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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-May-2019cat4_TS4synsiABesora, MariaGaussian; 09; EM64L-G09RevA.02Geometry optimization TSRB97D--2766.58375490; Eh
thumbnail.jpeg2-May-2019cat4_TS4synsiB_spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRB97D--2766.7700206; Eh
thumbnail.jpeg2-May-2019cat4_TS4antireA_spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRB97D--2766.7750918; Eh
thumbnail.jpeg2-May-2019cat5_TS4synsiB_spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRB97D--2715.8994053; Eh
thumbnail.jpeg2-May-2019cat4_TS4synsiBBesora, MariaGaussian; 09; EM64L-G09RevA.02Geometry optimization TSRB97D--2766.58227054; Eh
thumbnail.jpeg2-May-2019TS4antireBBesora, MariaGaussian; 09; EM64L-G09RevA.02Geometry optimization TSRB97D--2678.82527534; Eh
thumbnail.jpeg2-May-2019cat4_TS4antireB_spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRB97D--2766.7752881; Eh
thumbnail.jpeg2-May-2019cat7_TS4synsi_spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRB97D--2370.7666531; Eh
thumbnail.jpeg2-May-2019cat8_TS4antireBBesora, MariaGaussian; 09; EM64L-G09RevA.02Geometry optimization TSRB97D--1935.39128569; Eh
thumbnail.jpeg2-May-2019TS4synsiA_spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRB97D--2679.0044468; Eh
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