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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A6PC7PArtigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPcc-pVDZ-3011.69877838; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A6A7_56Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPcc-pVDZ-4048.16562097; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A6C7_66Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPcc-pVDZ-4048.14413558; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A7A8Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPcc-pVDZ-4048.18204387; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A7PArtigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-3011.75852959; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A7Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-4048.21437088; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A6Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-4048.18550392; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A5PArtigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-725.265070402; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A10_56Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-5161.99160046; Eh
thumbnail.jpeg3-Oct-2019/C60ACET/OPTFREQ A10Artigas, AlbertGaussian; 09; AM64L-G09RevD.01Geometry optimization MinimumRB3LYPcc-pVDZ-5162.02176403; Eh
Results 61-70 of 109 (Search time: 0.0 seconds).