Prediction of CO 2 Adsorption Properties in Zeolites Using Force Fields Derived from Periodic Dispersion-Corrected DFT Calculations
Fang, Hanjun, Kamakoti, Preeti, Zang, Ji, Cundy, Stephen, Paur, Charanjit, Ravikovitch, Peter I., Sholl, David S.Volume:
116
Language:
english
Journal:
The Journal of Physical Chemistry C
DOI:
10.1021/jp302433b
Date:
May, 2012
File:
PDF, 2.95 MB
english, 2012