accurately represent the crystal growth rate as a function of the supersaturation. When extrapolating outside the range of experiments, this equation is shown to predict growth rates that are significantly different from those predicted by a corresponding power law expression. The dissolution rate exhibits a nonlinear dependence on undersaturation which is interpreted as changes in the crystal shape. Initial dissolution rate coefficients are in good agreement with volume diffusion coefficients obtained from growth experiments.
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  • 24
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    AIChE Journal 36 (1990), S. 710-724 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A linear stability analysis of multilayer plane Poiseuille flow of Oldroyd-B liquids with shear rate dependent viscosities is performed for an arbitary number of layers. Asymptotic solutions at long wavelengths and numerical solutions at wavelengths of O(1) are obtained for two-dimensional infinitesimal disturbances. The asymptotic solutions are identical for viscoelastic and Newtonian liquids in two- and three-layer flows, except for nearly geometrically symmetric configurations in three-layer flows. Multilayer flows of viscoelastic liquids can be stable at all wavelengths; thus, operating diagrams of stable flows can be constructed. Symmetric and nearly symmetric configurations in three-layer flows are unstable when the core layer is more viscous than the cuter layers. For highly elastic liquids, stability is not influenced by elasticity, whereas shear thinning always destabilizes the flow. The analysis provides guidelines to avoid interfacial instabilities, which originate inside dies of multilayer extrusion.
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  • 25
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    AIChE Journal 36 (1990), S. 765-772 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Void fraction and friction pressure drop measurements were made for an adiabatic, vertical two-phase flow of air-water across two horizontal, in-line, 5 × 20 rod bundles, one with a pitch-to-diameter ratio, P/D, of 1.3, the other 1.75. For both bundles the average void fraction showed a strong mass velocity effect and values were significantly less than those predicted by a homogeneous flow model. All void fraction data were found to be well correlated, with no P/D effect, using the dimensionless gas velocity, j*g. The two-phase friction multiplier data exhibited a strong effect of P/D and mass velocity, however, the data for both bundles could be well correlated with the Martinelli parameter for G 〉 200 kg/m2s. The correlations developed for void fraction and two-phase friction multiplier were successfully tested in predicting the total pressure drop in boiling freon experiments.
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  • 26
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    AIChE Journal 36 (1990), S. 789-793 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 27
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    AIChE Journal 36 (1990), S. 801-804 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 28
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    AIChE Journal 36 (1990), S. 677-684 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Gas-agitated liquid-liquid dispersions arise in applications as diverse as direct hydrogenation processes for bitumen and coal, and the manufacture of iron and steel. The transfer of gas-phase constitutents to the dispersed liquid phase and/or elution of dispersed-phase drops have been identified as potential limiting phenomena in these processes. Consequently, mean drop size and drop size distribution are key design variables. In this paper, the impact of gas flux and the physical properties of dispersed-phase constitutents on the steady-state size distribution of liquid drops in lean liquid-liquid dispersions is quantified. The physical properties of the dispersed phase are shown to have a significant impact on drop size and drop-size distribution at low gas fluxes. Sauter mean drop size is correlated using theoretical models for drop break-up and coalescence. All results are compared with stirred tank analogues.
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  • 29
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    AIChE Journal 37 (1991), S. 597-606 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The tray hydrodynamics were determined for a system containing water and kerosene as immiscible liquids. Plates with hole diameters ranging from 3.18 to 12.70 mm were used in a 44.5-cm2 perspex air-water-kerosene simulator. Experiments were also carried out in a 50-mm-ID column using different depths of oil and water mixtures to study the drop and bubble mechanisms. A spray-to-bubble transition occurred for the two liquid-phase system experiments. The liquid holdup at the transition increased directly with gas velocity and hole diameter, and decreased with increasing free area. At the same hole velocity, the presence of two liquid phases caused the transition to occur at different liquid holdups than for the single pure liquid. Two different modes of coalescence were observed in the small column work. New correlations have been proposed for the liquid holdup at the transition which allow for the presence of two liquid phases.
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  • 30
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    AIChE Journal 36 (1990), S. 753-764 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The selection of an appropriate control configuration (structure) is the most important decision when designing distillation control systems. The steady state RGA is commonly used in industry for selecting the best structure. One counterexample to the usefulness of this measure is the DB configuration, which has infinite steady state relative gain array (RGA) values, but still good control performance is possible. This is indicated by high-frequency RGA values close to 1. In this paper it is stressed that decisions regarding controller design should be based on the initial response (high-frequency behavior) rather than the steady state.Based on a frequency-dependent RGA analysis and optimal Pl controller designs of four different configurations, the (L/D) (V/B) configuration is found to be the best choice for two-point composition control. The conventional LV configuration performs poorer than the above system, but is preferable if one-point control is used.
