[HTML][HTML] Coarse-graining in simulations of multicomponent polymer systems

V Sethuraman, BH Nguyen, V Ganesan - The Journal of Chemical …, 2014 - pubs.aip.org
We investigate the mapping required between the interaction parameters of two different
coarse-grained simulation models to ensure a match of the long-range structural
characteristics of multicomponent polymeric system. The basis for our studies is the recent
work of Morse and workers, which demonstrated the existence of a mapping between the
interaction parameters of different coarse-grained simulation models which allow for a
matching of the peak of the disordered state structure factor in symmetric diblock …