| 1 |
Dynamics and Rheology of Polymer Melts via Hierarchical Atomistic, Coarse-Grained, and Slip-Spring Simulations
Behbahani AF, Schneider L, Rissanou A, Chazirakis A, Bacova P, Jana PK, Li W, Doxastakis M, Polinska P, Burkhart C, Muller M, Harmandaris VA
Macromolecules, 54(6), 2740, 2021 |
| 2 |
Conformations and Dynamics of Polymer Chains in Cis and Trans Polybutadiene/Silica Nanocomposites through Atomistic Simulations: From the Unentangled to the Entangled Regime
Behbahani AF, Rissanou A, Kritikos G, Doxastakis M, Burkhart C, Polinska P, Harmandaris VA
Macromolecules, 53(15), 6173, 2020 |
| 3 |
Structure and Conformation of Stereoregular Poly(methyl methacrylate) Chains Adsorbed on Graphene Oxide and Reduced Graphene Oxide via Atomistic Simulations
Behbahani AF, Motlagh GH, Allaei SMV, Harmandaris VA
Macromolecules, 52(10), 3825, 2019 |
| 4 |
Structure, Dynamics, and Apparent Glass Transition of Stereoregular Poly(methyl methacrylate)/Graphene Interfaces through Atomistic Simulations
Behbahani AF, Allaei SMV, Motlagh GH, Eslami H, Harmandaris VA
Macromolecules, 51(19), 7518, 2018 |
