Nano tools for macro problems: multiscale molecular modeling of nanostructured polymer systems

Modeling hierarchically structured nanoparticle/diblock copolymer systems

(2013) Zbyšek Posel et al.   Soft Matter

Interphase Structure in Silica–Polystyrene Nanocomposites: A Coarse-Grained Molecular Dynamics Study

(2011) Azadeh Ghanbari et al.   MACROMOLECULES

A molecular simulation approach to the prediction of the morphology of self-assembled nanoparticles in diblock copolymers

(2010) Paola Posocco et al.   JOURNAL OF MATERIALS CHEMISTRY

Current issues in research on structure–property relationships in polymer nanocomposites

(2010) J. Jancar et al.   POLYMER

A Complete Multiscale Modelling Approach for Polymer-Clay Nanocomposites

(2009) Giulio Scocchi et al.   CHEMISTRY-A EUROPEAN JOURNAL

Multiscale Computer Simulation Studies of Water-Based Montmorillonite/Poly(ethylene oxide) Nanocomposites

(2009) Radovan Toth et al.   MACROMOLECULES

Scripting approach in hybrid organic–inorganic condensation simulation: the GPTMS proof-of-concept

(2008) Marek Maly et al.   MOLECULAR SIMULATION

Many-scale molecular simulation for ABS–MMT nanocomposites: Upgrading of industrial scraps

(2007) Paolo Cosoli et al.   MICROPOROUS AND MESOPOROUS MATERIALS

Multiscale modeling and simulation of polymer nanocomposites

(2007) Q.H. Zeng et al.   PROGRESS IN POLYMER SCIENCE