TY - DATA
T1 - Sample simulation input file and data sets for the article: "Modelling of adsorbate-size dependent explicit isotherms using a segregated approach to account for surface heterogeneities."
PY - 2023/04/14
AU - Shrinjay  Sharma
AU - Marcello S. Rigutto
AU - Richard Baur
AU - Umang Agarwal
AU - Erik Zuidema
AU - Salvador R.G.  Balestra
AU - Sofia Calero
AU - David Dubbeldam
AU - Thijs Vlugt
UR - 
DO - 10.4121/9f0aec2f-8905-42ae-945d-32fbf4262969.v1
KW - Adsorption, Segregated Ideal Adsorbed Solution Theory, Segregated Explicit Adsorption Isotherm
N2 - <p>This folder contains simulation input files and datasets for calculation of pure component isotherms, mixture isotherms and breakthrough curves for the separation of:</p><p>1) CO2 and C3H8 molecules in MOR-type zeolite at 300K</p><p>2) nC4 and 2mC3 molecules in MFI-type zeolite at 400K</p>
ER -