23 citations · 23 across the 2 of their papers we have counts for
3 papers
Accurate and Transferable Intermolecular Potential Based on Machine-Learned Molecular Electron Density
Dahvyd Wing, Mihail Bogojeski, Szabolcs Goger +2
Machine-learned force fields (MLFFs) contain many learnable parameters and therefore require large training datasets. This poses a challenge for developing highly accurate, general…
libMBD: A general-purpose package for scalable quantum many-body dispersion calculations
Jan Hermann, Martin Stöhr, Szabolcs Góger +4
Many-body dispersion (MBD) is a powerful framework to treat van der Waals (vdW) dispersion interactions in density-functional theory and related atomistic modeling methods. Several…
Optimized Quantum Drude Oscillators for Atomic and Molecular Response Properties
Szabolcs Góger, Almaz Khabibrakhmanov, Ornella Vaccarelli +2
The quantum Drude oscillator (QDO) is an efficient yet accurate coarse-grained approach that has been widely used to model electronic and optical response properties of atoms and m…