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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations I3-2-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.26320274; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations 3I1-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.24800411; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations I11-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.29684717; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations I4-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.25993101; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me) TS9-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RB3LYP	LANL2DZ; 6-31G(d)	-2233.84245870; Eh
	17-Oct-2016	/Dimer/Al_H_I/Insertion/Int3 Int3	González Fabra, Joan	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB97D3	6-311G**	-2696.43234437; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations TS7-2-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.25613556; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations TS8-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.28445259; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations TS0-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.20685401; Eh
	19-Jul-2017	/Methyl_substituent_(R=Me)/Single_Point_Calculations TS1-SP-Me	Mudarra, Ángel Luís	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	LANL2DZ; 6-311++G(d,p)	-2234.24857073; Eh

Results 8971-8980 of 103542 (Search time: 0.007 seconds).