The correlation factor model for the exchange-correlation energy and its application to transition metal compounds R Wang, Y Zhou, M Ernzerhof The Journal of Chemical Physics 150 (8), 2019 | 15 | 2019 |
Construction of self-interaction-corrected exchange-correlation functionals within the correlation factor approach R Wang, Y Zhou, M Ernzerhof The Journal of Chemical Physics 151 (19), 2019 | 10 | 2019 |
Fourth-order series expansion of the exchange hole R Wang, Y Zhou, M Ernzerhof Physical Review A 96 (2), 022502, 2017 | 8 | 2017 |
The fourth-order expansion of the exchange hole and neural networks to construct exchange–correlation functionals E Cuierrier, PO Roy, R Wang, M Ernzerhof The Journal of Chemical Physics 157 (17), 2022 | 2 | 2022 |
Accelerated Organic Crystal Structure Prediction with Genetic Algorithms and Machine Learning A Kadan, K Ryczko, A Wildman, R Wang, A Roitberg, T Yamazaki Journal of Chemical Theory and Computation 19 (24), 9388-9402, 2023 | 1 | 2023 |
Massively parallel quantum chemistry: PFAS on over 1 million cloud vCPUs AE Rask, L Huntington, SY Kim, D Walker, A Wildman, R Wang, N Hazel, ... arXiv preprint arXiv:2307.10675, 2023 | 1 | 2023 |