Structural and Dynamical Properties of Polyethylene/Graphene Nanocomposites through Molecular Dynamics Simulations

Graphene/Hyperbranched Polymer Nanocomposites: Insight from Molecular Dynamics Simulations

(2014) Kostas Karatasos   MACROMOLECULES

Determination of the Mechanical Properties of a Poly(methyl methacrylate) Nanocomposite with Functionalized Graphene Sheets through Detailed Atomistic Simulations

(2014) Emmanuel N. Skountzos et al.   MACROMOLECULES

Dynamics of various polymer–graphene interfacial systems through atomistic molecular dynamics simulations

(2014) Anastassia N. Rissanou et al.   Soft Matter

Molecular dynamics simulation of mechanical performance of graphene/graphene oxide paper based polymer composites

(2013) Jianwei Zhang et al.   CARBON

Molecular dynamics of polyisoprene/polystyrene oligomer blends: The role of self-concentration and fluctuations on blend dynamics

(2013) Vagelis Harmandaris et al.   JOURNAL OF CHEMICAL PHYSICS

Structure and dynamics of poly(methyl methacrylate)/graphene systems through atomistic molecular dynamics simulations

(2013) Anastassia N. Rissanou et al.   JOURNAL OF NANOPARTICLE RESEARCH

Molecular dynamics simulations of vinyl ester resin monomer interactions with a pristine vapor-grown carbon nanofiber and their implications for composite interphase formation

(2011) Sasan Nouranian et al.   CARBON

Molecular dynamics simulations of oxidized vapor-grown carbon nanofiber surface interactions with vinyl ester resin monomers

(2011) Changwoon Jang et al.   CARBON

On the Cartesian definition of orientational order parameters

(2011) Stefano S. Turzi   JOURNAL OF MATHEMATICAL PHYSICS

Crystallization of alkane melts induced by carbon nanotubes and graphene nanosheets: a molecular dynamics simulation study

(2011) Jun-Sheng Yang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Multiscale modeling of graphene- and nanotube-based reinforced polymer nanocomposites

(2011) A. Montazeri et al.   PHYSICS LETTERS A

Carbon Nanomaterials in Biosensors: Should You Use Nanotubes or Graphene?

(2010) Wenrong Yang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Recent advance in functionalized graphene/polymer nanocomposites

(2010) Dongyu Cai et al.   JOURNAL OF MATERIALS CHEMISTRY

Molecular Dynamics Simulations of Folding of Supported Graphene

(2010) Edson P. Bellido et al.   Journal of Physical Chemistry C

Effect of Chemisorption on the Interfacial Bonding Characteristics of Graphene−Polymer Composites

(2010) Cheng Lv et al.   Journal of Physical Chemistry C

Graphene/Polymer Nanocomposites

(2010) Hyunwoo Kim et al.   MACROMOLECULES

Simulation insights into thermally conductive graphene-based nanocomposites

(2010) D. Konatham et al.   MOLECULAR PHYSICS

Graphene-based polymer nanocomposites

(2010) Jeffrey R. Potts et al.   POLYMER

GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

(2008) Berk Hess et al.   Journal of Chemical Theory and Computation

Functionalized graphene sheets for polymer nanocomposites

(2008) T. Ramanathan et al.   Nature Nanotechnology