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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg15-Oct-2021/SP_M06L_GD3_CHCl3 M88Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Single point StructureUM06LGEN-1133.12287032; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M1Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGEN-924.2147475; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M80Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2541.4118514; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M85Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2001.4422223; Eh
thumbnail.jpeg15-Oct-2021/SP_M06L_GD3_CHCl3 M86Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Single point StructureRM06LGEN-1811.63176584; Eh
thumbnail.jpeg15-Oct-2021/SP_M06L_GD3_CHCl3 M66Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Single point StructureRM06LGEN-1890.33037161; Eh
thumbnail.jpeg15-Oct-2021/SP_M06L_GD3_CHCl3 M45Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Single point StructureRM06LGEN-1890.30319094; Eh
thumbnail.jpeg15-Oct-2021/SP_M06L_GD3_CHCl3 M43Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Single point StructureRM06LGEN-2082.07678652; Eh
thumbnail.jpeg15-Oct-2021/SP_PBEPBE_GD3MBJ_CHCl3 M3Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Single point StructureRPBEPBEGEN-756.234215504; Eh
thumbnail.jpeg15-Oct-2021/SP_M06L_GD3_CHCl3 M56Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevC.01Single point StructureRM06LGEN-1890.29041519; Eh
Results 11-20 of 276 (Search time: 0.001 seconds).