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Título:	Kinetic analysis and CFD simulations of the photocatalytic production of hydrogen in silicone microreactors from water-ethanol mixtures
Autor/a:	Castedo Rodríguez, Alejandra; Uriz, I.; Soler Turu, Lluís; Gandía, L. M.; Llorca Piqué, Jordi
Otros autores:	Universitat Politècnica de Catalunya. Institut de Tècniques Energètiques; Universitat Politècnica de Catalunya. Departament d'Enginyeria Química; Universitat Politècnica de Catalunya. NEMEN - Nanoenginyeria de materials aplicats a l'energia
Abstract:	Silicone microreactors containing microchannels of 500 µm width in a single or triple stack configuration have been manufactured, coated with an Au/TiO2 photocatalyst and tested for the photocatalytic production of hydrogen from water-ethanol gaseous mixtures under UV irradiation. Computational fluid dynamics (CFD) simulations have revealed that the design of the distributing headers allowed for a homogeneous distribution of the gaseous stream within the channels of the microreactors. A rate equation for the photocatalytic reaction has been developed from the experimental results obtained with the single stack operated under different ethanol partial pressures, light irradiation intensities and contact times. The hydrogen photoproduction rate has been expressed in terms of a Langmuir-Hinshelwood-type equation that accurately describes the process considering that hydrogen is produced through the dehydrogenation of ethanol to acetaldehyde. This equation incorporates an apparent rate constant (kapp) that has been found to be proportional to the intrinsic kinetic rate constant (k), and that depends on the light intensity (I) as follows: kapp = k·I0.65. A three-dimensional isothermal CFD model has been developed in which the previously obtained kinetic equation has been implemented. The model adequately describes the production of hydrogen of both the single and triple stacks. Moreover, the specific hydrogen productions (i.e. per gram of catalyst) are very close for both stacks thus suggesting that the scaling-up of the process could be accomplished by simply numbering-up. However, small deviations between the experimental and predicted hydrogen production suggest that a fraction of the radiation is absorbed by the microreactor components which should be taken into account for scaling-up purposes.
Materia(s):	-Àrees temàtiques de la UPC::Energies::Recursos energètics renovables -Àrees temàtiques de la UPC::Enginyeria química -Fluid mechanics -Chemical reactors -Hydrogen -Hydrogen photoproduction -Gas-phase photocatalysis -Microreactor -Kinetic modeling -Computational fluid dynamics (CFD) -Mecànica de fluids -Reactors químics -Hidrogen
Derechos:	http://creativecommons.org/licenses/by-nc-nd/3.0/es/
Tipo de documento:	Artículo - Versión presentada Artículo
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