| Fermionic statistics in the strongly correlated limit of Density Functional Theory J Grossi, DP Kooi, KJH Giesbertz, M Seidl, AJ Cohen, P Mori-Sánchez, ... Journal of chemical theory and computation 13 (12), 6089-6100, 2017 | 28 | 2017 |
| Integrative modeling strategies for predicting drug toxicities at the eTOX project F Sanz, P Carrió, O López, L Capoferri, DP Kooi, NPE Vermeulen, ... Molecular Informatics 34 (6‐7), 477-484, 2015 | 25 | 2015 |
| Electronic excited states in extreme limits via ensemble density functionals T Gould, DP Kooi, P Gori-Giorgi, S Pittalis Physical review letters 130 (10), 106401, 2023 | 24 | 2023 |
| Large coupling-strength expansion of the Møller–Plesset adiabatic connection: From paradigmatic cases to variational expressions for the leading terms KJ Daas, J Grossi, S Vuckovic, ZH Musslimani, DP Kooi, M Seidl, ... The Journal of chemical physics 153 (21), 2020 | 23 | 2020 |
| The effect of N-acetylcysteine on brain glutamate and gamma-aminobutyric acid concentrations and on smoking cessation: a randomized, double-blind, placebo-controlled trial MHJ Schulte, AE Goudriaan, AM Kaag, DP Kooi, W Van Den Brink, ... Journal of Psychopharmacology 31 (10), 1377-1379, 2017 | 22 | 2017 |
| Gradient expansions for the large-coupling strength limit of the Møller–Plesset adiabatic connection KJ Daas, DP Kooi, AJAF Grooteman, M Seidl, P Gori-Giorgi Journal of chemical theory and computation 18 (3), 1584-1594, 2022 | 18 | 2022 |
| A variational approach to london dispersion interactions without density distortion DP Kooi, P Gori-Giorgi The journal of physical chemistry letters 10 (7), 1537-1541, 2019 | 18 | 2019 |
| Improving the iterative Linear Interaction Energy approach using automated recognition of configurational transitions CR Vosmeer, DP Kooi, L Capoferri, MM Terpstra, NPE Vermeulen, ... Journal of molecular modeling 22, 1-8, 2016 | 17 | 2016 |
| Local and global interpolations along the adiabatic connection of DFT: a study at different correlation regimes DP Kooi, P Gori-Giorgi Theoretical chemistry accounts 137, 1-12, 2018 | 16 | 2018 |
| eTOX ALLIES: an automated pipeLine for linear interaction energy-based simulations L Capoferri, M van Dijk, AS Rustenburg, TA Wassenaar, DP Kooi, EA Rifai, ... Journal of cheminformatics 9, 1-13, 2017 | 10 | 2017 |
| Regularized and Opposite Spin-Scaled Functionals from Møller–Plesset Adiabatic Connection─ Higher Accuracy at Lower Cost KJ Daas, DP Kooi, NC Peters, E Fabiano, F Della Sala, P Gori-Giorgi, ... The Journal of Physical Chemistry Letters 14 (38), 8448-8459, 2023 | 9 | 2023 |
| London dispersion forces without density distortion: a path to first principles inclusion in density functional theory DP Kooi, P Gori-Giorgi Faraday Discussions 224, 145-165, 2020 | 8 | 2020 |
| Real-space Mott-Anderson electron localization with long-range interactions A Marie, DP Kooi, J Grossi, M Seidl, ZH Musslimani, KJH Giesbertz, ... Physical Review Research 4 (4), 043192, 2022 | 6 | 2022 |
| Large-Z atoms in the strong-interaction limit of DFT: Implications for gradient expansions and for the Lieb–Oxford bound KJ Daas, DP Kooi, T Benyahia, M Seidl, P Gori-Giorgi The Journal of Chemical Physics 159 (23), 2023 | 5 | 2023 |
| Dispersion without many-body density distortion: Assessment on atoms and small molecules DP Kooi, T Weckman, P Gori-Giorgi Journal of chemical theory and computation 17 (4), 2283-2293, 2021 | 4 | 2021 |
| The Lieb-Oxford bound and the optimal transport limit of DFT M Seidl, T Benyahia, DP Kooi, P Gori-Giorgi arXiv preprint arXiv:2202.10800, 2022 | 3 | 2022 |
| Highly accurate real-space electron densities with neural networks L Cheng, PB Szabó, Z Schätzle, DP Kooi, J Köhler, KJH Giesbertz, F Noé, ... The Journal of Chemical Physics 162 (3), 2025 | 2 | 2025 |
| Efficient bosonic and fermionic Sinkhorn algorithms for non-interacting ensembles in one-body reduced density matrix functional theory in the canonical ensemble DP Kooi arXiv preprint arXiv:2205.15058, 2022 | 2 | 2022 |
| New density-functional approximations and beyond: general discussion JG Brandenburg, K Burke, A Cancio, J Erhard, E Fromager, A Ghosal, ... Faraday Discussions 224, 166-200, 2020 | 1 | 2020 |
| Testing Local Interpolations along the Adiabatic Connection in Density Functional Theory DP Kooi | | |
Paola Gori-GiorgiMicrosoft Research AI for ScienceVerified email at microsoft.com