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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nhcnbnh24Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-506.9518622; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ocunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-442.227527; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ohauph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-554.7732243; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ohoso3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-391.8396698; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-okBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-103.4647124; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilno2ircoph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1340.28379949; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nhcrush4Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1916.4124448; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nhcmosh3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1490.6589264; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ohcunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-442.6987931; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nhcznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-493.0684959; Eh
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