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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2spdph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-870.504849225; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-pf3zncl3_newfixBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2248.9943616; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-piridinaaucl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1764.723597; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nhcincl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1148.3832934; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-pcl3incl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2644.0828087; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ph3aucl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1859.5675855; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ncshgi2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-667.6227819; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ofenofecl2sextup_newBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1274.1484016; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-oincl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-997.6819115; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-saucl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1914.678012; Eh
Results 11001-11010 of 12354 (Search time: 0.008 seconds).