| Extension of the CL&Pol polarizable force field to electrolytes, protic ionic liquids, and deep eutectic solvents K Goloviznina, Z Gong, MF Costa Gomes, AAH Pádua Journal of Chemical Theory and Computation 17 (3), 1606-1617, 2021 | 71 | 2021 |
| The CL &Pol polarizable force field for the simulation of ionic liquids and eutectic solvents K Goloviznina, Z Gong, AAH Padua Wiley Interdisciplinary Reviews: Computational Molecular Science 12 (3), e1572, 2022 | 42 | 2022 |
| Predicting thermodynamic properties of alkanes by high-throughput force field simulation and machine learning Z Gong, Y Wu, L Wu, H Sun Journal of chemical information and modeling 58 (12), 2502-2516, 2018 | 31 | 2018 |
| Single‐Crystalline MFI Zeolite with Sheet‐Like Mesopores Layered along the a Axis Y Zhang, X Shen, Z Gong, L Han, H Sun, S Che Chemistry–A European Journal 25 (3), 738-742, 2019 | 22 | 2019 |
| Temperature transferability of force field parameters for dispersion interactions Z Gong, H Sun, BE Eichinger Journal of Chemical Theory and Computation 14 (7), 3595-3602, 2018 | 19 | 2018 |
| A Coarse-Grained Force Field Parameterized for MgCl2 and CaCl2 Aqueous Solutions Z Gong, H Sun Journal of chemical information and modeling 57 (7), 1599-1608, 2017 | 17 | 2017 |
| Effect of side chain modifications in imidazolium ionic liquids on the properties of the electrical double layer at a molybdenum disulfide electrode Z Gong, AAH Padua The Journal of Chemical Physics 154 (8), 2021 | 16 | 2021 |
| Charge transfer and polarisability in ionic liquids: a case study F Philippi, K Goloviznina, Z Gong, S Gehrke, B Kirchner, AAH Pádua, ... Physical Chemistry Chemical Physics 24 (5), 3144-3162, 2022 | 14 | 2022 |
| Bolaform molecules directing intergrown zeolites X Jia, Y Zhang, Z Gong, B Wang, Z Zhu, JG Jiang, H Xu, H Sun, L Han, ... The Journal of Physical Chemistry C 122 (16), 9117-9126, 2018 | 11 | 2018 |
| Extension of TEAM force-field database to ionic liquids Z Gong, H Sun Journal of Chemical & Engineering Data 64 (9), 3718-3730, 2019 | 10 | 2019 |
| Wiley Interdiscip K Goloviznina, Z Gong, AA Padua Rev.: Comput. Mol. Sci 15, 5858-5871, 2021 | 9 | 2021 |
| Pressure-viscosity relation of 2, 2, 4-trimethylhexane predicted using all-atom TEAM force field Z Gong, H Sun Fluid Phase Equilibria 497, 64-70, 2019 | 8 | 2019 |
| A high-throughput computing procedure for predicting vapor-liquid equilibria of binary mixtures–Using carbon dioxide and n-alkanes as examples F Cao, Z Gong, Y Wu, H Sun Fluid Phase Equilibria 452, 58-68, 2017 | 8 | 2017 |
| Agiliopadua/Fftool: XML Force Field Files, v1. 2.1 A Padua, K Goloviznina, Z Gong Zenodo: Geneve, Switzerland, 2021 | 5 | 2021 |
| Effects of selenium substitution on optical, electrochemical, and photovoltaic properties of oxindole-based π-conjugated polymers D Zhao, J Zheng, Z Gong, J Wu, J Tang, Q Zhang Organic Electronics 64, 131-137, 2019 | 5 | 2019 |
| Insights into the Absorption of Hydrocarbon Gases in Phosphorus-Containing Ionic Liquids SH McCalmont, ICM Vaz, H Oorts, Z Gong, L Moura, M Costa Gomes The Journal of Physical Chemistry B 127 (15), 3402-3415, 2023 | 2 | 2023 |
| Ionic liquids at interfaces with 2D and porous materials A Pádua, Z Gong, MS Santos, LB Tannous, A Steinberger, R Clark, ... Ionic Liquids and Materials–ILMAT 7, 2023 | | 2023 |
| Effect of Surface Chemistry on the Electrical Double Layer in a Long-Chain Ionic Liquid L Bou Tannous, M Simoes Santos, Z Gong, PH Haumesser, A Benayad, ... Langmuir 39 (47), 16785-16796, 2023 | | 2023 |
| Efficient Exploration of Chemical Compound Space Using Active Learning for Prediction of Thermodynamic Properties of Alkane Molecules Y Xiang, YH Tang, Z Gong, H Liu, L Wu, G Lin, H Sun Journal of Chemical Information and Modeling 63 (21), 6515-6524, 2023 | | 2023 |
| Transferable, Polarizable Force Field for Electrolytes, Protic Ionic Liquids and Deep Eutectic Solvents A Padua, K Goloviznina, MC Gomes, Z Gong | | 2020 |
