Computational Screening of Cationic Zeolites for n‑Butane/Methane Separations Using Quantitatively Accurate First-Principles-Derived Force Fields.

Autor: Fang, Hanjun, Daou, Alan S.S., Boulfelfel, Salah Eddine, Findley, John M., Ravikovitch, Peter I., Sholl, David S.
Zdroj: Journal of Physical Chemistry C; 12/14/2023, Vol. 127 Issue 49, p23941-23955, 15p
Databáze: Supplemental Index