Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/1j_d5_110 1j_d5_110_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-436.7298145; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/2_110 2_110_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-734.4587299; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/TS_D_Cpstar_II_III TS_D_Cpstar_II_IIIGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XDGENECP-
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/II_H_Cpstar_110 II_H_Cpstar_110García, CristinaGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XDGENECP-
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/1j_110 1j_110García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) GENECP-436.615062001; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/TS_H_Cp_II_III_110 TS_H_Cp_II_III_110_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-968.0826392; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/II_D_Cpstar_110 II_D_Cpstar_110_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1164.7349348; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/II_H_Cp_110 II_H_Cp_110_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-968.112706; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/1j_110 1j_110_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-436.7298145; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/KIE_110/TS_H_Cp_II_III_110 TS_H_Cp_II_III_110García, CristinaGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XDGENECP-
Results 31-40 of 281 (Search time: 0.001 seconds).