most citedExcited states of polonium(IV): Electron correlation and spin-orbit coupling in the Po^{4+} free ion and in the bare and solvated [PoCl5]^- and [PoCl6]^{2-} complexes

5 citations · 6 across the 2 of their papers we have counts for

collaborators

2 papers

physics.chem-ph2024★ 1 cited

Solvation effects on halides core spectra with Multilevel Real-Time quantum embedding

Jessica A. Martinez B., Matteo De Santis, Michele Pavanello +2

In this work we introduce a novel subsystem-based electronic structure embedding method that combines the projection-based block-orthogonalized Manby-Miller embedding (BOMME) with…

physics.chem-ph2023★ 5 cited

Excited states of polonium(IV): Electron correlation and spin-orbit coupling in the Po^{4+} free ion and in the bare and solvated [PoCl5]^- and [PoCl6]^{2-} complexes

Nadiya Zhutova, Florent Réal, Eric Renault +2

Polonium (Po, Z = 84) is a main-block element with poorly known physico-chemical properties. Not much information has been firmly acquired since its discovery by Marie and Pierre C…