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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene_Iabs_prod 2iodomxylene_Iabs_prodNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUMN15LDEF2SVP-646.163594388; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene_Iabs_TS 2iodomxylene_Iabs_TSNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUMN15LDEF2SVP-646.154863109; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/PPh3/PPh3+Ph-rad_TS PPh3+Ph-rad_TSNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUMN15LDEF2SVP-1266.05023127; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene+Me_rad_prod_5pos 2iodomxylene+Me_rad_prod_5posNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUMN15LDEF2SVP-646.193240369; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene+Me_rad_prod_4pos 2iodomxylene+Me_rad_prod_4posNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUMN15LDEF2SVP-646.194303980; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene+Me_rad_prod_2pos 2iodomxylene+Me_rad_prod_2posNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUMN15LDEF2SVP-646.247742368; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene+Me_rad_TS_5pos 2iodomxylene+Me_rad_TS_5posNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUMN15LDEF2SVP-646.154894134; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/2iodomxylene+Me_rad_TS_2pos 2iodomxylene+Me_rad_TS_2posNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUMN15LDEF2SVP-646.157062910; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/dppf/dppf+Ph-rad_TS dppf+Ph-rad_TSNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUMN15LDEF2SVP-3487.23384359; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/PCy3/PhPCy3_TS_cleavage PhPCy3_TS_cleavageNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUMN15LDEF2SVP-1276.80372660; Eh
Results 11-20 of 31 (Search time: 0.002 seconds).