Jan Hermann

15PUBLICATIONS
135CO-AUTHORS
Theoretical quantum chemistryFormal methods for softwareComputational chemistryDegenerate quantum gases and atom opticsStatistical mechanics, physical combinatorics and mathematical aspects of condensed matter
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Publications (15)

|Sep 20, 2026
An ab initio foundation model of wavefunctions that accurately describes chemical bond breaking.

|Sep 10, 2026
The Python simulations of chemistry framework: 10 years of an open-source quantum chemistry project.

|Apr 24, 2026
Accurate Chemistry Collection: Coupled cluster atomization energies for broad chemical space.

|Sep 02, 2025
Chemical Space Exploration with Artificial "Mindless" Molecules.

Thomas Gasevic, Marcel Müller, Jonathan Schöps

|Jan 21, 2025
Highly accurate real-space electron densities with neural networks.

Lixue Cheng, P Bernát Szabó, Zeno Schätzle

|Nov 16, 2023
Variational principle to regularize machine-learned density functionals: The non-interacting kinetic-energy functional.

Pablo Del Mazo-Sevillano, Jan Hermann

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Frequent Collaborators

5 joint publications

Frank Noé

4 joint publications

Alexandre Tkatchenko

3 joint publications

Zeno Schätzle

3 joint publications

Martin Stöhr