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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Sep-2021INT_C2PBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-1087.45293884; Eh
thumbnail.jpeg20-Sep-2021T1_S0_MECP2_ABorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021T1_TS_OOBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021INT_OOHBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021T1_6aBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021S1-T2_MECP2_ABorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD; TD-FCDEF2TZVP-937.088744803; Eh
thumbnail.jpeg20-Sep-2021INT_OOBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-1087.44742393; Eh
thumbnail.jpeg20-Sep-2021T2-T1_MECP2_ABorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021O2Borowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-
thumbnail.jpeg20-Sep-2021S1-T2_MECP1_ABorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD; TD-FCDEF2TZVP-937.092347740; Eh
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