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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 T3_Et3NHBF4_Cis_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--1998.79983013; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 T4Anti_Si_Down_Cis_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--1858.06597814; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 T4Syn_Si_Down_Cis_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--1858.05799025; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_4 T4Anti_Si_Up_Cis_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Single point TSRM062X--1858.06339271; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_3 T4Anti_Si_Down_Cis_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--4622.89948361; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_3 T4Syn_Si_Down_Cis_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization TSRM062X--4622.88830715; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_2 (3S,3aR)-FuranoneFianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--767.682290002; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_3 I3_Re_Down_Cis_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--4046.95871520; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_3 I3_Et3NHBF4_Cis_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--4763.66090623; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_3 stransEBromoCinnamaldehydeFianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--2995.77735579; Eh
Results 311-320 of 343 (Search time: 0.002 seconds).