Opposing Electronic and Nuclear Quantum Effects on Hydrogen Bonds in O and O
T. Clark, J.J. Heske, T. Kühne, ChemPhysChem 20 (2019) 1–6.

Assessing the accuracy of improved force-matched water models derived from Ab initio molecular dynamics simulations
A. Köster, T. Spura, G. Rutkai, J. Kessler, H. Wiebeler, J. Vrabec, T.D. Kühne, Journal of Computational Chemistry 37 (2016) 1828–1838.