cff-version: 1.2.0
abstract: "<p>This folder contains simulation input files and datasets for estimation of Henry coefficient, enthalpy of adsorption at zero loading, pure component adsorption isotherms for C7 isomers in BEA-type zeolite at 500K and 576K.</p>"
authors:
  - family-names: Agarwal
    given-names: Umang
  - family-names: Rigutto
    given-names: Marcello S.
  - family-names: Zuidema
    given-names: Erik
  - family-names: Jansen
    given-names: A.P.J.
  - family-names: Poursaeidesfahani
    given-names: Ali
  - family-names: Sharma
    given-names: Shrinjay
  - family-names: Dubbeldam
    given-names: David
  - family-names: Vlugt
    given-names: Thijs J.H.
title: "Simulation files and data for &#34;Kinetics of zeolite-catalyzed heptane hydroisomerization and hydrocracking with CBMC-modeled adsorption terms: Zeolite Beta as a large pore base case&#34;"
keywords:
version: 1
identifiers:
  - type: doi
    value: 10.4121/85987b96-79b6-4ccd-a10c-7c4fb52c818f.v1
license: CC BY 4.0
date-released: 2023-04-14