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  • 31
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    AIChE Journal 36 (1990), S. 779-783 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 32
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    AIChE Journal 36 (1990), S. 797-800 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 33
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 34
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    AIChE Journal 37 (1991), S. 803-803 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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  • 35
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    AIChE Journal 36 (1990), S. 943-947 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 36
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    AIChE Journal 36 (1990), S. 957-960 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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  • 37
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    AIChE Journal 36 (1990), S. 985-993 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: For systems described by algebraic or differential equation models where all variables are subject to error, the error-in-variables method (EVM) for parameter estimation has been shown to be superior to standard least-squares techniques. Previous EVM algorithms were developed assuming linear (or linearized) model equations. Unfortunately, many chemical engineering processes operate in strongly nonlinear regions where linear approximations may be inaccurate. In this paper, new algorithms using nonlinear programming techniques for the error-in-variables methods are proposed. In addition, a method for discerning when these methods are necessary is discussed. The proposed algorithms are compared to the least-squares method and traditional error-in-variable approaches. Improved parameter estimates for several steady-state nonlinear processes are demonstrated.
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  • 38
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    AIChE Journal 36 (1990), S. 1025-1031 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A compensator that approximates the inverse of dead time at low frequencies in a modified Smith predictor (MSP) control system is proposed, and the design of an MSP control system for it is given. The performance of the MSP with compensator, using a first-order element as a low-pass filter, is described. Analysis and simulation results show that the compensator improves performance in the disturbance rejection of the original Smith predictor.
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    AIChE Journal 36 (1990), S. 1046-1053 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The development phase of the optical photolithography process has long been considered the most crucial, as it is the final image-forming step. Process monitoring methods have focused primarily on end point detection and have not used other inferable on-line information. This paper examines the use of mathematical models in conjunction with on-line development penetration data to determine process changes. An on-line sequential parameter identification scheme is used to calculate a current rate parameter value for the development model, and a Kalman filter is used to reduce erroneous observations caused by measurement noise. A powerful development monitor system results from the combination of real-time data, and on-line parameter and state estimation theory.
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    AIChE Journal 37 (1991) 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 1009-1018 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A computational study of fully-developed flow of gas-particle suspensions in vertical pipes was carried out, using the model proposed recently by Sinclair and Jackson (1989), to understand the predicted scale-up characteristics. It was shown that the model can capture the existence of steady-state multiplicity wherein different pressure gradients can be obtained for the same gas and solids fluxes. A pronounced and nonmonotonic variation of the pressure gradient required to achieve desired fluxes of solid and gas with tube diameter was predicted by the model, and this is explained on a physical basis. The computed results were compared with the experimental data. The model manifests an unsatisfactory degree of sensitivity to the inelasticity of the particle-particle collisions and the damping of particle-phase fluctuating motion by the gas.
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    AIChE Journal 36 (1990), S. 1118-1120 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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    AIChE Journal 36 (1990), S. 1137-1144 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The direct-contact heat transfer to a dispersed population of immiscible evaporating droplets is analyzed. Also studied is a population balance formulation for the distribution of two-phase bubbles, which is similar to that utilized in particle and droplet dispersion analysis and is capable of including bubble coalescence and break-up. It is shown that the method of classes is useful particularly in solving such problems when the growth functions are size- and time-dependent and nonquadratic. The method is applied to a liquid cool-down, representing the initial chilling stage of a direct-contact batch crystallizer or cold-storage unit wherein a vessel containing a liquid is chilled by injecting a dispersion of refrigerant droplets. Transient bubble population characteristics, volumetric heat transfer coefficient, total heat transfer, and liquid temperature are predicted, along with the liquid refrigerant holdup.
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    AIChE Journal 37 (1991), S. 1109-1112 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 1121-1128 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The solubility of L-serine in water was measured as a function of temperature, and the solubility in methanol-water solutions was determined as a function of temperature and methanol concentration. Solubility in aqueous solutions was found to be a linear function of temperature. Additionally, a statistical design of experiments was used to identify the kinetic variables that influence the purity of L-serine crystals recovered by batch crystallization. Agitation and the rate at which super-saturation was generated through cooling and methanol addition were found to influence the methanol content of the recovered crystals. The size of the recovered crystals also was found to depend on agitation and the rate at which methanol was added to the L-serine mother liquor.
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    AIChE Journal 37 (1991), S. 1139-1150 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: An emulsion layer model is presented which predicts the thickness of a downward-moving emulsion layer along the wall of a circulating fluidized bed, the mean solids velocity, and the solids flux in the layer. Also presented is a heat transfer model which, in combination with the emulsion layer model, predicts the low-temperature data very well. An alternate slab model proposed for the radiative component in a high-temperature circulating fluidized bed agrees well with experimental data. The heat transfer predictions of the overall model for such operating parameters as solid circulation flux, suspension temperature, length of the heat transfer surface, superficial gas velocity, and mean particle size are in good agreement with the published data for long surfaces.
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    AIChE Journal 37 (1991), S. 1187-1195 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The sorption behavior of water and ethanol on starch material has been investigated in relation to the adsorptive separation of water from ethanol. The adsorption isotherms of water-starch, ethanol-starch and water-ethanol-starch were measured using a Cahn electrobalance. Careful examination of the many sorption isotherm models resulted in selection of Sircar's model and the potential theory to best represent the isotherm data of water-starch and ethanol-starch adsorption. Experimental results showed that ethanol as well as water can adsorb on starch. The adsorption rate of ethanol, however, is much slower than that of water. This suggests that the selective removal of water from ethanol vapor in a packed-bed adsorber is likely a rate-dependent, not an equilibrium-dependent, process.
