Training

Each Thursday, this UGM series will feature online training sessions with members of the Materials Design Team.
 
The training sessions provide an exclusive opportunity to learn about the MedeA Environment, new capabilities, and to interact with Materials Design researchers and developers. Topics will relate to the presentations given by the plenary speakers.

The training agenda is available below. Registration is now open for all sessions.

MedeA Training: Simulations of Gas Separation Through Nanofiltration

MedeA Training: Simulations of Gas Separation Through Nanofiltration

Registration available soon

October 6, 2022, 8:00 AM PDT

This training session will focus on an atomic scale approach to simulate a pressure-driven gas separation process involving a nanoporous polymer membrane.

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Rene Windiks
MedeA Training: Generating and Applying Machine-Learned Potentials with MedeA

MedeA Training: Generating and Applying Machine-Learned Potentials with MedeA

Registration available soon

October 13, 2022, 8:00 AM PDT

This session introduces MedeA's Machine-Learned Potential Generator (MLPG), which allows to generate MLPs in a highly efficient manner for a given set of training structures.

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David Reith
MedeA Training: On-the-fly Machine-Learning Forcefields with MedeA VASP

MedeA Training: On-the-fly Machine-Learning Forcefields with MedeA VASP

Registration available soon

October 20, 2022, 8:00 AM PDT

This UGM training session will demonstrate the recent machine learning force field (MLFF) capability using MedeA VASP.

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Xiaoli Liu
Shubham Pandey
MedeA Training: Multiscale Modeling of Polymers Using the MedeA Environment

MedeA Training: Multiscale Modeling of Polymers Using the MedeA Environment

Registration available soon

October 27, 2022, 8:00 AM PDT

We will demonstrate how to build both atomistic and coarse-grained models of polymers using the amorphous builder, and how to run simulations with the LAMMPS and Gibbs molecular dynamics and Monte Carlo codes.

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Jörg-Rüdiger Hill
Marianna Yiannourakou
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