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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg17-Jan-2019/L4 TS1d-eFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUB3LYP6-31+G*-1560.45242680; Eh
thumbnail.jpeg17-Jan-2019/L4 TS_1c-fFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUB3LYP6-31+G*-1560.45641570; Eh
thumbnail.jpeg17-Jan-2019/L3 TS1d-eFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUB3LYP6-31+G*-1445.92194095; Eh
thumbnail.jpeg17-Jan-2019/L2 TS1d-eFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUB3LYP6-31+G*-1410.03010161; Eh
thumbnail.jpeg8-May-20184_TS3Fernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUM06lanl2dz; 6-31+g(d)-1129.61037053; Eh
thumbnail.jpeg8-May-20182_TS3Fernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUM06lanl2dz; 6-31+g(d)-1106.37109730; Eh
thumbnail.jpeg8-May-20181_TSDFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM06lanl2dz; 6-31+g(d)-1161.74941391; Eh
thumbnail.jpeg8-May-20181_TS3Fernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUM06lanl2dz; 6-31+g(d)-1161.71434669; Eh
thumbnail.jpeg8-May-20184_TS2Fernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM06lanl2dz; 6-31+g(d)-1129.62268622; Eh
thumbnail.jpeg8-May-20181_TS2Fernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM06lanl2dz; 6-31+g(d)-1161.72755759; Eh
Results 1-10 of 18 (Search time: 0.001 seconds).