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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg26-Dec-2022/Redox LCu1Pérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1269.55539272; 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
thumbnail.jpeg26-Dec-2022/NLE HFIP_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-790.1351943; Eh
thumbnail.jpeg26-Dec-2022/NLE HFIP2__SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPAUG-CC-PVTZ CC-PVTZ GENECP-1579.8065069; Eh
thumbnail.jpeg26-Dec-2022/NLE LCu1HFIP_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2059.6606964; Eh
thumbnail.jpeg26-Dec-2022/NLE Trimer_RRR_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-3613.9178193; Eh
thumbnail.jpeg26-Dec-2022/NLE H2O_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-76.4721487; Eh
thumbnail.jpeg26-Dec-2022/NLE Cu1_heterocoupled_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2343.9109122; Eh
Results 151-160 of 460 (Search time: 0.002 seconds).