Constructing and representing exchange–correlation holes through artificial neural networks E Cuierrier, PO Roy, M Ernzerhof The Journal of Chemical Physics 155 (17), 2021 | 14 | 2021 |
The correlation factor approach: Combining density functional and wave function theory PO Roy, É Cuierrier, M Ernzerhof The Journal of Chemical Physics 152 (21), 2020 | 8 | 2020 |
The electron-centric approach to the exchange-correlation energy PO Roy, T Henkes, M Ernzerhof The Journal of Chemical Physics 159 (15), 2023 | 6 | 2023 |
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 | 5 | 2022 |
Generating exchange–correlation functionals with a simplified, self-consistent correlation factor model PO Roy, E Cuierrier, M Ernzerhof The Journal of Physical Chemistry A 127 (8), 2026-2033, 2023 | 3 | 2023 |
The factorization ansatz for non-local approximations to the exchange–correlation hole E Cuierrier, PO Roy, M Ernzerhof The Journal of Chemical Physics 156 (18), 2022 | 1 | 2022 |