30 citations · 34 across the 10 of their papers we have counts for
4 papers · 1 filter
eT 2.0: An efficient open-source molecular electronic structure program
Sarai Dery Folkestad, Eirik F. Kjønstad, Alexander C. Paul +34
The eT program is an open-source electronic structure program with emphasis on performance and modularity. As its name suggests, the program features extensive coupled cluster capa…
A Complete Active Space Self-Consistent Field approach for molecules in QED environments
Riccardo Alessandro, Matteo Castagnola, Henrik Koch +1
Multireference systems are usually challenging to investigate using ab initio methods as they require an accurate description of static electron correlation. The urgency of develop…
Strong coupling quantum electrodynamics Hartree-Fock response theory
Matteo Castagnola, Rosario R. Riso, Yassir El Moutaoukal +2
The development of reliable ab initio methods for light-matter strong coupling is necessary for a deeper understanding of molecular polaritons. The recently developed strong coupli…
Strong coupling Møller-Plesset perturbation theory
Yassir El Moutaoukal, Rosario R. Riso, Matteo Castagnola +2
Perturbative approaches are methods to efficiently tackle many-body problems, offering both intuitive insights and analysis of correlation effects. However, their application to sy…