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project-a08-roberto-improved-dynamics-in-hybrid-particle-field-molecular-dynamics-simulations

Project A08: Roberto – Improved dynamics in hybrid particle-field molecular dynamics simulations of polymers

We pursue one of the approaches to generate coarse-grained polymer models with correct dynamical properties. If such models can be made predictive for, say, polymer melt...

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  • Projects - A: Dynamics
    • Project A08: Roberto – Improved dynamics in hybrid particle-field molecular dynamics simulations of polymers
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  • confinement - 1
  • Diffusion - 1
  • HPF-MD - 1
  • polymers - 1
  • Roberto method - 1
  • slip springs - 1

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1 dataset found

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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).
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    Uni Mainz
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