| Improving small molecule force fields by identifying and characterizing small molecules with inconsistent parameters JN Ehrman, VT Lim, CC Bannan, N Thi, DY Kyu, DL Mobley Journal of computer-aided molecular design 35, 271-284, 2021 | 18 | 2021 |
| Efficient evaluation of the Breit operator in the Pauli spinor basis S Sun, J Ehrman, Q Sun, X Li The Journal of Chemical Physics 157 (6), 2022 | 17 | 2022 |
| Scalar Breit interaction for molecular calculations S Sun, J Ehrman, T Zhang, Q Sun, KG Dyall, X Li The Journal of Chemical Physics 158 (17), 2023 | 8 | 2023 |
| Improving One-Electron Exact-Two-Component Relativistic Methods with the Dirac–Coulomb–Breit-Parameterized Effective Spin–Orbit Coupling J Ehrman, E Martinez-Baez, AJ Jenkins, X Li Journal of Chemical Theory and Computation 19 (17), 5785-5790, 2023 | 4 | 2023 |
| Improving Force Fields by Identifying and Characterizing Small Molecules with Parameter Inconsistencies JN Ehrman, CC Bannan, VT Lim, N Thi, DY Kyu, DL Mobley ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019 | 3 | 2019 |
| Unveiling Hidden Shake-Up Features in the Uranyl M4-Edge Spectrum JN Ehrman, K Shumilov, AJ Jenkins, JM Kasper, T Vitova, ER Batista, ... JACS Au 4 (3), 1134-1141, 2024 | | 2024 |
| 1Department of Pharmaceutical Sciences, University of California, Irvine, Irvine, California 92697, United States JN Ehrman, VT Lim, C Caitlin | | |