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    AIChE Journal 37 (1991), S. 1196-1204 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The influence of various operating and liquid-phase physical variables on interfacial area ab in cylindrical and spherical gas-liquid stirred contactors was studied using the sulfite method. Studied were stirring speed, sparger porosity, gas flow rate, liquid-phase temperature, surface tension, and pH.The results show that the influence of operating variables (gas flow rate Qg, stirring speed ω, and the average pore radius of the sparger used rp) on ab, for both types of contactors, can be given by the equation: \documentclass{article}\pagestyle{empty}\begin{document}$$ a_b = Q_g^{0.5} \left({\frac{{k_1 }}{{k_2 }} + \frac{{k_2 }}{{r_p^{1.5} }}\omega } \right) $$\end{document} Dependency of ab on surface tension observed was believed to be caused by a rising rate of bubble coalescence with increased surfactant concentration. The higher the surfactant concentration, the lower ab, tending to a limit that depends on both the type of surfactant and the average size of sparger pore used. Due to the measurement method used, solution pH and temperature were also observed to influence ab.
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    AIChE Journal 37 (1991), S. 1219-1226 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A correlation was developed to quantitatively describe the flux in a high-speed rotating filtration device using a minimum set of parameters. The experimental results were found to be consistent with the concentration polarization (CP) model. Beyond a threshold pressure flux ceases to depend on membrane permeability. The CP model was modified to include the concentration dependence of the diffusivity. This approach was found to be consistent with the strong dependence of flux on pH. Protein concentration in the polarized layer adjacent to the membrane surface was estimated using a procedure that corrects for some of the inconsistencies in the methods usually applied. Four dimensionless numbers were necessary to correlate the experiments with good accuracy. Previously-reported correlations used only three dimensionless numbers. Usage of four numbers could be justified by dimensional analysis. Finally, the performance of rotary or vortex filtration was compared to that of other configurations.
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    AIChE Journal 37 (1991), S. 1255-1260 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 1249-1254 
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    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 1270-1274 
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    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 1305-1317 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The problem of freely-suspended liquid droplets deforming due to an applied electrostatic field is examined. Developed is a numerical model capable of predicting the complete transient histories of droplets in systems with a wide range of dispersedand continuous-phase densities, viscosities, relative permittivities, and electric field strengths. For liquid/gas systems, the predictions of the numerical model demonstrated that the critical field strength and critical permittivity ratio during actual transient breakup are not necessarily the same as those predicted by steady-state theories. An approximate analytical model of transient droplet deformation is also developed, which is able to predict the deformation time histories for large Ohnesorge number, small-deformation liquid/liquid systems. The approximate analytical model agreed well with the results of the complete numerical model.
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    AIChE Journal 37 (1991), S. 1341-1353 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: We present an explicit analytical solution for the Lévêque's problem with the boundary condition of the third kind. This solution is applicable to problems of mass (heat) transfer with surface reaction (surface resistance) in the entry region of fully developed flow fields of power law fluids, and to the developing boundary layer flows that admit Falkner-Skan solutions, provided that the Schmidt (Prandtl) number is large. The series form of the solution developed by inversion of the Laplace transform has excellent convergence properties within the concentration (temperature) boundary layer in contrast to the integral forms that are usually reported for problems of this type. An efficient computational algorithm for evaluation of the surface concentration is presented, as well as accurate approximate formulas in the form of simple algebraic expressions for the local and average mass (heat) transfer coefficients and the surface concentration (temperature).
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    AIChE Journal 36 (1990), S. 1403-1419 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Axisymmetric motions of suspended spheres and dumbbells through sinusoidally corrugated capillaries are considered as an illustrative model of particulate or macromolecular transport in porous media. Numerical simulations are carried out using a least-squares singularity method, which is well suited to simulating creeping flows in the complicated, time-evolving geometries associated with particle motion through nonrectilinear pores. The numerical method is applied to a representative closure problem, whose solution yields effective transport coefficients describing particulate flow in porous media. With reference to polymer-induced mobility control in enhanced oil recovery, a hydrodynamic mechanism of mobility reduction is studied using a rigid dumbbell polymer model.
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    AIChE Journal 36 (1990), S. 1444-1448 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
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    AIChE Journal 36 (1990), S. 1457-1470 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A molecular-based statistical simulation program was developed to study the covariance terms involved in the mass balance equations for complex chemical reactions during mixing. Several closure theories were compared to the simulations and available experimental data. The simple closure by Brodkey and Lewalle was found to be an extension of Toor's analysis applied to two reactions. This closure does not satisfy the molar fluctuation balance equation and was found only to represent the high Reynolds number data of Li and Toor. This result led to examining other possible closures which were based on Damkoehler numbers, reaction rate constant ratios, and limiting forms of the covariance term. These closures also were inadequate. The second reaction's covariance term varied from the product of the average values for each component to the Brodkey and Lewalle value for the range of Reynolds numbers considered.
