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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required24-Jun-2023puu-int-sp-gasVlaisavljevich, BessGaussian; 16; EM64L-G16RevA.03Single point StructureRM062X6-311+G(2DF,2P)-2563.8917881; Eh
Login required24-Jun-2023puu-ts-sp-gasVlaisavljevich, BessGaussian; 16; EM64L-G16RevA.03Single point StructureRM062X6-311+G(2DF,2P)-2563.8559345; Eh
Login required24-Jun-2023peu-int-sp-gasVlaisavljevich, BessGaussian; 16; EM64L-G16RevA.03Single point StructureRM062X6-311+G(2DF,2P)-2583.7598187; Eh
Login required24-Jun-2023peu-ts-sp-gasVlaisavljevich, BessGaussian; 16; EM64L-G16RevA.03Single point StructureRM062X6-311+G(2DF,2P)-2583.7163596; Eh
thumbnail.jpeg21-Feb-2023/M06-2X_6-31+Gd_optimisation_frequencies/no_guest Eq-o-M-cis-M-cis_M06-2X_6-31plGd_chloroformSMD_frequenciesSerapian, Stefano A.Gaussian; 16; ES64L-G16RevC.02Single point StructureRM062X6-31+G(D)-2995.24395982; Eh
thumbnail.jpeg21-Feb-2023/M06-2X_6-31+Gd_optimisation_frequencies/no_guest Eq-i-M-cis-M-cis_eqax_M06-2X_6-31plGd_chloroformSMD_frequenciesSerapian, Stefano A.Gaussian; 16; ES64L-G16RevC.02Single point StructureRM062X6-31+G(D)-2995.25202399; Eh
Login required1-Sep-2023MK_RS7_ValNovotny, JanGaussian; 09; EM64L-G09RevC.01Single point StructureRM062XGEN-645.9590845; Eh
Login required1-Sep-2023MK_RS8_ValNovotny, JanGaussian; 09; EM64L-G09RevC.01Single point StructureRM062XGEN-645.945571; Eh
Login required1-Sep-2023MK_RS8Novotny, JanGaussian; 09; EM64L-G09RevC.01Single point StructureRM062XGEN-645.9730125; Eh
Login required1-Sep-2023MK_RS7Novotny, JanGaussian; 09; EM64L-G09RevC.01Single point StructureRM062XGEN-645.9717552; Eh
Results 231-240 of 260 (Search time: 0.002 seconds).