Size-consistent explicitly correlated triple excitation correction M Kállay, RA Horváth, L Gyevi-Nagy, PR Nagy Journal of Chemical Physics 155, 034107, 2021 | 20 | 2021 |
Adsorption of Methylamine on amorphous ice under interstellar conditions. A grand canonical Monte Carlo simulation study RA Horváth, G Hantal, S Picaud, M Szőri, P Jedlovszky The Journal of Physical Chemistry A 122 (13), 3398-3412, 2018 | 15 | 2018 |
Basis set limit CCSD (T) energies for extended molecules via a reduced-cost explicitly correlated approach M Kállay, RA Horváth, L Gyevi-Nagy, PR Nagy Journal of Chemical Theory and Computation 19 (1), 174-189, 2022 | 12 | 2022 |
Surface affinity of alkali and halide ions in their aqueous solution: insight from intrinsic density analysis G Hantal, RA Horváth, J Kolafa, M Sega, P Jedlovszky The Journal of Physical Chemistry B 124 (44), 9884-9897, 2020 | 12 | 2020 |
Investigation of the liquid-vapour interface of aqueous methylamine solutions by computer simulation methods RA Horvath, B Fabian, M Szőri, P Jedlovszky Journal of Molecular Liquids 288, 110978, 2019 | 11 | 2019 |
Computer Simulation Investigation of the Adsorption of Cyanamide on Amorphous Ice at Low Temperatures P Jedlovszky, RA Horváth, M Szőri The Journal of Physical Chemistry C 124 (19), 10615-10626, 2020 | 10 | 2020 |
Thermodynamics of mixing methanol with supercritical CO 2 as seen from computer simulations and thermodynamic integration RA Horváth, G Horvai, A Idrissi, P Jedlovszky Physical Chemistry Chemical Physics 22 (20), 11652-11662, 2020 | 7 | 2020 |
Adsorption of acetamide on crystalline and amorphous ice under atmospheric conditions. A grand canonical Monte Carlo simulation study M Balbisi, RA Horvath, M Szőri, P Jedlovszky Journal of Molecular Liquids 354, 118870, 2022 | 3 | 2022 |
Computer simulation investigation of the adsorption of acetamide on low density amorphous ice. An astrochemical perspective M Balbisi, RA Horváth, M Szőri, P Jedlovszky The Journal of Chemical Physics 156 (18), 2022 | 3 | 2022 |
Which model density is best in pair natural orbital local correlation theory? RA Horváth, K Sorathia, I Saint, DP Tew Chemical Physics Letters, 141144, 2024 | | 2024 |
Basis set limit MP2 energies for extended molecules via a reduced-cost explicitly correlated approach RA Horváth, M Kállay Molecular Physics, e2304103, 2024 | | 2024 |