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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 118, 2020 - Issue 21-22: MQM 2019
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MQM 2019
Performance of density functional theory and orbital-optimised second-order perturbation theory methods for geometries and singlet–triplet state splittings of aryl-carbenes
Reza Ghafarian ShiraziDepartment of Molecular Theory and Spectroscopy, Max-Planck-Institut für Kohlenforschung, Mülheim an der Ruhr, GermanyView further author information
, Dimitrios A. PantazisDepartment of Molecular Theory and Spectroscopy, Max-Planck-Institut für Kohlenforschung, Mülheim an der Ruhr, GermanyCorrespondence[email protected]
https://orcid.org/0000-0002-2146-9065View further author information
Frank NeeseDepartment of Molecular Theory and Spectroscopy, Max-Planck-Institut für Kohlenforschung, Mülheim an der Ruhr, GermanyCorrespondence[email protected]
View further author information
View further author information
Article: e1764644
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Received 01 Mar 2020, Accepted 28 Apr 2020, Published online: 18 May 2020
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