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    AIChE Journal 36 (1990), S. 1505-1516 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A thermodynamic framework for the analysis of gas sorption in glassy polymers is established in the limit of low sorption levels. The results represent an extension of the Flory-Huggins theory to materials with nonzero internal energy changes due to deformation; the Flory-Huggins theory is recovered in the limit of zero polymer bulk modulus. The sorption isotherm is expressed in terms of the penetrant vapor-phase activity, polymer physical properties, the penetrant partial molar volume, and the heat of mixing. The qualitative form of the isotherm is shown to be unrelated to the presence of excess free volume in the polymer; only quantitative predictions are influenced. The downward curvature of the isotherm is due to the thermodynamics of solid deformation. Explicit relationships between the parameters of this work and the dual-mode model are given for the low-sorption/high-bulk modulus limit.
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    AIChE Journal 36 (1990), S. 1545-1554 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: All classical models for thickening assume one-dimensional continuity. However, the free-settling domain in continuous thickeners is not one-dimensional. Therefore, a two-dimensional model is investigated. The two-dimensional model gives the same values for thickener area demands as the one-dimensional model, but the relationships between batch and steady-state thickening are not the same. Free-settling Kynch characteristics can arise in the continuous operation that do not arise in batch tests. Therefore, design procedures that rely on Kynch theory, such as that of Talmage and Fitch, are not completely valid.A method is developed, based on extrapolating the Kynch or free-settling segment of a batch settling, curve, that yields an improved prediction for thickener area demand.
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    AIChE Journal 36 (1990), S. 1562-1568 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Xenon-129 NMR is used to probe macroscopic distributions of aromatic molecules adsorbed in a packed bed of 1-μm NaY zeolite particles. Relative rates of guest transport through the intracrystalline (micro) and intercrystalline (macro) pores play a unique role in the axial distribution of sorbate molecules, such as hexamethylbenzene, in a zeolite powder. Xenon-129 NMR spectra show that a sharp HMB adsorption front advances through a bed of dehydrated NaY crystallites at 523 K. However, at 573 K or in the presence of coadsorbed water, HMB species disperse through the bed without forming a sharp boundary between adsorption zones.When guest transport is controlled by pseudosteady-state diffusion in the macropores, axial penetration of the bed by vapor-phase guest species occurs in a sharp adsorption front. A shrinking-core transport model then quantitatively estimates the intracrystalline diffusivities of HMB in dehydrated and partially hydrated NaY zeolite of 10-11 and 10-13 m2/s, respectively, at 523 K. Xenon-129 NMR proves to be a powerful tool for probing adsorbed guest distribution in zeolites, allowing relative time scales to be established for transport of molecular guests in NaY powders.
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    AIChE Journal 36 (1990), S. 1592-1596 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 36 (1990), S. 1605-1609 
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    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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    AIChE Journal 36 (1990), S. 1613-1616 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 36 (1990), S. 1633-1640 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The reaction of CO2 with TEA, DMMEA, and DEMEA has been studied at 293, 303, 318 and 333 K. All the kinetic experiments were carried out in a stirred cell reactor operated with a flat, smooth and horizontal gas-liquid interface. A numerical method, which describes mass transfer accompanied by reversible chemical reactions, has been applied to infer rate constants from the experimental data. It is argued that the contribution of the CO2 reaction with OH- to the observed reaction rate may have been overstimated in most literature on tertiary amine kinetics as serious depletion of OH- toward the gas-liquid interface usually occurs.For all the amines studied, the reaction order in amine was found to be about one for each temperature investigated. This is in good agreement with the base catalysis mechanism proposed by Donaldson and Nguyen (1980). All kinetic data could be summarized reasonably well in one Brønsted relationship.
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    AIChE Journal 36 (1990), S. 1687-1696 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Notes: The potential for effective vectorization of the sequential-modular, simultaneous-modular, and equation-based approaches to process flowsheeting is assessed. The last appears to be the most promising, but the required sparse matrix techniques currently used do not vectorize well. Different approaches to vectorizing the sparse matrix calculation are considered. With a good matrix reordering scheme, the most promising sparse matrix strategy for the vectorization of flowsheeting problems is the frontal method, a technique currently used primarily on finite-element problems.
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    AIChE Journal 36 (1990), S. 1707-1714 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: This work presents a linear, steady-state model of a rotary kiln hazardous waste incinerator. Mass balance constraints, energy balance constraints, constraints typically imposed by incinerator permits, and constraints imposed by design limitations are all included in the model. The model is used to perform optimization studies, which maximize a measure of the incinerator's throughput. The sensitivity of the model to uncertainties in the chemical property values of the waste streams is also examined. For the spectrum of case studies examined, the optimal operating conditions are most sensitive to halogen content and water content of the wastes and are less sensitive to variations in heating value and nitrogen content.
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    AIChE Journal 36 (1990), S. 1743-1747 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
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    AIChE Journal 36 (1990), S. 1865-1872 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A model of the reaction between SO2 and calcium-based slurries is presented. The model is coupled with an extensive model of the evaporation process and considers external SO2 mass transfer and liquid-phase mass transfer of dissolved sulfur and calcium species in both the film surrounding the calcium particles and the bulk liquid phase. The model assumes that particles do not circulate within slurry droplets and that evaporation results in an accumulation of particles at the droplet surface that causes a shift in the controlling mechanisms. Agreement between the model and data available in the literature is excellent.
