Georg Kresse

15PUBLICATIONS
41CO-AUTHORS
Functional materialsComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Reaction engineering (excl. nuclear reactions)Degenerate quantum gases and atom opticsColloid and surface chemistry
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Publications (15)

|Jun 23, 2026
Scalar machine learning of tensorial quantities-Born effective charges from monopole models.

|May 20, 2026
Accurate thermophysical properties of water using machine-learned potentials.

|Dec 02, 2025
Equivariant machine learning of electric field gradients-Predicting the quadrupolar coupling constant in the MAPbI3 phase transition.

Bernhard Schmiedmayer, Jop W Wolffs, Gilles A de Wijs

|Apr 28, 2025
Self-Refinement of Auxiliary-Field Quantum Monte Carlo via Non-Orthogonal Configuration Interaction.

Zoran Sukurma, Martin Schlipf, Georg Kresse

|Feb 13, 2025
Structure and Dynamics of the Magnetite(001)/Water Interface from Molecular Dynamics Simulations Based on a Neural Network Potential.

Salvatore Romano, Pablo Montero de Hijes, Matthias Meier

|Jan 23, 2025
Author Correction: Layer-by-layer phase transformation in Ti<sub>3</sub>O<sub>5</sub> revealed by machine-learning molecular dynamics simulations.

Mingfeng Liu, Jiantao Wang, Junwei Hu

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Frequent Collaborators

3 joint publications

Bernhard Schmiedmayer

3 joint publications

Zoran Sukurma

2 joint publications

Haiyang Niu

2 joint publications

Moritz Humer