Christoph Ortner

Nowadays, I spend most of my time on hybrid mechanistic/machine-learned interaction models for atoms and molecules, but am interested in many other topics as well (visit my homepage). My research on this topic straddles rigorous analysis and numerical analysis, scientific computing (algorithms), modelling and applications primarily in molecular modelling (usually with collaborators). Topics: Molecular simulation, Machine learning and coarse-graining Atomistic-continuum-quantum multi-scale methods, Crystal defects, Fracture mechanics, Numerical analysis, PDEs