ICTP-East African Institute for Fundamental Research
KIST2 Building CST
Nyarugenge Campus
University of Rwanda
Kigali, Rwanda
News
EAIFR Online Seminar: Giulia Galli
Title: Quantum simulations of materials for sustainable energy generation and use
02 DEC 2021
Machine Learning for Electronic Structure and Molecular Dynamics
In the study of known materials and the prediction of the properties of new ones, electronic structure (ES) methods as well as atomistic simulations such as molecular dynamics (MD) have proved to be formidable tools and have facilitated the development of new materials. Machine learning (ML) and Artificial Intelligence (AI) offer systematic approaches to address a number of problems to broaden the scope of traditional ES and MD simulations.
01 Oct 2021