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    AIChE Journal 37 (1991), S. 1789-1800 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The finite element method was used to model microwave thawing of pure-water and 0.1-M NaCl cylinders. The electromagnetic field was described by Maxwell's equations with temperature-dependent dielectric properties, while the heat equation, coupled with the Stefan and Robin conditions, was used to describe the thawing process. An additional equation for the frozen volume fraction was used, when necessary, to account for the presence of a mushy region. Two microwave frequencies, 915 MHz and 2,450 MHz, were examined and the microwave radiation was assumed to be radially isotropic and normal to the surface of the cylinder. Results show that a two-phase mushy region may exist, and an additional thawing front may appear at the center of the cylinder. Salt cylinders have a higher dielectric loss than pure-water cylinders and therefore thaw more quickly. Internal resonance occurs when the wavelength of the radiation is a harmonic of the cylinder radius. Resonance increases power deposition and expedites the thawing process. The onset of resonance alters thawing times and complicates the development of heuristic rules for microwave thawing.
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    AIChE Journal 37 (1991), S. 1833-1843 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: An experimental study of the dynamics of electrodissolution of iron in sulfuric acid is reported. The experiments were done under potentiostatic conditions with a rotating disk electrode as a function of two parameters, potential and electrode diameter. The dynamic behavior depends strongly on the latter parameter; with increasing electrode size we observe transitions from periodic oscillations to low-order chaos to higher-order chaos. The attractor dimension increases with increasing electrode size. In addition, for the large electrodes at more positive potentials, a secondary higher frequency oscillation also arises.
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    AIChE Journal 37 (1991), S. 1863-1874 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A generalized technique for modeling resist performance is outlined. In this approach, the fraction of resist remaining after development as a function of incident dose, or characteristic curve, is related to the development rate which is assumed to be a power law of a dominant soluble species. Soluble species are either photochemically consumed for negative resists or generated for positive. Expressions for the dependence of characteristic curves on exposure dose and chemistry are derived for various resist systems, which are consistent with current models. For similar chemical kinetics, negative resists yield fewer lumped parameters to describe their development rate and characteristic curves than positive.Under conditions of negligible surface inhibition, lumped parameters can be extracted from characteristic curves and used to simulate lithography. A generalized method to correct for absorption in the resist and reflections is outlined. Exposure latitude was accurately predicted for a commercial negative chemically amplified resist. However, prediction of linewidths from characteristic curves of positive resists is complicated by surface inhibition effects.
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    AIChE Journal 37 (1991), S. 1905-1906 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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  • 73
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    AIChE Journal 38 (1992), S. 15-25 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Quantitative results are presented on mean coordination number and coordination number distribution, contact normal distribution and fabric tensor of simulated anisotropic granular deposits with resulting solid fractions between ca. 15% for ballistic deposits and 58%, corresponding to a random loose packing. The deposits, generated by the capture of uniform size spherical particles arriving normal to a target, were simulated using a simple algorithmic model.We focus on microstructural quantities which explicitly take into account the discrete nature of the granules comprising the deposit. Such measures are important in determining the heat transport properties of the deposits for Fourier conduction through the solid phase, as well as their mechanical and sintering properties. The variation of mean coordination number with deposit solid fraction was successfully correlated using a unit-cell model (Eq. 13). This correlation, in conjunction with entropy maximization arguments (after Nayak and Tien, 1978) has been further used to predict the coordination number distribution. The usefulness of the results reported here is illustrated by computing an upper bound to the deposit effective thermal conductivity (Jagota and Hui, 1990) and comparing it to both ‘exact’ simulation results (Tassopoulos and Rosner, 1991b) and experimental data (Koh, 1971).
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    AIChE Journal 38 (1992), S. 56-66 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The tortuosities of fibrous media in the heretofore unexplored transition and ordinary regimes are computed using a Monte Carlo scheme based on the Einstein equation for random walkers. The model structure is that of fully penetrable cylinders (FPC) in a unit simulation volume. The mean square displacement technique is combined with the first passage time distribution to accelerate the progress of the walkers at low Knudsen number. The results include the computation of transition regime transport coefficients for the first time. The calculated ordinary tortuosities are approximately equal to the reciprocal of the porosity over a wide range, while the transition tortuosities are shown to deviate from the reciprocal porosity with a simple dependence on Knudsen number. The limits of the transition regime are shown to correspond roughly to Knudsen numbers of 0.50 and 100, respectively. The calculated Knudsen tortuosities are shown to improve on earlier results obtained by the authors using a flux-based technique.
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    AIChE Journal 38 (1992), S. 101-115 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Singularity theory, large activation energy asymptotics, and numerical methods are used to present a comprehensive study of the steady-state multiplicity features of three classical adiabatic autothermal reactor models: tubular reactor with internal heat exchange, tubular reactor with external heat exchange, and the CSTR with external heat exchange. Specifically, we derive the exact uniqueness-multiplicity boundary, determine typical cross-sections of the bifurcation set, and classify the different types of bifurcation diagrams of conversion vs. residence time. Asymptotic (limiting) models are used to determine analytical expressions for the uniqueness boundary and the ignition and extinction points. The analytical results are used to present simple, explicit and accurate expressions defining the boundary of the region of autothermal operation in the physical parameter space.
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    AIChE Journal 38 (1992), S. 153-157 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 429-436 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The sensitivity of the calculated micropore size of zeolite Y in a fluidized cracking catalyst based on empirical models for argon adsorption has been tested by examining the effect of curvature and by systematically verifying the magnitude of physical constants in the model equations. With a consistent set of physical parameters the slit model provided a pore size value of 0.45 nm, while the new cylindrical models provided values of 0.69 and 0.74 nm. The latter values are found to correspond well with the known aperture size of zeolite Y, 0.74 nm. By separately varying the magnitudes of five of the physical constants in the model over a range of ±30%, it was concluded that the diameter of the oxide ion at the surface had a large effect on the calculated pore size, while the other parameters had only moderate to small effects. Preliminary application of the cylindrical pore model to isotherms of argon on other zeolites and molecular sieves leads to promising results, especially for medium to large pore zeolites. These results suggest that the cylindrical pore model is a useful means for the transformation of argon adsorption data on a zeolite into a micropore size distribution.
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    AIChE Journal 37 (1991), S. 461-465 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 448-460 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Efforts to model the turbulent flow in stirred tanks require accurate boundary conditions at the tip of the impeller, not just of velocities, but of the turbulence quantities k and ε. Kolar's (1982) phenomenological, swirling radial jet model of the impeller region is extended by using a two-equation k - ε turbulence model to obtain direct estimates of k and ε on the impeller periphery. The model is extended and clarified, so that the number of parameters required for its application is reduced to two: the rotational speed and the diameter of the impeller. Three-dimensional simulations allow a realistic treatment of the baffles. Agreement of the modeling results with recently published experimental data is excellent. This is particularly true in the important impeller discharge zone, where details of the predicted behavior of the turbulence kinetic energy and dissipation rate are in quantitative agreement with the available data. Based on these results, average values of ε are calculated, along with the zones over which the apply. For the impeller discharge zone, the dimensionless, volume-averaged ε is 0.19.
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    AIChE Journal 37 (1991), S. 475-479 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 499-511 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Simple distillation columns with ideal vapor-liquid equilibrium may display multiple steady-state solutions. Two fundamentally different sources for the multiplicity are presented. Both bring about the unexpected result that increasing reflux makes separation worse in the top part of the column. It corresponds to an unstable operating point.The first type of multiplicity is found for columns with mass or volume inputs (e.g., mass reflux and molar boilup). Even for constant molar flows, the transformation from the actual input units to molar units may become singular (corresponding to a pitchfork bifurcation point), resulting in multiple steady-state solutions. The results are highly relevant in practice, as industrial columns usually have inputs on a mass or volume basis. The second type for specifications on a molar basis (e.g., molar reflux and molar boilup) depends on the presence of an energy balance in the model. The multiplicity is caused by interactions between flows and compositions in the column.
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    AIChE Journal 38 (1992), S. 318-319 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 38 (1992), S. 321-327 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Aqueous solutions of phenol were oxidized in a flow reactor at temperatures between 300 and 420°C (0.89 ≤ Tr ≤ 1.07) and pressures from 188 to 278 atm (0.86 ≤ Pr ≤ 1.27). These conditions included oxidations in both near-critical and supercritical water. Reactor residence times ranged from 1.2 to 111 s. The initial phenol concentrations were between 50 and 330 ppm by mass, and the initial oxygen concentrations ranged from 0 to 1,100% excess. The oxidation experiments covered essentially the entire range of phenol conversions. Analysis of the kinetics data for phenol disappearance using a combination of the integral method and the method of excess revealed that the reaction was first order in phenol and 1/2 order in oxygen, and influenced by pressure. The global reaction order for water was taken to be nonzero, and the global rate constant was assumed to be independent of pressure so that the only effect of pressure was to alter the water concentration and hence the reaction rate. This approach led to a global reaction rate law that was 0.7 order in water and had a rate constant with an activation energy of 12.4 kcal/mol. The implications of these rate laws to the design of a commercial supercritical water oxidation reactor are also explored.
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    AIChE Journal 37 (1991), S. 547-554 
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    Keywords: Chemistry ; Chemical Engineering
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    Notes: The interstitial pressure buildup and the internal stresses on the skeleton of a cylindrical green body during burnout are analyzed numerically. The intrinsic kinetics of pyrolysis is coupled with the Carman-Kozeny equation or the slip-flow model of Wakao and Smith to evaluate the pressure distribution. The stress distributions before failure are estimated from elasticity theory. The stresses are tensile, and their maxima are located at the center of the cylinder. The tangential stress is larger than the radial stress. The effects of green body size, specific surface area, and pressurized atmosphere are discussed. The approximate solution is accurate for small green bodies. The pressurized atmosphere reduces the interstitial pressure and the internal stresses effectively.
