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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-May-2021/reaction_profiles/PMe3 PMe3Nelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRM066-311+G(D,P) GENECP-461.0186095; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PC6H4CF33 NiBrdppfPC6H4CF33+rad_ossNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureUM066-311+G(D,P) GENECP-9697.5743441; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PPh3 NiBrdppfPPh3+rad_ossNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureUM066-311+G(D,P) GENECP-8686.4734707; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PPh3 NiBrRdppfPPh3_sqbpNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRM066-311+G(D,P) GENECP-8686.4892235; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PC6H4CF33 PC6H4CF33Nelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRM066-311+G(D,P) GENECP-2047.0209291; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PPh3 PPh3Nelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRM066-311+G(D,P) GENECP-1035.9196751; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PC6H4CF33 NidppfPC6H4CF33_HATS_tripletNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureUM066-311+G(D,P) GENECP-9697.5559669; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PPh3 NidppfPPh3_HATS_tripletNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureUM066-311+G(D,P) GENECP-8686.4477273; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PC6H4CF33 NidppfPC6H4CF33Nelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRM066-311+G(D,P) GENECP-6813.4480793; Eh
thumbnail.jpeg30-May-2021/reaction_profiles/PPh3 NidppfPPh3BrRNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRM066-311+G(D,P) GENECP-8686.4929248; Eh
Results 21-30 of 186 (Search time: 0.001 seconds).