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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3och3 ch3och3-c6h5_6311+Gd_ch2cl2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-386.829415235; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3sh ch3sh-nhcho_6311+Gd_ch2cl2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-608.196664657; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3och3 ch3och3-f_6311+GdMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-255.093970584; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3oh ch3oh-cl_6311+GdMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-576.162540428; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3sh ch3sh-och2ch3_6311+Gd_ch2cl2Morán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-593.312703290; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3sh ch3sh-nch33_6311+Gd_ch2cl2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-613.273670161; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3oh ch3oh-sh_6311+GdMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-514.708587859; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3och3 ch3och3-cf3_6311+GdMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-492.907118268; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3och3 ch3och3-oh_6311+GdMorán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-231.005965969; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3sh ch3sh-oTs_6311+Gd_ch2cl2Morán, LucíaGaussian; 16; AM64L-G16RevA.03Geometry optimization MinimumRB3LYP6-311+G(D)-1333.85127921; Eh
Results 3621-3630 of 12842 (Search time: 0.004 seconds).