CEST - Research overview
Theory and method development
Development of high-accuracy quantum-mechanical first-principles methods that can facilitates a better description of matter and unlocks new applications.
Contact persons: Marc Dvorak and Dorothea Golze
Electronic materials modeling
Computational modeling of novel electronic materials using density-functional-theory (DFT) and DFT-based multiscale methods
Contact person: Jingrui Li
Hybrid interfaces
Exploration of hybrid (organic-inorganic) interfaces in functional materials using DFT and DFT-based machine learning methods
Contact person: Milica Todorović
Machine learning materials science
Development of cutting-edge machine learning methods and application in modern materials science
Contact persons: Milica Todorović and Lauri Himanen
Database-driven materials science
Materials science research taking advantage of big data
Contact persons: Amber Gurts and Lauri Himanen