Abstract
We investigated the adsorption and the diffusion of alkanes in the sodium-exchanged zeolite Mordenite (Na-MOR) using molecular simulations. MOR-type zeolite consists of main channels (6.5 × 7 Å) oriented along the z crystallographic axis that are connected to small side pockets (3.4 × 4.8 Å). It is well-known that the
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