245 citations · 2.8k across the 42 of their papers we have counts for
4 papers · 1 filter
Phase diagrams in the lattice RPM model: from order-disorder to gas-liquid phase transition
Alexandre Diehl, Athanassios Z. Panagiotopoulos
The phase behavior of the lattice restricted primitive model (RPM) for ionic systems with additional short-range nearest neighbor (nn) repulsive interactions has been studied by gr…
Coarse-Grained Kinetic Computations for Rare Events: Application to Micelle Formation
Dmitry I. Kopelevich, Athanassios Z. Panagiotopoulos, Ioannis G. Kevrekidis
We discuss a coarse-grained approach to the computation of rare events in the context of grand canonical Monte Carlo (GCMC) simulations of self-assembly of surfactant molecules int…
Coarse Grained Computations for a Micellar System
Dmitry I. Kopelevich, Athanassios Z. Panagiotopoulos, Ioannis G. Kevrekidis
We establish, through coarse-grained computation, a connection between traditional, continuum numerical algorithms (initial value problems as well as fixed point algorithms) and at…
Monte Carlo study of shear-induced alignment of cylindrical micelles in thin films
Gaurav Arya, Athanassios Z. Panagiotopoulos
The behavior of confined cylindrical micelle-forming surfactants under the influence of shear has been investigated using Monte Carlo simulations. The surfactants are modeled as co…