Effects of Framework Flexibility on the Adsorption and Diffusion of Aromatics in MFI-Type Zeolites

Sebastián Caro-Ortiz,Erik Zuidema,Marcello Stefano Rigutto,David Dubbeldam,Thijs J. H. Vlugt

Effects of Framework Flexibility on the Adsorption and Diffusion of Aromatics in MFI-Type Zeolites

2020

Sebastián Caro-Ortiz
Erik Zuidema
Marcello Stefano Rigutto
David Dubbeldam
Thijs J. H. Vlugt

We systematically study how the degree of framework flexibility affects the adsorption and diffusion of aromatics in MFI-type zeolites as computed by Monte Carlo simulations. It is observed that as...

Keywords:

Chemical engineering
Adsorption
Materials science

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