Adsorption of xylene isomers in MOF UiO-66 by molecular simulation

This work presents results of molecular simulations on adsorption of mixtures of the four xylene isomers in the porous zirconium terephthalate UiO-66. The grand-canonical Monte Carlo simulations (GCMC) are compared to multi-component adsorption equilibrium data obtained by breakthrough experiments....

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Bibliographic Details
Main Author: Miguel Angelo Granato (author)
Other Authors: Vanessa Duarte Martins (author), Alexandre Filipe P. Ferreira (author), Alírio E. Rodrigues (author)
Format: article
Language:eng
Published: 2014
Online Access:https://hdl.handle.net/10216/103894
Country:Portugal
Oai:oai:repositorio-aberto.up.pt:10216/103894

Internet

https://hdl.handle.net/10216/103894

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