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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 I3Anti_Si_Up_Trans_1VDW_complexFianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--2278.25452910; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 I4Anti_Si_Up_Trans_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--2278.26558687; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 scisECinnamaldehydeFianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--422.484068737; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 I1_Trans_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1473.63104135; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 I2_Cis_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1473.66082930; Eh
thumbnail.jpeg7-Apr-2019/Catalytic_cycle_1 I1_Cis_1Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1473.63619058; Eh
thumbnail.jpeg7-Apr-2019/Epimerization_of_the_3R_S_center EpiI2_CisDD_to_TransDU_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--3863.81826777; Eh
thumbnail.jpeg7-Apr-2019/Epimerization_of_the_3R_S_center EpiI3_CisDD_to_TransDU_4Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--1098.96905642; 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 EpiI3_CisDD_to_TransDU_3Fianchini, MauroGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRM062X--3863.80197292; Eh
Results 21-30 of 95 (Search time: 0.001 seconds).