The radiation field in an annular photocatalytic reactor is simulated using a Monte Carlo method (MC) for two TiO 2 suspensions in water. Simulations are performed by using both the spectral distribution and the wavelength-averaged scattering and absorption coefficients. The Henyey-Greenstein phase function is adopted to represent forward, isotropic, and backward scattering modes. It is assumed that the UV lamp reflects the backscattered photons by the slurred medium. Photoabsorption rates using MC simulations and spectral distribution of the optical coefficients agree closely with experimental observations from a macroscopic balance. It is found that the scattering mode of the probability density function is not a critical factor for a consistent representation of the radiation field. MC simulation for the optimal catalyst concentration reveals that the maximum LVREA is reached at a concentration of 0.14 g L -1 for TiO 2 Degussa P25. From this concentration, the apparent optical thickness is determined to be 2.8476 which is in agreement with the optimal one previously reported. This concentration is comparable to that determined experimentally for phenol photocatalytic degradation.
OH • radicals react in photocatalytic reactors via adsorbed species on the catalytic surface through complex reaction mechanisms leading to complete mineralization of organic molecules. Our research group has recently contributed with kinetic modeling of the photocatalytic network using a parallel-series reaction network. This kinetic approach helps toward the assessment of the photocatalytic thermodynamic efficiency factors (PTEF) and quantum yields (QY). Efficiency calculations consider stoichiometric relationships involving observable chemical species and OH • groups. These stoichiometric equations set the OH • requirements for reaching a particular intermediate species and for the complete mineralization of them. On this basis, the PTEF and QY factors for phenol photoconversion point toward a high degree of photon utilization as in the case of Photo-CREC units and, as a result, confirm the value of photocatalysis for the conversion of organic pollutants in water.
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