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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-Jan-2024TS_3_H2O_CH3CN_O2Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-3684.4269076; Eh
thumbnail.jpeg8-Jan-20243_H2O_CH3CN_P1Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-3684.4637616; Eh
thumbnail.jpeg8-Jan-2024TS_3_Cl_H2O_O2Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-4012.009083; Eh
thumbnail.jpeg8-Jan-20243_H2O_O2Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-4312.8065266; Eh
thumbnail.jpeg8-Jan-2024TS_3_Cl_H2O_C_CBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-4012.0297973; Eh
thumbnail.jpeg8-Jan-20243_H2O_CH3CN_O2Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-3684.4715635; Eh
thumbnail.jpeg8-Jan-20243_Cl_H2O_P1Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-4012.0550247; Eh
thumbnail.jpeg8-Jan-20243_H2O_CH3CNBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-3534.0741483; Eh
thumbnail.jpeg8-Jan-20243_Cl_H2OBorowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-3861.6618924; Eh
thumbnail.jpeg8-Jan-2024TS_3_O2Borowski, TomaszGaussian; 16; ES64L-G16RevC.01Single point StructureUB3LYPDEF2TZVP-4236.2703862; Eh
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