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We study the adsorption equilibrium isotherms and differential heats of adsorption of hexane isomers on the zeolitic imidazolate framework ZIF-8. The studies are carried out at 373 K using a manometric set-up combined with a micro-calorimeter. We see that the Langmuir model describes well the isotherms for all four isomers (n-hexane, 2-methylpentane, 2,2-dimethylbutane and 2,3-dimethylbutane). The linear and mono-branched isomers adsorb well, but 2,2-dimethylbutane is totally excluded. Plotting the differential heat of adsorption against the loading shows an initial plateau for n-hexane and 2-methylpentane. This is followed by a slow rise, indicating adsorbate-adsorbate interactions. For the di-branched isomers the differential heat of adsorption decreases with loading. To gain further insight, we ran molecular simulations using the grand-canonical Monte Carlo approach. Comparing the simulation and the experimental results shows that the ZIF framework model requires blocking of the cages, since 2,2-dimethylbutane cannot fit through the sodalite-type windows. Practically speaking, this means that ZIF-8 is a highly promising candidate for enhancing gasoline octane numbers at 373 K, as it can separate 2,2-dimethylbutane and 2,3-dimethylbutane from 2-methylpentane. Our results prove the potential of ZIF-8 as a new adsorbent that can be employed in the upgrade of the Total Isomerization Process for the production of high octane number gasoline, by blending di-branched alkanes in the gasoline.

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The separation of ethylene from ethane is particularly complex due to their similar physical properties. Cryogenic distillation is the most common technology employed for this separation and is one of the most expensive operations in industry, being the driving force for the ongoing research to find a more cost-effective alternative. In the present work, a gas-phase simulated moving bed (SMB) bench unit was employed to produce polymer-grade ethylene from ethane/ethylene mixtures, using binderless 13X zeolite beads as adsorbent, and propane as desorbent. The achieved performance parameters demonstrated the high efficiency of the current technology, since ethylene was obtained with a purity of 99.8%, a recovery of 99.8%, and a productivity of 59.7 kg C2H4 Áh 21 Ám 23 adsorbent . Considering the encouraging results obtained it is fair to say that the gas-phase SMB is a competitive and strong candidate as alternative to the conventional process, especially when combined with enhanced performance adsorbents, such as binderless zeolites.

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