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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required30-Sep-2021RhI-HCp-1eSolé-Daura, AlbertGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUwB97XDLANL2DZ 6-31G(D,P) GENECP-995.382494033; Eh
Login required30-Sep-2021RhIII-H-1eSolé-Daura, AlbertGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUwB97XDLANL2DZ 6-31G(D,P) GENECP-995.366686041; Eh
Login required30-Sep-2021TS-CO2RRSolé-Daura, AlbertGaussian; 16; ES64L-G16RevC.01Geometry optimization TSUwB97XDLANL2DZ 6-31G(D,P) GENECP-1183.87453906; Eh
Login required30-Sep-2021RhI-HCpSolé-Daura, AlbertGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRwB97XDLANL2DZ 6-31G(D,P) GENECP-995.280038639; Eh
thumbnail.jpeg9-Jan-2021Anti-4a-b_Kojasoy, VolgaGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYP6-31G(D)-
thumbnail.jpeg9-Jan-2021Anti-4a-bKojasoy, VolgaGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYP6-31G(D)-
thumbnail.jpeg9-Jan-2021B-TS-bKojasoy, VolgaGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYP6-31G(D)-
thumbnail.jpeg9-Jan-2021B_-TS-bKojasoy, VolgaGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYP6-31G(D)-
thumbnail.jpeg9-Jan-2021P5-bKojasoy, VolgaGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYP6-31G(D)-
thumbnail.jpeg9-Jan-2021n2-bKojasoy, VolgaGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYP6-31G(D)-
Results 11-20 of 173 (Search time: 0.001 seconds).