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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Sep-2021reactant_TS_C2PWBBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-1163.89927879; Eh
thumbnail.jpeg20-Sep-2021TS_C4PBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSRwB97XDDEF2TZVP-1087.37844519; Eh
thumbnail.jpeg20-Sep-20215bBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-1087.39792773; Eh
thumbnail.jpeg20-Sep-2021T1_INT_C2PBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021S1-T1_MECP2_BBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-936.986097168; Eh
thumbnail.jpeg20-Sep-2021INT_C4Borowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-1087.41615259; Eh
thumbnail.jpeg20-Sep-2021TS_OOBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-1087.41858017; Eh
thumbnail.jpeg20-Sep-2021H2O2Borowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSRwB97XDDEF2TZVP-151.574618887; Eh
thumbnail.jpeg20-Sep-2021T1_S0_MECP2_BBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021S0_TS_NHBorowski, TomaszGaussian; 16; ES64L-G16RevB.01Single point StructureUwB97XDDEF2TZVP-
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