Sascha Klawohn

Implementation of Molecular Gradients for Local Hybrid Density Functionals Using Seminumerical Integration Techniques.

M. Kaupp, H. Bahmann, Sascha Klawohn, 2016, Journal of chemical theory and computation.

Electron transfer pathways in mixed‐valence paracyclophane‐bridged bis‐triarylamine radical cations

Christoph Lambert, Sascha Klawohn, Martin Kaupp, 2016, J. Comput. Chem..

Self-Consistent Implementation of Hybrid Functionals with Local Range-Separation.

Sascha Klawohn, Hilke Bahmann, H. Bahmann, 2020, Journal of chemical theory and computation.

MVO-10: A Gas-Phase Oxide Benchmark for Localization/Delocalization in Mixed-Valence Systems.

M. Kaupp, A. Karton, Sascha Klawohn, 2018, Journal of chemical theory and computation.

Gaussian approximation potentials: Theory, software implementation and application examples.

J. Kermode, Sascha Klawohn, Miguel A Caro, 2023, The Journal of chemical physics.

Massively parallel fitting of Gaussian approximation potentials

J. Kermode, Sascha Klawohn, Albert P. Bart'ok, 2022, Mach. Learn. Sci. Technol..