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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-clnbnh24Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-741.1767464; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-cncunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-459.701374; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes sih3-incl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1213.69546122; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes sih3-hgi2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-467.870439522; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-cunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-406.7657449; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-nbnh24Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-320.8192549; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-auph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-518.8631567; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-brpdph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-484.6055371; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-brticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1452.5667735; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes sih3-aucl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1807.86612457; Eh
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