Predicting Multicomponent Adsorption Isotherms in Open-Metal Site Materials Using Force Field Calculations Based on Energy Decomposed Density Functional Theory
Heinen, Jurn, Burtch, Nicholas C., Walton, Krista S., Fonseca Guerra, Célia, Dubbeldam, DavidLanguage:
english
Journal:
Chemistry - A European Journal
DOI:
10.1002/chem.201603895
Date:
November, 2016
File:
PDF, 1.25 MB
english, 2016