Published: On

Webinar: Classical Forcefields for Modeling Materials on Atomic Scale

Classical forcefield-based simulations complement electronic structure methods. Accurately parameterized forcefield-based classical methods extend the scope and range of electronic structure methods to substantially larger length and time scales. While forcefield-based simulations can provide unique insights and property data, classical forcefields have been difficult to use and to develop. However, the latest developments of the MedeA®software environment provides state-of-the-art forcefield support along with powerful tools to develop and deploy forcefields in simulating sophisticated systems and solving complex problems. This webinar will provide a review on forcefields supported in the MedeA® environment and an update on the latest developments in MedeA® for forcefield development.


In this free webinar, you will: 

  • Learn the basics of forcefields and gain knowledge on the forcefields supported in the MedeA®environment. 
  • Review the openness and straightforwardness of forcefield support in MedeA® and observe how literature parameters can be imported.
  • Discover how the Forcefield Optimizer bridges the gap between quantum mechanical and classical methods 



Publish while: 
2017 Aug 22 - 11 - 2017 Sep 30 - 14

News & Views

Register here to learn how high throughput calculations in the MedeA Environment can accelerate searches in your design spaces

June 24 - 28, 2018. UCLA campus, Los Angeles, California, USA

Benoit Minisini and Alexander Mavromaras will give an invited talk at the 2018 Surfair Congress in Biarritz, France May 20-22, 2018

Curious about the MedeA GUI? Watch the webinar here

Did you miss the webinar? Watch the recording here.

Click here to see the new capabilities of 2.22