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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-h2omosh3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1340.8259747; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ffecl2sextupBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1144.2831925; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-fenilpdph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-702.7812962; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-h2ocro3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-389.1286242; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-fenilkBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-259.9357261; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-fznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-366.9453468; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes xegacl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1398.35325374; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes xefecl3baiBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSUB3LYP6-31+g*; sdd-1520.19216072; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-fenilircoph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1135.7437193; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-fenilpdhph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1046.4776096; Eh
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