Concepedia

Oliver T. Unke

OT

29

Publications

2.6K

Citations

20

H-Index

2014

Active since

Affiliations

University of Basel(Current)

Technische Universität Berlin

Korea University

University of Luxembourg

Max Planck Institute for Informatics

Oliver T. Unke is an author at University of Basel specializing in natural sciences, engineering, and computational chemistry.

ORCID

Top concepts

Publications per year

2014–2025

29

Publications

29

PhysNet: A Neural Network for Predicting Energies, Forces, Dipole Moments, and Partial Charges

Oliver T. Unke, Markus Meuwly · Journal of Chemical Theory and Computation · 2019 · 1K citations · Full text

SpookyNet: Learning force fields with electronic degrees of freedom and nonlocal effects

Oliver T. Unke, Stefan Chmiela, Michael Gastegger et al. · Nature Communications · 2021 · 293 citations · Full text

Equivariant message passing for the prediction of tensorial properties and molecular spectra

Kristof T. Schütt, Oliver T. Unke, Michael Gastegger · arXiv (Cornell University) · 2021 · 263 citations · Full text

, , +19

Accurate global machine learning force fields for molecules with hundreds of atoms

Stefan Chmiela, Valentín Vassilev-Galindo, Oliver T. Unke et al. · Science Advances · 2023 · 154 citations · Full text

, , +17

Toolkit for the Construction of Reproducing Kernel-Based Representations of Data: Application to Multidimensional Potential Energy Surfaces

Oliver T. Unke, Markus Meuwly · Journal of Chemical Information and Modeling · 2017 · 131 citations

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