Spin adapted implementation of EOM-CCSD for triplet excited states: Probing intersystem crossings of acetylacetone at the carbon and oxygen K-edges

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Authors: Faber, Rasmus; Kjønstad, Eirik F.; Koch, Henrik; Coriani, Sonia

Journal title: The Journal of Chemical Physics

Journal publisher: American Institute of Physics

Published year: 2019

DOI identifier: 10.1063/1.5112164

ISSN: 0021-9606