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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Sep-2023/P_radicals/PCy3/PCy3 PCy3_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15DEF2TZVP-1046.402084; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/PCy3/PhPCy3-cat PhPCy3-cat_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15DEF2TZVP-1277.6854366; Eh
thumbnail.jpeg2-Sep-2023/P_radicals/dippf/dippf dippf_tzvpNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15DEF2TZVP-2805.6430488; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/E_AuClIPrHFIP+propyne AuClIPrHFIP+propyne_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-2660.8795248; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/G_AuIPrpropyne AuIPrpropyne_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-1411.0366815; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/F_AuIPrpropyne+ClHFIP AuIPrpropyne+ClHFIP_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-2660.8693466; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/TS3_hfip TS3_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-2660.8585556; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/Cl Cl_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-460.285485806; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/C2_AuClIPr_HFIP AuClIPr_2HFIP_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-3333.8458709; Eh
thumbnail.jpeg9-Jun-2023/HFIP_FES/D_AuHFIPIPr+Cl AuHFIPIP+Cl_sp_hfipNelson, DavidGaussian; 16; ES64L-G16RevC.01Single point StructureRMN15GENECP-2544.2960182; Eh
Results 11-20 of 36 (Search time: 0.002 seconds).