Abstract

In order to determine the water vapor adsorption performance of a rotary desiccant-based air conditioning system, the behavior of water adsorption on cylindrical pores of different sizes was studied by using classical density functional theory (CDFT) based on perturbated chain statistical associating fluid theory (PC-SAFT). Firstly, the structural parameters of the desiccant material were characterized by scanning electron microscopy (SEM), X-ray Energy Dispersive Spectrum (EDS), and N2 adsorption/desorption isotherms, as well as adsorption equilibrium measurements of water vapor at temperature range 293–308 K. Secondly, the potential energy equation of water molecules in cylindrical pores was determined, and contribution of various terms of PC-SAFT for simulating fluid in cylindrical pores were established. Finally, the pore size distribution (PSD) of the desiccant materials is determined by the PC-SAFT kernel. Moreover, water vapor condensation was investigated with the PC-SAFT model in micropores. The results indicate that the rotary desiccant materials have a large number of micropores with a volume of 0.3669 cm3/g and the amount of water adsorption is about 0.285 g/g. The condensation pressure and the pore width corresponding to the saturated pressure P0 grow with an increase in the temperature, signifying that adjusting the PSD of the material has a significant effect on improving the dehumidification performance. The research concludes that the PSD range of the oxide cylindrical pore between 1.09 and 1.53 nm is particularly beneficial for dehumidification. This study provides valuable theoretical guidance for optimizing dehumidification materials.

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