Efficient Prediction of Multicomponent Adsorption Isotherms and Enthalpies of Adsorption in MOFs Using Classical Density Functional Theory
利用经典密度泛函理论高效预测MOF中多组分吸附等温线和吸附焓
期刊:Journal of Physical Chemistry B
影响因子:2.9
doi:10.1021/acs.jpcb.5c08035
Thiele, Nadine; Teh, Tiong Wei; Bursik, Benjamin; Granderath, Marcel; Bauer, Gernot; Dufour-Décieux, Vincent; Rehner, Philipp; Stierle, Rolf; Bardow, André; Hansen, Niels; Gross, Joachim