Publications of Hyunwook Jung

All genres

Journal Article (2)

2023

Journal Article

S. Stocker, H. Jung, G. Csányi, C.F. Goldsmith, K. Reuter and J. Margraf: Estimating Free Energy Barriers for Heterogeneous Catalytic Reactions with Machine Learning Potentials and Umbrella Integration. Journal of Chemical Theory and Computation 19 (19), 6796–6804 (2023).

MPG.PuRe

DOI

publisher-version

Journal Article

H. Jung, L. Sauerland, S. Stocker, K. Reuter and J. Margraf: Machine-learning driven global optimization of surface adsorbate geometries. npj Computational Materials 9, 114 (2023).

MPG.PuRe

DOI

publisher-version