Asta Research Group
Computational Materials Science

Overview

Our research involves the use of state-of-the-art computational tools in the modeling and design of complex materials systems for structural and energy related applications. In this context, first-principles-based atomic-scale modeling and simulation methods are applied in studies of the structural, thermodynamic and dynamic properties of bulk phases, surfaces and interfaces.

Alloy Design

Interfacial Phenomena

Materials for Energy Applications
 

Group News



April 18, 2016:
Congratulations to Rodrigo Freitas for passing his PhD qualifying exam!

April 4, 2016:
The group welcomes new visiting scholar, Ankit Gupta from the Max Planck Institute for Iron Research in Dusseldorf, Germany.

March 14, 2016:
The group welcomes new Post-doc,Wei Xie to the group.


For more news go to our group activities page.