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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg26-Dec-2022/Redox DIPEA+_s2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-371.0217993; Eh
thumbnail.jpeg26-Dec-2022/Redox Nu__SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-780.581577; Eh
thumbnail.jpeg26-Dec-2022/Redox Nu_s2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-780.4212505; Eh
thumbnail.jpeg26-Dec-2022/Redox HO_s2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-75.7737123; Eh
thumbnail.jpeg26-Dec-2022/Redox HO__SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-75.9348088; Eh
thumbnail.jpeg26-Dec-2022/Redox DIPEA_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-371.2090316; Eh
thumbnail.jpeg26-Dec-2022/NLE LCu2W2OTf2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-3346.633355; Eh
thumbnail.jpeg26-Dec-2022/NLE LCu1WOTf_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2308.3814748; Eh
thumbnail.jpeg26-Dec-2022/NLE Cu1_homocoupled_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2343.9036141; Eh
thumbnail.jpeg26-Dec-2022/NLE OTf__SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-961.8930617; Eh
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