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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg18-Mar-2016APP1_iso103625Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.78559129; Eh
thumbnail.jpeg18-Mar-2016APP3_103648Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.73850182; Eh
thumbnail.jpeg18-Mar-2016APP2_iso103054Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.74072567; Eh
thumbnail.jpeg18-Mar-2016IPR_86Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.76455501; Eh
thumbnail.jpeg18-Mar-2016IPR_44Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.79038824; Eh
thumbnail.jpeg18-Mar-2016IPR_36Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.80487066; Eh
thumbnail.jpeg18-Mar-2016APP1_iso124451Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.77686954; Eh
thumbnail.jpeg18-Mar-2016APP2_124337Poblet, Josep M.ADF; 2012; 01Geometry optimizationDFTTZP-30.77043136; Eh
thumbnail.jpeg1-Mar-2016Sc2O@Td(2)-C76_optimizationAbella, LauraADF; 2012; 01Geometry optimizationDFTTZP; TZ2P-25.00749065; Eh
thumbnail.jpeg1-Mar-2016Frequencies_of_Sc2O@Td(2)-C76Abella, LauraADF; 2012; 01Single point MinimumDFTTZP; TZ2P-
Results 111-120 of 142 (Search time: 0.0 seconds).