We are hiring a postdoc to work on differentiable computational chemistry with Quantum Alchemy: https://stellen.uni-kassel.de/jobposting/9bf3de4c22f90c80e367f2e7511c2e94129733b70

Topics revolve around using response functions and (alchemical) derivatives to model and predict electronic structure properties. If you have any questions, please email vonrudorff||uni-kassel.de

About Us:
The lab at University of Kassel (nablachem.org) is a computational chemistry group investigating:

- How properties of molecules and materials change if you were to locally modify them, e.g. by replacing atoms with those of another element. Treating the system perturbatively in the context of quantum mechanics, allows us to optimize materials to have favourable properties without trying candidate materials one-by-one

- How to obtain property gradients in computational chemistry from e.g. quantum chemistry methods

- How to use such gradient information efficiently in machine learning applications

Please apply online: https://stellen.uni-kassel.de/jobposting/9bf3de4c22f90c80e367f2e7511c2e94129733b70