Assessing the accuracy of improved force-matched water models derived from Ab initio molecular dynamics simulations. - Andreas Köster; Thomas Spura; Gábor Rutkai; Jan Kessler; Hendrik Wiebeler; Jadran Vrabec; Thomas D. Kühne (J. Comput. Chem., 2016)

A Massively Parallel Algorithm for the Approximate Calculation of Inverse p-th Roots of Large Sparse Matrices. - Michael Lass; Stephan Mohr; Hendrik Wiebeler; Thomas D. Kühne; Christian Plessl (PASC, 2018)