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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg17-Jan-2019/L4 1bFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G*-1408.73894801; Eh
thumbnail.jpeg17-Jan-2019/L1 1bFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G*-1179.68076258; Eh
thumbnail.jpeg17-Jan-2019/L3 1bFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G*-1294.21142329; Eh
thumbnail.jpeg17-Jan-2019/L2 1bFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G*-1258.32095524; Eh
thumbnail.jpeg13-Sep-2023tame4_H2eta1_aqMorán, LucíaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+G* SDD GENECP-217.673038118; Eh
thumbnail.jpeg13-Sep-2023zrcl5-H2eta1_vacuum1Morán, LucíaGaussian; 09; EM64L-G09RevD.01Geometry optimization StructureRB3LYP6-31+G* SDD GENECP-2349.66847119; Eh
thumbnail.jpeg13-Sep-2023ticl3_H2eta1_vacuum1Morán, LucíaGaussian; 09; EM64L-G09RevD.01Geometry optimization StructureRB3LYP6-31+G* SDD GENECP-1439.97325660; Eh
thumbnail.jpeg13-Sep-2023nbnh24-H2eta1_vacuumMorán, LucíaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G* SDD GENECP-281.883825414; Eh
thumbnail.jpeg13-Sep-2023mosh3_H2eta1_vacuumMorán, LucíaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G* SDD GENECP-1265.51951634; Eh
thumbnail.jpeg13-Sep-2023ircoph32_H2eta1_vacuum1Morán, LucíaGaussian; 09; EM64L-G09RevD.01Geometry optimization StructureRB3LYP6-31+G* SDD GENECP-905.021697627; Eh
Results 1-10 of 166 (Search time: 0.002 seconds).