Search        

Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2conh35Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-429.4795256; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2cunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-367.9742575; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2oalcl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*-1699.7142402; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2cro3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-313.8605648; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2auph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-479.9672169; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-fZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2448.6542912; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2alcl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*-1624.412356; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-fenilpdhph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1046.5072846; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-fenilznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-498.7347148; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-fniph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-614.1097988; Eh
Results 4111-4120 of 12842 (Search time: 0.005 seconds).