Browsing by Author Mudarra, Ángel Luís

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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpegI-negaMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD-11.5726270541; Eh
thumbnail.jpegI1-AgMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-822.226609320; Eh
thumbnail.jpegI1-Ag-NBOMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-822.160623223; Eh
thumbnail.jpegI1-AuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-811.011314609; Eh
thumbnail.jpegI1-Au-NBOMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-810.946051184; Eh
thumbnail.jpegI1-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-872.633539905; Eh
thumbnail.jpegI1-Cu-NBOMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-872.562424067; Eh
thumbnail.jpegI1-ionpair-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-1086.73697061; Eh
thumbnail.jpegI11-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UM06SDD; 6-31+G(d,p)-872.449143083; Eh
thumbnail.jpegI12-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UM06SDD; 6-31+G(d,p)-546.333606506; Eh
thumbnail.jpegI12-MeMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-31G(d)-2233.91009738; Eh
thumbnail.jpegI13-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UM06SDD; 6-31+G(d,p)-783.090432082; Eh
thumbnail.jpegI14-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UM06SDD; 6-31+G(d,p)-884.049823702; Eh
thumbnail.jpegI15-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UM06SDD; 6-31+G(d,p)-557.963411864; Eh
thumbnail.jpegI16-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UM06SDD; 6-31+G(d,p)-794.750388488; Eh
thumbnail.jpegI2-AgMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-1065.07870124; Eh
thumbnail.jpegI2-AuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-1053.87961802; Eh
thumbnail.jpegI2-CuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-1115.49361201; Eh
thumbnail.jpegI3-AgMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-496.146618338; Eh
thumbnail.jpegI3-AuMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RM06SDD; 6-31+G(d,p)-484.916873065; Eh