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Modeling with mathematical tools

Hillert Modeling Laboratory makes computational modeling tools for materials science more available, together with the corresponding expertise.

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Tutorials for our most sought-after tools, led by experts connected to Hillert Modelling Laboratory.

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The modeling tools from the Department of Materials Science and Engineering, as well as those from partner developers.

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Watch the most recent colloquium

2025-01-21

Hillert Materials Modeling Colloquium series XXIV: Theoretical simulations of materials at extreme conditions – towards knowledge-based design of metastable materials with advanced functionality

In this talk, Professor Igor Abrikosov demonstrates the capabilities of state-of-the-art theoretical simulations to verify the crystal structure of compounds discovered in HPHT experiments, predict their (meta-)stability under ambient conditions, and disclose materials properties that are attractive for applications. These simulations can, for instance, be useful for material synthesis under TPa compression and temperatures above 2000 K, as well as for the development of new materials with exciting crystal chemistry and physical properties.

Watch the seminar at KTH Play: play.kth.se/media/Abrikosov+2025.01.21/0_es2c8oyl