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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes nh3aucl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1573.00011116; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nhcfecl3-Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1731.02532393; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes chch2agnhcBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-451.223410247; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes cchzrome3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-469.409932771; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nchzrome3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-485.882256347; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ncssnme3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-614.202557254; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nh3snme3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-179.482485295; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ncsfecl3-Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSUB3LYP6-31+g*; sdd-1995.86008973; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nhcagnhcBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-599.307822378; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes cchyh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-496.853692518; Eh
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