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Mobility of polymer melts in a regular array of carbon nanotubes
Simulation of the diffusion in polymer melts in an array of obstacles (here: carbon nanotubes) using the Roberto method (HPFZ-MD + slip-springs). -
Viscosity calculations on Lennard Jones Fluids with the HPF-MPCD method
This dataset provides benchmark and validation for rheological properties, specifically shear viscosity, obtained using hybrid particle-field (hPF/HPF) molecular dynamics. In...