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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	29-Sep-2017	2_Me	Fernández, Víctor	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	lanl2dz; 6-31+g(d)	-2354.69754347; Eh
	29-Sep-2017	TSPA	Fernández, Víctor	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	lanl2dz; 6-31+g(d)	-2856.21677656; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-2m-I2xm	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-2207.92994501; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-I5m-I7m	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-1976.14024707; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-4m-I4xm	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-1976.14790213; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-I7m-5m	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-1976.14368165; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-I2xm-7m	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-2207.89864081; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-I4m-I5m	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-1976.15000511; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-I4xm-5m	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-1976.11817871; Eh
	16-Jul-2018	/Ru-PMe-OAc-Cl TS-I1m-2m	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	sdd; 6-31+g*	-1899.57150345; Eh

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