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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-h2tame4piramBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-217.5274241; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-scunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-765.2565872; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-hecunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-369.367084; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-clcunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-827.2246584; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-cnrhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-585.2880328; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-cnconh35Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-521.3654241; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-cnZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2441.5983255; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-clznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-727.3447469; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-cnniph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-607.1007239; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-cnfeco4axialBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-670.334023; Eh
Results 11431-11440 of 12354 (Search time: 0.008 seconds).