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    AIChE Journal 36 (1990), S. 353-360 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: An instability is proposed that can lead to channel formation during the regeneration of monolithic diesel-particulate filters. This instability, which occurs during the transport-controlled combustion of the soot bed, is compared to a kinetically driven instability by using a numerical model for channel growth. Both mechanisms are shown to be important and may lead to higher thermal stresses in the filter wall. It is suggested that both mechanisms can be controlled by the ratio of the filter-plate to soot-bed flow resistance, lateral heat transfer, and other design parameters.
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    AIChE Journal 37 (1991), S. 617-628 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Recent advances in knowledge engineering have led to develop the qualitative (deep) model based diagnostic systems. As process knowledge accumulated, however, the diagnostic system remains strictly qualitative. This limits the usefulness of such systems. In this work, a framework is developed for integrating quantitative process knowledge into the qualitative model. Once quantitative process information, e.g., steady-state gains, is available, it can be incorporated into the simplest qualitative process model called the signed directed graph. The quantitative process knowledge is described in terms of membership functions of fuzzy set theory. According to the measurement pattern, the truth values of a hypothesis (e.g., a fault origin) can be calculated based on the fuzzy logic. Consequently, the diagnostic resolution can be improved significantly. Furthermore, the proposed method becomes a strictly qualitative diagnostic system, if no quantitative information is available. A chemical reactor example illustrates the design and performance of the qualitative/quantitative model-based diagnostic system. The proposed approach can also be extended to the multiple-fault situations in a straightforward manner.
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    AIChE Journal 37 (1991), S. 641-649 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Ignition, extinction and autothermal behavior of surface and homogeneous oxidation reactions of CH4, NH3, and mixed NH3/CH4 fuel systems in air over resistively heated Pt foils was studied in an atmospheric pressure flow reactor. Also examined were the effects of varying fuel concentration on the ignition, extinction, and autothermal surface temperatures. Heterogeneous ignition occurred at ∼200°C for NH3 and at ∼600°C for CH4. The mixed fuel systems exhibited two surface ignitions (∼200°C and ∼600°C), implying a sequential ignition of the two fuels. The effects of removing one of the fuels during autothermal operation gave results consistent with this hypothesis.In homogeneous ignition, two types of flames were observed: a boundary layer flame associated with NH3 systems and an independent flame observed in all systems. Homogeneous ignition of the two fuels and the mixtures occurred at surface temperatures ranging from 1,100°C to 1,600°C and appeared to be dominated by CH4 in the mixed systems. A generic behavior is proposed for homogenous-heterogeneous combustion of single and mixed fuels.
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    AIChE Journal 37 (1991), S. 679-686 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: High-surface-area, Zr-pillared, layered clays are synthesized and characterized for their adsorption properties. Although large free interlayer spacings are claimed in the literature (as also found in this work, 14.3 Å), the limiting pore size is the narrow interpillar spacing. The distribution of interpillar spacing is determined by molecular probing and adsorption data along with a theoretical framework available from the literature. Interpillar spacing can be tailored by controlling the number density of pillars inserted during the ion exchange (oligomer inserting) step. The following variables in the ion exchange solution result in lowering the pillar density: higher pH, lower oligomer concentration, and introduction of competitive cations. By changing these variables, peak interpillar spacing is shifted by nearly 2 Å (from 5 to 7 Å). The versatility of pillared clays as sorbents for kinetic separation (i.e., separation based on diffusivity differences) has been demonstrated by the separations of air and xylene isomers.
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    AIChE Journal 37 (1991), S. 769-779 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Adsorption of air in 5A zeolites was studied using Monte Carlo simulations in the grand canonical ensemble (μ, V, T constant). Site-site potentials were used to model the adsorbate-zeolite and adsorbate-adsorbate interactions. The potential model contains one adjustable parameter that was fit to a single experimental isotherm data point. Adsorption isotherms and heats of adsorption were determined for pure argon, oxygen, and nitrogen at 203.15 K, 233.15 K, and 297.15 K from 0.1 bar to 4.0 bar. Multicomponent adsorption isotherms were determined for binary mixtures of oxygen and nitrogen at 203.15 K. The results for the pure-component isotherms are in excellent agreement with experimental data. The results for the heat of adsorption are in good agreement with experimental data for argon and oxygen, but not for nitrogen. The results for multicomponent adsorption isotherms are qualitatively correct; however, the simulation was not able to quantitatively predict mixture data.
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    AIChE Journal 37 (1991), S. 836-844 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Equilibrium adsorption data for the N-benzoyl derivatives of D- and L-phenyl alanine in water/propanol solutions have been determined on a chiral-selective stationary phase, bovine serum albumin immobilized on silica. These data are well accounted for by an isotherm equation resulting from the sum of two Langmuir terms. The first term corresponds to the chiral-selective interactions, and the second to the nonselective molecular interactions between the enantiomers and the stationary phase. The individual band profiles of the two enantiomeric amino acids, either pure or in binary mixtures of various compositions, are predicted exactly by an equilibrium dispersive model using this bi-Langmuir isotherm. A classical Langmuir isotherm fails to predict these band profiles, illustrating the importance to collect accurate adsorption data and to use a correct isotherm model when calculating chromatographic band profiles.
