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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Dec-2021ch3nh3-hcooo-ts_6311+Gd_ch2cl2Morán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-360.828666979; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-nhcho-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-398.587450224; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-sh-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-628.067924096; Eh
thumbnail.jpeg9-Dec-2021ch3nh3-ph2-ts_6311+Gd_ch2cl2Morán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-438.997067993; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-f-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-329.139883482; Eh
thumbnail.jpeg9-Dec-2021ch3cooch3-nh3-ts_6311+Gd_ch2cl2Morán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-325.019783392; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-ash2-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-2466.29857170; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-sch3-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-667.381782631; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-ph2-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-571.790451581; Eh
thumbnail.jpeg9-Dec-2021ch3cooh-nh2-ts_6311+Gd_aqMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRB3LYP6-311+G(D)-285.167212945; Eh
Results 1291-1300 of 1455 (Search time: 0.003 seconds).