화학공학소재연구정보센터
AIChE Journal, Vol.40, No.2, 312-320, 1994
A Thermodynamic Model for Structure-H Hydrates
A statistical thermodynamics model based on the original work of van der Waals and Platteeuw is presented for structure-H hydrates. The model is an extension of the hydrate prediction method generalized by Parrish and Prausnitz for structure-I and -II hydrates. Four structure-H-forming systems, methane + adamantane, methane+neohexane, methane+isopentane, and methane+methylcyclohexane, were considered. Optimized Kihara core parameters are presented for each of the large hydrocarbon guest molecules. The optimized reference chemical potential difference and reference enthalpy difference for structure-H hydrates are also presented. The results show good agreement with the experimentally determined phase-equilibria conditions. A sensitivity analysis is presented for the parameters in the model, and their relative order of influence on the accurate evaluation of the equilibrium pressure is determined.