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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Feb-2020TSXIX_XX_sp_basissetGarcía, CristinaGaussian; 09Single point StructureRB3LYPGENECP-2982.3045546; Eh
thumbnail.jpeg22-Feb-2020TSXIX_XXGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLANL2DZ 6-31G(D,P) GENECP-2981.42319484; Eh
thumbnail.jpeg22-Feb-2020XIII_sp_basissetGarcía, CristinaGaussian; 09Single point StructureRB3LYPGENECP-3061.2283044; Eh
thumbnail.jpeg22-Feb-2020TSXXI_XXIIGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLANL2DZ 6-31G(D,P) GENECP-2906.41343448; Eh
thumbnail.jpeg22-Feb-2020IXGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLANL2DZ 6-31G(D,P) GENECP-3060.32105072; Eh
thumbnail.jpeg22-Feb-2020TSXXI_XXII_sp_basissetGarcía, CristinaGaussian; 09Single point StructureRB3LYPGENECP-2907.2776864; Eh
thumbnail.jpeg22-Feb-2020IX_sp_basissetGarcía, CristinaGaussian; 09Single point StructureRB3LYPGENECP-3061.2202819; Eh
thumbnail.jpeg22-Feb-2020XVIIIGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLANL2DZ 6-31G(D,P) GENECP-2981.42785030; Eh
thumbnail.jpeg22-Feb-2020XVIII_sp_basissetGarcía, CristinaGaussian; 09Single point StructureRB3LYPGENECP-2982.311346; Eh
thumbnail.jpeg22-Feb-2020IV_starGarcía, CristinaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLANL2DZ 6-31G(D,P) GENECP-3021.96753334; Eh
Results 21-30 of 116 (Search time: 0.001 seconds).