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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Sep-2023/P_radicals/dppf/dppf+Ph-rad dppf+Ph-rad_tzvp-as-catNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureUMN15DEF2TZVP-3488.9995191; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/dppf/dppf+Ph-rad_TS dppf+Ph-rad_TS_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureUMN15DEF2TZVP-3489.0731668; 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/dppf/dppf+Ph-cat dppf+Ph-catNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15LDEF2SVP-3487.14166216; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/dppf/dppf dppf_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15DEF2TZVP-3257.7291348; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/dppf/dppf dppfNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15LDEF2SVP-3256.08577627; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/Benzene benzene_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15DEF2TZVP-232.0336578; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/Me_radical Me_radical_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureUMN15DEF2TZVP-39.7888613; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/Me_radical Me_radicalNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUMN15LDEF2SVP-39.7493930418; Eh
thumbnail.jpeg2-Sep-2023/Me_radical_addn/Benzene benzeneNelson, DavidGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15LDEF2SVP-231.828039430; Eh
Results 61-70 of 170 (Search time: 0.001 seconds).