Ab initio prediction of proton exchange barriers for alkanes at Brønsted sites of zeolite H-MFI M Rybicki, J Sauer Journal of the American Chemical Society 140 (51), 18151-18161, 2018 | 63 | 2018 |
Interaction of C3–C5 Alkenes with Zeolitic Brønsted Sites: π-Complexes, Alkoxides, and Carbenium Ions in H-FER Q Ren, M Rybicki, J Sauer The Journal of Physical Chemistry C 124 (18), 10067-10078, 2020 | 44 | 2020 |
Adsorption and cracking of propane by zeolites of different pore size F Berger, M Rybicki, J Sauer Journal of Catalysis 395, 117-128, 2021 | 39 | 2021 |
Acidity of two-dimensional zeolites M Rybicki, J Sauer Physical Chemistry Chemical Physics 17 (41), 27873-27882, 2015 | 38 | 2015 |
Solvation of calcium ions in methanol− water mixtures: molecular dynamics simulation E Owczarek, M Rybicki, E Hawlicka The journal of physical chemistry B 111 (51), 14271-14278, 2007 | 27 | 2007 |
Acid strength of zeolitic Brønsted sites—Dependence on dielectric properties M Rybicki, J Sauer Catalysis Today 323, 86-93, 2019 | 26 | 2019 |
Solvation of Mg2+ ions in methanol–water mixtures: Molecular dynamics simulation M Rybicki, E Hawlicka Chemical Physics 400, 79-85, 2012 | 16 | 2012 |
Molecular Dynamics with Chemical Accuracy─ Alkane Adsorption in Acidic Zeolites F Berger, M Rybicki, J Sauer ACS Catalysis 13 (3), 2011-2024, 2023 | 13 | 2023 |
Influence of ions on molecular vibrations and hydrogen bonds in methanol–water mixtures: MD simulation study M Rybicki, E Hawlicka Journal of Molecular Liquids 196, 300-307, 2014 | 13 | 2014 |
Rigid Body Approximation for the Anharmonic Description of Molecule–Surface Vibrations M Rybicki, J Sauer Journal of Chemical Theory and Computation 18 (9), 5618-5635, 2022 | 11 | 2022 |
Multi-Level Energy Landscapes: The MonaLisa Program FA Bischoff, M Alessio, M John, M Rybicki, J Sauer Humboldt-University of Berlin, 2017 | 11 | 2017 |
Influence of CaCl2 on microheterogeneity of methanol–water mixtures E Owczarek, M Rybicki, E Hawlicka Chemical Physics 363 (1-3), 78-87, 2009 | 10 | 2009 |
Structure and stability of ultrathin Fe films on W (110) B Santos, M Rybicki, I Zasada, E Starodub, KF McCarty, JI Cerda, ... Physical Review B 93 (19), 195423, 2016 | 9 | 2016 |
A LEED study of surface relaxation in Fe (1 1 0) epitaxial film on W (1 1 0) M Rybicki, I Zasada, K Freindl, N Spiridis, J Korecki Applied surface science 286, 66-70, 2013 | 7 | 2013 |
Dual-Site Model for Ab Initio Calculations of Gibbs Free Energies and Enthalpies of Adsorption: Methane in Zeolite Mobile Five (H-MFI) M Rybicki, K Sillar, J Sauer The Journal of Physical Chemistry Letters 13 (50), 11595-11600, 2022 | 6 | 2022 |
Noncollinear spin reorientation transition in S= 1 ferromagnetic thin films M Rybicki, I Zasada Journal of Physics: Condensed Matter 24 (38), 386005, 2012 | 5 | 2012 |
MD Simulation of the ion solvation in methanol-water mixtures E Hawlicka, M Rybicki Molecular Dynamics—Theoretical Developments and Applications in …, 2012 | 4 | 2012 |
Comparison of Proton Exchange Barriers for N-Butane and I-Butane at Brønsted Sites of Zeolite H-MFI M Rybicki, J Sauer 2019 North American Catalysis Society Meeting, 2019 | | 2019 |
Accurate Proton Exchange Barriers for Small Alkanes in Zeolite H-MFI J Sauer, M Rybicki 25th North American Catalysis Society Meeting, 2017 | | 2017 |