| Accurate molecular polarizabilities with coupled cluster theory and machine learning DM Wilkins, A Grisafi, Y Yang, KU Lao, RA DiStasio, M Ceriotti Proceedings of the National Academy of Sciences 116 (9), 3401-3406, 2019 | 82 | 2019 |
| Predicting molecular dipole moments by combining atomic partial charges and atomic dipoles M Veit, DM Wilkins, Y Yang, RA DiStasio Jr, M Ceriotti The Journal of Chemical Physics 153 (2), 024113, 2020 | 21 | 2020 |
| Quantum mechanical static dipole polarizabilities in the QM7b and AlphaML showcase databases Y Yang, KU Lao, DM Wilkins, A Grisafi, M Ceriotti, RA DiStasio Scientific data 6 (1), 1-10, 2019 | 11 | 2019 |
| Oxyaapa: A Picolinate-Based Ligand with Five Oxygen Donors that Strongly Chelates Lanthanides A Hu, I Keresztes, SN MacMillan, Y Yang, E Ding, WR Zipfel, ... Inorganic chemistry 59 (7), 5116-5132, 2020 | 4 | 2020 |
| Designer Potential Energy Surfaces via Magnetic Interactions Y Yang, L Tu, Y Chen, D Leung, R Niu, HY Ko, Y Yang, Z Sparrow, ... Bulletin of the American Physical Society, 2021 | | 2021 |
| Enabling Linear Scaling Exact Exchange for Heterogeneous Systems HY Ko, Z Sparrow, M Andrade, O Crane, B Ernst, P Kotamnives, Y Yang, ... Bulletin of the American Physical Society, 2021 | | 2021 |
| Accurate Molecular Polarizabilities with Coupled Cluster Theory and Machine Learning Y Yang, KU Lao, D Wilkins, A Grisafi, M Ceriotti, R Distasio Bulletin of the American Physical Society, 2021 | | 2021 |
Robert A. DiStasio Jr.Assistant Professor, Chemistry and Chemical Biology, Cornell UniversityVerified email at cornell.edu
