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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Sep-2020/ferrocene singl_BP86_ethanolMariusz, RadonTURBOMOLE; 7.0.1Geometry optimizationDFTdef2-TZVP-1651.240383613; Eh
thumbnail.jpeg4-Sep-2020/cobaltocenium singl_PBE0Mariusz, RadonTURBOMOLE; 7.0.1Geometry optimizationDFTdef2-TZVP-1769.111323142; Eh
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