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    AIChE Journal 37 (1991), S. 871-885 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Waxy crude oils are highly non-Newtonian materials known to cause handling and pipelining difficulties and whose flow properties are time- and history-dependent. Experimental techniques are described that enable reproducible steady-state flow property data to be obtained from rotational viscometers. The flow properties are shown to depend strongly on the shear rate applied during cooling (shear history effect). This leads to a definable minimum operating point below which flow in a waxy crude oil pipeline would cease. Modified pipeline design techniques are presented for both laminar and turbulent flow at temperatures below the pour point, and it is shown that existing techniques overestimate the flow rate in laminar flow by the order of 100%. The modified design techniques can be used to quantitatively assess the performance of flow improver (pour point depressant) additives under steady-state conditions.
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    AIChE Journal 37 (1991), S. 915-922 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Direct conversion of methane into higher hydrocarbons (ethane, ethylene, and to small extent C3-4 hydrocarbons) by its partial oxidation with oxygen in the absence of catalyst has been investigated. It was carried out in a quartz flow reactor at atmospheric pressure under nonflame conditions at different temperatures (1,123-1,273 K), CH4/O2 ratios (1.7-9.0), space velocities (500-5,000 h-1), and water concentrations (0.0-80 mol %) in the feed. No coke deposition was observed in the reactor, but there was a formation of small amounts of tarry matter in the reaction at ≥ 1,223 K, particularly for the lower CH4/O2 ratios (≤3.5). The product distribution in the process was strongly influenced by the dilution of feed with N2 or water. Addition of water in the feed was highly beneficial to obtaining higher yield and/or to selectivity for the higher hydrocarbons and suppressing almost completely the formation of tarry matter.
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    AIChE Journal 37 (1991), S. 953-954 
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    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 961-961 
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    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 931-943 
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    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: An important application of the recently developed techniques in qualitative mathematical modeling is to qualitatively predict how changes in the operation of chemical units affect their behavior. Weld (1987, 1988a,b) has developed a series of comparative techniques that analyze the effect of perturbations to the parameters of a given qualitative unit model. In this article we demonstrate a system, based on the qualitative process theory of Forbus (1984), which extends comparative analysis in two ways. First, it predicts the effects of changes in the qualitative equations and in parameter values. Secondly, it compares physical descriptions, rather than comparing models directly, and builds and compares the associated models automatically.
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    AIChE Journal 37 (1991), S. 955-957 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 37 (1991), S. 963-985 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The onset of three-dimensional reaction-driven convection in a porous medium is investigated using linear stability theory. The geometries investigated include a finite cylinder and a rectangular parallelepipped of arbitrary aspect ratios. The analysis determines, among other things, the likely modes (flow patterns) to emerge first as a function of reaction parameters and aspect ratios. The flow fields corresponding to three-dimensional modes are described in detail. Important qualitative differences are found between reaction-driven convection and the standard Lapwood or Bénard convection due to a temperature gradient applied to the boundaries of the system.The second part of the work examines numerically reaction-driven natural convection in a porous two-dimensional rectangular box. Orthogonal collocation and continuation techniques are used to determine the conduction and convection branches of solutions as a function of the Rayleigh number (Ra), the Frank-Kamenetskii number (δ) and the aspect ratio (α). The convective solutions (streamlines and isotherms) corresponding to primary, secondary and tertiary bifurcations are presented. The effect of natural convection (Ra) on the ignition point (critical δ value) is determined for three different aspect ratios.
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    AIChE Journal 37 (1991), S. 1027-1034 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
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    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A theoretical model comprising the processes of micropore, macropore and surface diffusion was derived and applied to the dynamics of adsorption of CO2 on a single activated-carbon particle. The effects of a nonlinear isotherm (Langmuir), particle nonisothermality and concentration dependence of the surface diffusivity were also incorporated. The theoretical model was fitted to a preliminary set of adsorption experimental data (two particle sizes, and various temperatures and concentrations) to determine the diffusion coefficients. The validity of the theoretical model was checked by using the model, with fitted diffusivities, to simulate dynamic adsorption curves at conditions different from those of the preliminary fitting data set. These model simulations were found to predict the experimental data in a satisfactory manner.
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    AIChE Journal 36 (1990) 
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    Keywords: Chemistry ; Chemical Engineering
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    AIChE Journal 36 (1990), S. 897-906 
    ISSN: 0001-1541
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Equations for the critical properties of dilute multicomponent mixtures have been derived using the Soave-Redlich-Kwong equation of state. The utility and limitations of the approach are described using data on 47 mixtures from the literature. New data on three dilute multicomponent mixtures have also been measured in this work and are compared with the predictions of our method. In general, it is possible to predict all three critical properties of dilute multicomponent systems with a satisfactory degree of accuracy. Predictions are as good as those obtained from conventional equation of state methods, which employ a rigorous solution of the Gibbs criteria for the critical point, but offer the advantage that no iterations are required in the calculations.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
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