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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Aug-2018large_basis_A-6-I_NiIITMe2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-311+G(d,p)-948.038890059; Eh
thumbnail.jpeg30-Aug-2018large_basis_NiCODITMe_NiCODITMe_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(d,p)-865.091088505; Eh
thumbnail.jpeg30-Aug-2018large_basis_NiCODIXy_NiCODIXy_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(d,p)-1327.34590008; Eh
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