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Milica Todorović

Visiting researcher

Computational Electronic Structure Theory (www)

Research Fellow

Department of Applied Physics (www)
ProfileContactPublications

Person profile

Since 2015, I have been running the machine learning research projects of the Computational Electronic Structure Theory (CEST) group at Aalto University. We are interfacing machine learning algorithms with quantum mechanical simulations of materials with the aim to optimise material functionality. In particular, we seek to improve the performance of organic and inorganic components in solar cell devices. See more about our research on optimising organic/inorganic interfaces and data-driven materials science.


From 2021, I am an Assistant Professor in AI-driven Computational Materials Science at the Department of Mechanical and Materials Engineering of the University of Turku. I am currently a visiting researcher at the CEST group.

Person profile

I run the machine learning research projects of the Computational Electronic Structure Theory (CEST) group at Aalto University. We are interfacing machine learning algorithms with quantum mechanical simulations of materials with the aim to optimise material functionality. In particular, we seek to improve the performance of organic and inorganic components in solar cell devices. See more about our research on optimising organic/inorganic interfaces and data-driven materials science.

Background

I moved from Serbia to the UK to study physics at University College London, then I took a DPhil in Materials Science from Merton College at the University of Oxford in 2008. I went on to specialise in development and HPC applications of large-scale first principles calculations at the National Institute for Materials Science (Japan) and Universidad Autonoma de Madrid (Spain). I joined the CEST group of Patrick Rinke at Aalto University in 2015, and I started my own group at the University of Turku in 2021.

Background

I moved from Serbia to the UK to study physics at University College London, then I took a DPhil in Materials Science from Merton College at the University of Oxford in 2008. I went on to specialise in development and HPC applications of large-scale first principles calculations at the National Institute for Materials Science (Japan) and Universidad Autonoma de Madrid (Spain). I joined the CEST group of Patrick Rinke at Aalto University in 2015.

Keywords

Materials and sustainable use of natural resources
DFT
Bayesian machine learning
Materials science
High Performance Computing (HPC)
surfaces and interfaces
electronic structure

Contact information

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Work phone, landline

+358 50 433 2996

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Room number

Y426b

Postal address

Department of Applied Physics, Aalto University
P.O. Box 111
Espoo
Finland

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