| Efficient quantum vibrational spectroscopy of water with high-order path integrals: From bulk to interfaces S Shepherd, J Lan, DM Wilkins, V Kapil The Journal of Physical Chemistry Letters 12 (37), 9108-9114, 2021 | 24 | 2021 |
| Hydrogen-bonding and nuclear quantum effects in clays PKJ Kurapothula, S Shepherd, DM Wilkins The Journal of Chemical Physics 156 (8), 2022 | 3 | 2022 |
| A fully quantum-mechanical treatment for kaolinite S Shepherd, GA Tribello, DM Wilkins The Journal of Chemical Physics 158 (20), 2023 | 1 | 2023 |
| Competing Nuclear Quantum Effects and Hydrogen-Bond Jumps in Hydrated Kaolinite PKJ Kurapothula, S Shepherd, DM Wilkins The Journal of Physical Chemistry Letters 14 (6), 1542-1547, 2023 | 1 | 2023 |
| Learning Electronic Polarizations in Aqueous Systems A Jana, S Shepherd, Y Litman, DM Wilkins Journal of Chemical Information and Modeling, 2024 | | 2024 |
