Tristan Bereau
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Prof. at Heidelberg University
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Recent Grants
Grant: Close
Machine learning for multiscale simulations (B07*)
Open Date: 2018-01-01
Close Date:
Grant: Close
Importance sampling of chemical compound space: Thermodynamic properties from high-throughput coarse-grained simulations
Open Date: 2016-01-01
Close Date:
Grant: Close
Dynamic heterogeneities in coarse-grained and fine-grained models of liquid crystals and ionic liquids (A06)
Open Date: 2014-01-01
Close Date:
Grant: Close
Integrated Research Training Group (MGK)
Open Date: 2014-01-01
Close Date:
Positions (1)
Tristan Bereau
Heidelberg University
PhD opportunity in generative machine learning for molecular thin films at the Institute for Theoretical Physics, Heidelberg University , in the group of Prof. Tristan Bereau , with a joint collaboration with Prof. Ullrich Köthe . The project focuses on developing generative machine-learning methods for amorphous molecular thin films , which are important supramolecular structures for organic-electronic materials . The research combines statistical mechanics , molecular simulation , and deep generative modeling , with an emphasis on diffusion models , coarse-grained representations, and free-energy estimation. The successful candidate should have a strong background in statistical mechanics , experience in machine learning and/or molecular simulation , and strong Python and PyTorch skills. A genuine interest in method development and comfort with mathematical formalism are important. A physics degree is required for admission to the Heidelberg Graduate School for Physics. The position is fully funded for three years at 75% E13 TV-L . There is no application deadline ; applications are reviewed on a rolling basis until the position is filled. To apply, send a CV , a short statement of interest , and the names of two referees to [email protected] .
Articles (10)
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2023
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2022
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2022
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2021
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2021
Collaborators (6)
Patrick Lambrix
Linköping University
Jan Münch
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Christian Carbogno
Fritz-Haber-Institut der Max-Planck-Gesellschaft
Thomas A. Vilgis
group leader, Prof. Dr.
Max Planck Institute for Polymer Research
Luca M. Ghiringhelli
Professor of data-driven materials modeling
Friedrich-Alexander Universität Erlangen-Nürnberg
Stefano Curtarolo
Edmund T. Pratt, Jr. Distinguished Professor
Duke University
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