| On the universality of the long-/short-range separation in multiconfigurational density-functional theory E Fromager, J Toulouse, HJA Jensen The Journal of chemical physics 126 (7), 2007 | 208 | 2007 |
| DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science AM Teale, T Helgaker, A Savin, C Adamo, B Aradi, AV Arbuznikov, ... Physical chemistry chemical physics 24 (47), 28700-28781, 2022 | 188 | 2022 |
| Multi-configuration time-dependent density-functional theory based on range separation E Fromager, S Knecht, HJA Jensen The Journal of Chemical Physics 138 (8), 2013 | 107 | 2013 |
| Merging multireference perturbation and density-functional theories by means of range separation: Potential curves for , , and E Fromager, R Cimiraglia, HJA Jensen Physical Review A—Atomic, Molecular, and Optical Physics 81 (2), 024502, 2010 | 73 | 2010 |
| Self-consistent many-body perturbation theory in range-separated density-functional theory: A one-electron reduced-density-matrix-based formulation E Fromager, HJA Jensen Physical Review A—Atomic, Molecular, and Optical Physics 78 (2), 022504, 2008 | 69 | 2008 |
| Generalised adiabatic connection in ensemble density-functional theory for excited states: example of the H2 molecule O Franck, E Fromager Molecular Physics 112 (12), 1684-1701, 2014 | 67 | 2014 |
| On the universality of the long-/short-range separation in multiconfigurational density-functional theory. II. Investigating f actinide species E Fromager, F Réal, P Wåhlin, U Wahlgren, HJA Jensen The Journal of chemical physics 131 (5), 2009 | 67 | 2009 |
| On the exact formulation of multi-configuration density-functional theory: electron density versus orbitals occupation E Fromager Molecular Physics 113 (5), 419-434, 2015 | 54 | 2015 |
| Rigorous formulation of two-parameter double-hybrid density-functionals E Fromager The Journal of chemical physics 135 (24), 2011 | 53 | 2011 |
| Exact ensemble density functional theory for excited states in a model system: Investigating the weight dependence of the correlation energy K Deur, L Mazouin, E Fromager Physical Review B 95 (3), 035120, 2017 | 52 | 2017 |
| Assessment of charge-transfer excitations with time-dependent, range-separated density functional theory based on long-range MP2 and multiconfigurational self-consistent field … ED Hedegård, F Heiden, S Knecht, E Fromager, HJA Jensen The Journal of chemical physics 139 (18), 2013 | 50 | 2013 |
| Analysis of double-hybrid density functionals along the adiabatic connection Y Cornaton, O Franck, AM Teale, E Fromager Molecular Physics 111 (9-11), 1275-1294, 2013 | 48 | 2013 |
| Ground and excited energy levels can be extracted exactly from a single ensemble density-functional theory calculation K Deur, E Fromager The Journal of Chemical Physics 150 (9), 2019 | 45 | 2019 |
| Unified formulation of fundamental and optical gap problems in density-functional theory for ensembles B Senjean, E Fromager Physical Review A 98 (2), 022513, 2018 | 45 | 2018 |
| Alternative separation of exchange and correlation energies in multi-configuration range-separated density-functional theory A Stoyanova, AM Teale, J Toulouse, T Helgaker, E Fromager The Journal of Chemical Physics 139 (13), 2013 | 45 | 2013 |
| Individual correlations in ensemble density-functional theory: State-driven/density-driven decomposition without additional Kohn-Sham systems E Fromager Phys. Rev. Lett. 124, 243001 (2020), 2020 | 44* | 2020 |
| Electron Transfer in Uranyl (VI)− Uranyl (V) Complexes in Solution T Privalov, P Macak, B Schimmelpfennig, E Fromager, I Grenthe, ... Journal of the American Chemical Society 126 (31), 9801-9808, 2004 | 41 | 2004 |
| Local density approximation in site-occupation embedding theory B Senjean, M Tsuchiizu, V Robert, E Fromager Molecular Physics 115 (1-2), 48-62, 2017 | 37 | 2017 |
| Ensemble density functional theory of neutral and charged excitations: exact formulations, standard approximations, and open questions F Cernatic, B Senjean, V Robert, E Fromager Topics in current chemistry 380, 1-80, 2022 | 36 | 2022 |
| A weight-dependent local correlation density-functional approximation for ensembles PF Loos, E Fromager The Journal of Chemical Physics 152 (21), 2020 | 36 | 2020 |
