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Katherine Hollingsworth

Webinar: Atomistic-Scale Simulations of Real, Messy, Nasty, and Complex Reactive Materials – The Rea


Presented by Professor Adri van Duin from Pennsylvania State University
Dr. Ray Shan from Materials Design, Inc.

Attend this free webinar to:

  • Learn about modern reactive forcefields like ReaxFF

  • Evaluate the current ReaxFF application range and learn about recent developments, including explicit electron transfer and metadynamics

  • Learn the basics of setting up ReaxFF simulations

  • Understand the MedeA LAMMPS system including the import of any external ReaxFF parameter files in to MedeA

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