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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required18-Nov-2022/U2@C46(103) U2@C46(103)Rosello, YannickADF; 2017Geometry optimizationPBETZP-15.36882621; Eh
Login required18-Nov-2022/U2@C44(75) U2@C44(75)Rosello, YannickADF; 2017Geometry optimizationPBETZP-14.70420212; Eh
Login required18-Nov-2022/U2@C60/U2@C60_O1/U2@C60-5quintuplet U2@C60-5quintupletRosello, YannickADF; 2019; 306Geometry optimizationPBE0 == Not Default ==TZP-24.63293598; Eh
Login required18-Nov-2022/U2@C80/U2@C80_O1/U2@C80-7septuplet U2@C80-7septupletRosello, YannickADF; 2019; 306Geometry optimizationPBE0 == Not Default ==TZP-32.73312153; Eh
Login required18-Nov-2022/U2@C80/U2@C80_O2/U2@C80-7septuplet U2@C80-7septupletRosello, YannickADF; 2019; 306Geometry optimizationPBE0 == Not Default ==TZP-32.70151747; Eh
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