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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required14-Aug-2023DyCp2-cationVlaisavljevich, BessTURBOMOLE; 7.3Geometry optimization TSU-DFTdef2-TZVP; def-SV(P)-1664.589117950; Eh
thumbnail.jpeg24-Jul-2023u-ph-dimerVlaisavljevich, BessTURBOMOLE; 7.3Geometry optimization TSU-DFTdef2-TZVP; def2-SV(P); def-TZVP-6101.087968940; Eh
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