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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 T4Syn_Si_Down_Trans_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--2278.24226991; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 T4Anti_Si_Up_Trans_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--2278.23990513; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 I3_Si_Up_Trans_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1473.65646272; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 T4Syn_Si_Up_Trans_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--2278.23501686; Eh
thumbnail.jpeg7-Apr-2019/Epimerization_of_the_3R_S_center EpiT4_CisDD_to_TransDU_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--3863.79683004; Eh
thumbnail.jpeg7-Apr-2019/Epimerization_of_the_3R_S_center EpiI3_CisDD_to_TransDU_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1519.15691124; Eh
thumbnail.jpeg7-Apr-2019/Epimerization_of_the_3R_S_center EpiI1_CisDD_to_TransDU_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1098.97159709; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 I3_Si_Down_Trans_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1282.12279344; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 T4Anti_Si_Down_Trans_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--1858.05948149; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 T4Syn_Si_Down_Trans_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--1858.05659239; Eh
Results 151-160 of 194 (Search time: 0.001 seconds).