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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-h2orush4Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1766.6046102; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-hrhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-492.7355911; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-hnbnh24Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-281.5011204; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-hticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1439.7033445; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes xenipf33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2109.52678680; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-halcl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*-1623.9312393; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes xeincl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-937.618583106; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-h2ocunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-442.9315132; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-h2onbnh24Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-357.1545246; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-fenilticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1670.7790448; Eh
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