206 citations · 1.1k across the 22 of their papers we have counts for
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Approaching Coupled Cluster Accuracy with Positive Semidefinite Vertex Corrected Self-Energies
Yaroslav Pavlyukh, Fabien Bruneval, Arno Förster
Hedin's formalism of functional derivatives is the best-known method for systematically constructing correlated electronic theories, largely due to the success of its lowest-order…
reduced density matrix from iterated linearized Dyson equation
Fabien Bruneval, Erik Verzijl, Arno Förster +1
Iterating the Dyson equation with the static part of the self-energy leads to a concise and possibly improved expression of the one-body reduced density matrix from any self-energy…
Why does the approximation give accurate quasiparticle energies? The cancellation of vertex corrections quantified
Arno Förster, Fabien Bruneval
Hedin's approximation to the electronic self-energy has been impressively successful to calculate quasiparticle energies, such as ionization potentials, electron affinities, o…
Time-Reversal Symmetry in RDMFT and pCCD with Complex-Valued Orbitals
Mauricio Rodríguez-Mayorga, Pierre-François Loos, Fabien Bruneval +1
Reduced density matrix functional theory (RDMFT) and coupled cluster theory restricted to paired double excitations (pCCD) are emerging as efficient methodologies for accounting fo…
RPA, an accurate and fast method for the computation of static non-linear optical properties
Pau Besalú-Sala, Fabien Bruneval, Ángel José Pérez-Jiménez +2
The accurate computation of non-linear optical properties (NLOPs) in large polymers requires accounting for electronic correlation effects with a reasonable computational cost. The…
density matrix to estimate self-consistent total energy in solids
Adam Hassan Denawi, Fabien Bruneval, Marc Torrent +1
The approximation is a well-established method for calculating ionization potentials and electron affinities in solids and molecules. For numerous years, obtaining self-consis…