Four-dimensional scaling of dipole polarizability in quantum systems P Szabó, S Góger, J Charry, MR Karimpour, DV Fedorov, A Tkatchenko Physical Review Letters 128 (7), 070602, 2022 | 30 | 2022 |
Comparison of hydrogen atom and hydroxyl radical reactions with simple aromatic molecules in aqueous solution R Homlok, V Mile, E Takács, G Járvás, S Góger, L Wojnárovits Chemical Physics 534, 110754, 2020 | 21 | 2020 |
Flame Inhibition Chemistry: Rate Coefficients of the Reactions of HBr with CH3 and OH Radicals at High Temperatures Determined by Quasiclassical Trajectory … S Góger, P Szabó, G Czakó, G Lendvay Energy & Fuels 32 (10), 10100-10105, 2018 | 17 | 2018 |
Data-Driven Tailoring of Molecular Dipole Polarizability and Frontier Orbital Energies in Chemical Compound Space S Góger, LM Sandonas, C Müller, A Tkatchenko Physical Chemistry Chemical Physics 25, 22211-22222, 2023 | 7 | 2023 |
Optimized quantum Drude oscillators for atomic and molecular response properties S Góger, A Khabibrakhmanov, O Vaccarelli, DV Fedorov, A Tkatchenko The Journal of Physical Chemistry Letters 14 (27), 6217-6223, 2023 | 7 | 2023 |
The role of zero-point vibration and reactant attraction in exothermic bimolecular reactions with submerged potential barriers: theoretical studies of the r+ hbr→ rh+ br (r … B Csorba, P Szabó, S Góger, G Lendvay The Journal of Physical Chemistry A 125 (38), 8386-8396, 2021 | 7 | 2021 |
libMBD: A general-purpose package for scalable quantum many-body dispersion calculations J Hermann, M Stöhr, S Góger, S Chaudhuri, B Aradi, RJ Maurer, ... The Journal of Chemical Physics 159 (17), 2023 | 5 | 2023 |
Formation of the BeH and BeD molecules in Be + H/D collisions through radiative association P Szabó, S Góger, M Gustafsson Frontiers in Astronomy and Space Sciences 8, 102, 2021 | 5 | 2021 |
Development of Practical Non-Local Many-Body Polarization Functionals S GOGER Unilu-Université du Luxembourg [Faculty of Science, Technology and Medicine …, 2023 | 1 | 2023 |
Four-Dimensional Scaling of Dipole Polarizability: From Single-Particle Models to Atoms and Molecules S Góger, MR Karimpour, A Tkatchenko Journal of Chemical Theory and Computation 20 (15), 6621-6631, 2024 | | 2024 |
Non-Local Polarizability Density and DFT S Goger, P Szabo, D Fedorov, A Tkatchenko Psi-k Conference, 2022 | | 2022 |
Formation of the BeH</SUP>+<//SUP> and BeD</SUP>+<//SUP> Molecules in Be</SUP>+<//SUP P Szabo, S Goger, M Gustafsson Frontiers in Astronomy and Space Sciences 8, 2021 | | 2021 |
Transferability of the Tkatchenko-Scheffler and the Many-body Dispersion Method Between Quantum Chemical Codes S Goger | | 2021 |
Toward a General Non-Local Polarizability Density Functional for van der Waals Dispersion Interactions S Góger, P Szabó, D Fedorov, A Tkatchenko APS March Meeting Abstracts 2021, B19. 008, 2021 | | 2021 |
Theoretical studies on the dynamics of the HO+ HBr→ H2O+ Br reaction S Goger, G Lendvay | | |