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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-Oct-2017H2O-solv_HSE03-13Hegner, Franziska Simonevasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complexGeometry optimization---16.68922401; eV
thumbnail.jpeg16-Oct-2017hsls-KCoFe(CN)6+H2O_HSE03-13Hegner, Franziska Simone-Geometry optimization---563.79668070; eV
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