Simulating the Reactions of CO 2 in Aqueous Monoethanolamine Solution by Reaction Ensemble Monte Carlo Using the Continuous Fractional Component Method
Balaji, Sayee Prasaad, Gangarapu, Satesh, Ramdin, Mahinder, Torres-Knoop, Ariana, Zuilhof, Han, Goetheer, Earl L.V., Dubbeldam, David, Vlugt, Thijs J.H.Volume:
11
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.5b00160
Date:
June, 2015
File:
PDF, 948 KB
english, 2015