Browsing by Author Pérez-Soto, Raúl

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_NPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-559.632335083; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_N_NPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-773.545187223; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_N_N_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-850.030454675; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_N_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-636.108992967; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_N_W_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-712.593621195; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-422.195334037; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts A_W_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-498.672725819; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts I_NPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-697.073287438; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts I_N_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-773.554713027; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts I_N_W_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-850.037095890; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts I_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-559.639118313; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts I_W_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-636.118279666; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts I_W_W_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-712.599349142; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts Int_NPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-773.548127632; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts Int_N_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-850.028529639; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts Int_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-636.113822802; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts Int_W_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-712.598744597; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts N_NPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-427.816638070; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts N_N_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-504.298154258; Eh
thumbnail.jpeg24-Feb-2020/PaperStructures/Adducts N_WPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-290.385672764; Eh