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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes nhcZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2574.75199997; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nhcwco5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-860.158602588; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nhcticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1665.13578809; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes hefecl3-baiBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1507.71533987; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ocunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-442.241286031; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nhcznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-493.078737229; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes oconh35Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-503.737171605; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes hegacl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1385.71769016; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes oalcl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*-1698.49260811; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ph3nipf33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2437.16339243; Eh
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