The webinar titled “Atomistic-scale Simulations of Realistic, Complex, Reactive Materials” provides an overview of ReaxFF and e-ReaxFF reactive force fields and their applications to 2D materials. The presentation discusses the principles of these force fields, their role in simulating chemical reactions at the atomistic scale, and showcases case studies on their use in various 2D materials. The goal is to illustrate the effectiveness of ReaxFF in predicting the properties and behaviors of complex reactive materials.
You can watch the complete webinar recording under the following link:
