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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required21-Jun-2019/B2O4(C2H4)2 TS4CsO_BMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1289.42818600; Eh
Login required21-Jun-2019/B2O4(C2H4)2 tetraB2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-657.867856224; Eh
Login required21-Jun-2019/B2O4(C2H4)2 ProdMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-657.867856224; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_aryl/Nidppf2_OATS G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-10833.066877; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_aryl/TS_OA_Nidppf_PhBr G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-7573.6451206; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_aryl/Nidppf_BrPh G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-7573.6379533; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_aryl/NiBrPhdppf G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-7573.6937165; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_aryl/PhBr G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-2805.8719946; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_alkyl/Nidppf2 G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-8027.2252504; Eh
thumbnail.jpeg25-Aug-2020/Ni_dppf_aryl/Ni_dppf_open_dppf_e2PhBr G16_SP_BB_BenzeneNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D,P) GENECP-10833.0693878; Eh
Results 31-40 of 224 (Search time: 0.001 seconds).