| Emergence of complexity in hierarchically organized chiral particles W Jiang, Z Qu, P Kumar, D Vecchio, Y Wang, Y Ma, JH Bahng, ... Science 368 (6491), 642-648, 2020 | 255 | 2020 |
| Enhanced optical asymmetry in supramolecular chiroplasmonic assemblies with long-range order J Lu, Y Xue, K Bernardino, NN Zhang, WR Gomes, NS Ramesar, S Liu, ... Science 371 (6536), 1368-1374, 2021 | 241 | 2021 |
| Effect of alkyl-group flexibility on the melting point of imidazolium-based ionic liquids K Bernardino, Y Zhang, MCC Ribeiro, EJ Maginn The Journal of Chemical Physics 153 (4), 2020 | 29 | 2020 |
| Aggregation thermodynamics of sodium octanoate micelles studied by means of molecular dynamics simulations K Bernardino, AF de Moura The Journal of Physical Chemistry B 117 (24), 7324-7334, 2013 | 25 | 2013 |
| Surface electrostatic potential and water orientation in the presence of sodium octanoate dilute monolayers studied by means of molecular dynamics simulations K Bernardino, AF de Moura Langmuir 31 (40), 10995-11004, 2015 | 19 | 2015 |
| Thermodynamic insights into the self-assembly of capped nanoparticles using molecular dynamic simulations AF de Moura, K Bernardino, CJ Dalmaschio, ER Leite, NA Kotov Physical Chemistry Chemical Physics 17 (5), 3820-3831, 2015 | 17 | 2015 |
| Low-temperature phase transitions of the ionic liquid 1-ethyl-3-methylimidazolium dicyanamide K Bernardino, TA Lima, MCC Ribeiro The Journal of Physical Chemistry B 123 (44), 9418-9427, 2019 | 15 | 2019 |
| Solvation of sodium octanoate micelles in concentrated urea solution studied by means of molecular dynamics simulations AF de Moura, K Bernardino, OV de Oliveira, LCG Freitas The Journal of Physical Chemistry B 115 (49), 14582-14590, 2011 | 15 | 2011 |
| Role of density and electrostatic interactions in the viscosity and non-newtonian behavior of ionic liquids–a molecular dynamics study K Bernardino, MCC Ribeiro Physical Chemistry Chemical Physics 24 (11), 6866-6879, 2022 | 13 | 2022 |
| Vibrational spectroscopy and molecular dynamics simulation of choline oxyanions salts ÍFT de Souza, VH Paschoal, K Bernardino, TA Lima, LL Daemen, ... Journal of Molecular Liquids 340, 117100, 2021 | 13 | 2021 |
| Ion pair free energy surface as a probe of ionic liquid structure K Bernardino, K Goloviznina, MC Gomes, AAH Pádua, MCC Ribeiro The Journal of Chemical Physics 152 (1), 2020 | 13 | 2020 |
| Pressure and shear rate effects on viscosity and structure of imidazolium-based ionic liquids K Bernardino, MCC Ribeiro Fluid Phase Equilibria 554, 113345, 2022 | 10 | 2022 |
| Hydrogen-bonding and symmetry breaking in the protic ionic liquid 1-ethylimidazolium nitrate K Bernardino, MCC Ribeiro Vibrational Spectroscopy 120, 103358, 2022 | 8 | 2022 |
| Electrostatic potential and counterion partition between flat and spherical interfaces K Bernardino, A Farias de Moura The Journal of Chemical Physics 150 (7), 2019 | 7 | 2019 |
| Optical anisotropy and sign reversal in layer-by-layer assembled films from chiral nanoparticles Z Liang, K Bernardino, J Han, Y Zhou, K Sun, AF de Moura, NA Kotov Faraday Discussions 191, 141-157, 2016 | 7 | 2016 |
| Relating the structure and dynamics of ionic liquids under shear by means of reverse non-equilibrium molecular dynamics simulations K Bernardino, MCC Ribeiro Physical Chemistry Chemical Physics 23 (25), 13984-13995, 2021 | 6 | 2021 |
| Themis: a software to assess association free energies via direct estimative of partition functions F Colombari, A Lozada-Blanco, K Bernardino, W Gomes, AF de Moura | 5 | 2020 |
| Pinpointing disulfide connectivities in cysteine-rich proteins K Bernardino, MEF Pinto, VS Bolzani, AF De Moura, JMB Junior Chemical Communications 53 (53), 7337-7340, 2017 | 5 | 2017 |
| Confined ionic liquids films under shear: The importance of the chemical nature of the solid surface K Bernardino, MCC Ribeiro The Journal of Chemical Physics 158 (9), 2023 | 4 | 2023 |
| Graph Theoretical Description of Phase Transitions in Complex Multiscale Phases with Supramolecular Assemblies R Yang, K Bernardino, X Xiao, WR Gomes, DA Mattoso, NA Kotov, ... Advanced Science 11 (33), 2402464, 2024 | 3* | 2024 |