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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/II_NO2_Cpstar II_NO2_CpstarGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1408.20271049; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S33 S33García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1099.04343646; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S34 S34García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1314.30474815; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/AgI AgIGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLANL2DZ GENECP-157.233292641; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/II_NO2_Cpstar II_NO2_Cpstar_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1408.5367725; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S33 S33_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1099.2789928; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S34 S34_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1314.6061746; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/AgI AgI_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-157.2362653; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/TSCH2_4 TSCH2_4García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRwB97XD6-31G(D,P) LANL2DZ GENECP-1688.41658715; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S5 S5García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1727.77865837; Eh
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