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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Sep-20176minor_tbu_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureUwB97XDlanl2dz; 6-31+g(d)-4183.37587338; Eh
thumbnail.jpeg29-Sep-20172_tbu_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XDlanl2dz; 6-31+g(d)-2325.04668145; Eh
thumbnail.jpeg29-Sep-20175_d_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point Structure-lanl2dz; 6-31+g(d)-2450.24885820; Eh
thumbnail.jpeg16-Jul-2018OAcHFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XD6-311++g**-229.086275769; Eh
thumbnail.jpeg29-Sep-20177major_tbu_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point Structure-lanl2dz; 6-31+g(d)-3868.70255562; Eh
thumbnail.jpeg29-Sep-20176major_tbu_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureUwB97XDlanl2dz; 6-31+g(d)-4183.38024263; Eh
thumbnail.jpeg29-Sep-2017TSminor_e_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureUwB97XDlanl2dz; 6-31+g(d)-3541.76919073; Eh
thumbnail.jpeg29-Sep-20177minor_tbu_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XDlanl2dz; 6-31+g(d)-4183.24481518; Eh
thumbnail.jpeg29-Sep-20175_tbu_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRwB97XDlanl2dz; 6-31+g(d)-2764.74471620; Eh
thumbnail.jpeg29-Sep-2017TSmajor_d_solvFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureUwB97XDlanl2dz; 6-31+g(d)-4647.77621153; Eh
Results 41-50 of 5658 (Search time: 0.003 seconds).