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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Apr-2016/Chapter_5/TD-DFT (SCH3)Fe(IV)O(Porph)_LS_CAM-B3LYPSaureu, SergiOrca; 3.0.1; RELEASESingle pointUKSdef2-TZVP; def2-TZVP/J-
thumbnail.jpeg5-Apr-2016/Chapter_4/TD-DFT Fe(pap)2_HS_B3LYP_STARSaureu, SergiOrca; 3.0.1; RELEASESingle pointTDDFTdef2-TZVP; def2-TZVP/J-
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