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formation of polyhalogens. The applied methods will include first principles methods like DFT, both for finite and periodic systems, ab initio molecular dynamics simulations and calculations of various
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theoretical and practical experience with machine learning methods, especially for training of machine learning potentials - development and utilization of ab initio electronic-structure methodology - previous
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Max Planck Institute for the Structure and Dynamics of Matter, Hamburg | Hamburg, Hamburg | Germany | about 1 month ago
-Bahrenfeld and investigates non-equilibrium quantum phenomena down to elementary timescales. The theory department of A. Rubio is specialized on the ab-initio description of (quantized) light-matter
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