Browsing by Author Mudarra, Ángel Luís

Jump to: 0-9 A B C D E F G H I J K L M N O P Q R S T U V W X Y Z
or enter first few letters:  
Showing results 41 to 60 of 207 < previous   next >
PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg/Hydrogen_substituent_(R=H) TS9-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-31G(d)-2194.51875261; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations 3I0ad-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UB3LYPLANL2DZ; 6-311++G(d,p)-2194.87027189; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations 3I1-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UB3LYPLANL2DZ; 6-311++G(d,p)-2194.92251890; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations 3I8-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UB3LYPLANL2DZ; 6-311++G(d,p)-2194.93742070; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I10-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.94597321; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I11-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.96091337; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I12-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2195.01606728; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I2-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.93039896; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I3-2-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.91614193; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I3-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.92067893; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I4-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.91729838; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I5-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.92110993; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I6-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.95559824; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I7-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.96206539; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations I9-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.93834582; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations TS0-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UB3LYPLANL2DZ; 6-311++G(d,p)-2194.86914256; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations TS1-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01UB3LYPLANL2DZ; 6-311++G(d,p)-2194.92039597; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations TS2-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.91200510; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations TS3-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.91422694; Eh
thumbnail.jpeg/Hydrogen_substituent_(R=H)/Single_Points_Calculations TS4-SP-HMudarra, Ángel LuísGaussian; 09; EM64L-G09RevD.01RB3LYPLANL2DZ; 6-311++G(d,p)-2194.91866430; Eh