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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S32 S32García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-852.141380070; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S2 S2García, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1007.18188286; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/3j 3jGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) GENECP-1157.19816694; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/TSCH2_4 TSCH2_4_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1688.7549395; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S5 S5_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1728.1253832; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/3j 3j_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1157.4241291; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S32 S32_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-852.3248739; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/S2 S2_spbsGarcía, CristinaGaussian; 09Single point StructureRwB97XDGENECP-1007.4181572; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/VI_prima VI_primaGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1473.32548338; Eh
Login required23-Mar-2020/Paper/Outputs_Inputs_CGET/VI VIGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31G(D,P) LANL2DZ GENECP-1886.79322670; Eh
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