| Length scales and interfacial potentials in ion hydration Y Shi, TL Beck The Journal of chemical physics 139 (4), 2013 | 50 | 2013 |
| The importance of the water molecular quadrupole for estimating interfacial potential shifts acting on ions near the liquid–vapor interface CC Doyle, Y Shi, TL Beck The Journal of Physical Chemistry B 123 (15), 3348-3358, 2019 | 39 | 2019 |
| Deconstructing free energies in the law of matching water affinities Y Shi, T Beck The Journal of Physical Chemistry B 121 (9), 2189-2201, 2017 | 22 | 2017 |
| Absolute ion hydration free energy scale and the surface potential of water via quantum simulation Y Shi, TL Beck Proceedings of the National Academy of Sciences 117 (48), 30151-30158, 2020 | 19 | 2020 |
| Condensed Phase Water Molecular Multipole Moments from Deep Neural Network Models Trained on Ab Initio Simulation Data Y Shi, CC Doyle, TL Beck The Journal of Physical Chemistry Letters 12 (42), 10310-10317, 2021 | 16 | 2021 |
| Deep neural network based quantum simulations and quasi-chemical theory for accurate modeling of molten salt thermodynamics Y Shi, ST Lam, T Beck Chemical Science 13, 8265-8273, 2022 | 9 | 2022 |
| An Ion Specific Continuum Model on Ionic Surfactant's Binary Phase Diagram in Aqueous Solution Y Shi, TL Beck Journal of Molecular Liquids 408, 125293, 2024 | | 2024 |
