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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-shptf5singleteBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1017.491726; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-chch2hgi2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-254.5325065; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-hgi2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-216.4576256; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2sconh35Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-827.092825154; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-shfecl3-Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1903.5633609; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-piridinaauph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-727.0573477; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ph3tame4piramBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-559.5433558; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ph3rhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-834.7606163; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ph3ZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2691.6523462; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-piridinaalcl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*-1871.5770137; Eh
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