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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ C6_56Artigas, AlbertGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-4048.17080257; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ C60Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYP--2286.42777924; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ PRODUCT_56Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-2441.21764099; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ WILKINSONArtigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-3679.83632014; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ PRODUCTArtigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-2441.24498186; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ B6P_56Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-3011.67550807; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ C7P_66Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-3011.80400143; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ B6PArtigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-3011.69832995; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ PPH3Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-1036.38610999; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ B6_56Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-4048.12013886; Eh
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