Author: grouaut

Lucien Dupuy and Emmanuel Fromager published a new paper, “Charged Excitations Made Neutral: 𝑁-Centered Ensemble Density Functional Theory of Fukui Functions” in Physical Review Letters

Lucien Dupuy, Toni Chiti, Jeremy Morere and Emmanuel Fromager published a new paper, “Ensemble density functional theory of excited states: Exact N-centered formalism and practical opportunities” in The Journal of Chemical Physics

Lucien Dupuy, Emmanuel Fromager and coworker published a new paper, “Exactly Factorized Molecular Kohn–Sham Density Functional Theory” in the Journal of Computational Chemistry