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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Aug-2025triplet-on-singlet-6e_6oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025triplet-on-singlet-2e_2oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025singlet-on-triplet-6e_6oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025singlet-on-triplet-2e_2oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025singlet-on-singlet-2e_2oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025triplet-on-triplet-6e_6oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025triplet-on-triplet-2e_2oVlaisavljevich, BessMolcas; 24.02Single pointCASSCF; CASPT2ANO-RCC-
thumbnail.jpeg1-Aug-2025singlet-on-singlet-6e_6oVlaisavljevich, BessMolcas; 24.02Single pointCASSCFANO-RCC-
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