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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Jan-2019/Migratory_Insertion TS-3-4(endo)Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-2095.689591; Eh
thumbnail.jpeg24-Jan-2019/Reductive_Elimination TS-6-Ni(II)Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-2083.5844991; Eh
thumbnail.jpeg24-Jan-2019/Migratory_Insertion 4x(exo)Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-2095.7385754; Eh
thumbnail.jpeg24-Jan-2019/Reductive_Elimination TS-7-8Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-311++G**-2083.4997035; Eh
thumbnail.jpeg24-Jan-2019/Migratory_Insertion 4(endo)Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-2095.7364454; Eh
thumbnail.jpeg24-Jan-2019/Migratory_Insertion 3Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1781.1179749; Eh
thumbnail.jpeg24-Jan-2019/Reductive_Elimination 7Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-311++G**-2083.5317044; Eh
thumbnail.jpeg24-Jan-2019/Reductive_Elimination 6Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-2083.692716; Eh
thumbnail.jpeg24-Jan-2019/Reductive_Elimination 8Fondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-311++G**-1644.3236948; Eh
thumbnail.jpeg24-Jan-2019_Ru(bpy)3_2+_tripletFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-311++G**-1580.3533694; Eh
Results 1-10 of 51 (Search time: 0.002 seconds).